*HEADER    STRUCTURAL GENOMICS, UNKNOWN FUNCTION   10-FEB-03   1NXI              
*TITLE     SOLUTION STRUCTURE OF VIBRIO CHOLERAE PROTEIN VC0424                  
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CONSERVED HYPOTHETICAL PROTEIN VC0424;                     
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: VIBRIO CHOLERAE;                                
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 GENE: VC0424;                                                        
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: ROSETTA (LAMDADE3);                        
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET28B                                    
*KEYWDS    STRUCTURAL GENOMICS, AB SANDWICH, COG 3076, ATCC NO. 51394D,          
*KEYWDS   2 NESG TARGET OP3                                                      
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    T.A.RAMELOT, S.NI, S.GOLDSMITH-FISCHMAN, J.R.CORT, B.HONIG,           
*AUTHOR   2 M.A.KENNEDY                                                          
*REVDAT   1   01-JUL-03 1NXI    0                                                

! Restraint file for VC0424 from Vibrio cholerae

 remarks vc0424 hydrogen bond constraints             
assign (resid  11   and name O    )(resid  15   and name N    )     2.8 0.0 0.5
assign (resid  11   and name O    )(resid  15   and name HN   )     1.8 0.0 0.5
assign (resid  12   and name O    )(resid  16   and name N    )     2.8 0.0 0.5
assign (resid  12   and name O    )(resid  16   and name HN   )     1.8 0.0 0.5
assign (resid  13   and name O    )(resid  17   and name N    )     2.8 0.0 0.5
assign (resid  13   and name O    )(resid  17   and name HN   )     1.8 0.0 0.5
assign (resid  14   and name O    )(resid  18   and name N    )     2.8 0.0 0.5
assign (resid  14   and name O    )(resid  18   and name HN   )     1.8 0.0 0.5
assign (resid  15   and name O    )(resid  19   and name N    )     2.8 0.0 0.5
assign (resid  15   and name O    )(resid  19   and name HN   )     1.8 0.0 0.5
assign (resid  16   and name O    )(resid  20   and name N    )     2.8 0.0 0.5
assign (resid  16   and name O    )(resid  20   and name HN   )     1.8 0.0 0.5
assign (resid  17   and name O    )(resid  21   and name N    )     2.8 0.0 0.5
assign (resid  17   and name O    )(resid  21   and name HN   )     1.8 0.0 0.5
assign (resid  18   and name O    )(resid  22   and name N    )     2.8 0.0 0.5
assign (resid  18   and name O    )(resid  22   and name HN   )     1.8 0.0 0.5
assign (resid  19   and name O    )(resid  23   and name N    )     2.8 0.0 0.5
assign (resid  19   and name O    )(resid  23   and name HN   )     1.8 0.0 0.5
assign (resid  20   and name O    )(resid  24   and name N    )     2.8 0.0 0.5
assign (resid  20   and name O    )(resid  24   and name HN   )     1.8 0.0 0.5
assign (resid  21   and name O    )(resid  25   and name N    )     2.8 0.0 0.5
assign (resid  21   and name O    )(resid  25   and name HN   )     1.8 0.0 0.5
assign (resid  22   and name O    )(resid  26   and name N    )     2.8 0.0 0.5
assign (resid  22   and name O    )(resid  26   and name HN   )     1.8 0.0 0.5
assign (resid  23   and name O    )(resid  27   and name N    )     2.8 0.0 0.5
assign (resid  23   and name O    )(resid  27   and name HN   )     1.8 0.0 0.5
assign (resid  24   and name O    )(resid  28   and name N    )     2.8 0.0 0.5
assign (resid  24   and name O    )(resid  28   and name HN   )     1.8 0.0 0.5
assign (resid  25   and name O    )(resid  29   and name N    )     2.8 0.0 0.5
assign (resid  25   and name O    )(resid  29   and name HN   )     1.8 0.0 0.5
assign (resid  26   and name O    )(resid  30   and name N    )     2.8 0.0 0.5
assign (resid  26   and name O    )(resid  30   and name HN   )     1.8 0.0 0.5
assign (resid  27   and name O    )(resid  31   and name N    )     2.8 0.0 0.5
assign (resid  27   and name O    )(resid  31   and name HN   )     1.8 0.0 0.5
assign (resid  34   and name O    )(resid  37   and name N    )     2.8 0.0 0.5
assign (resid  34   and name O    )(resid  37   and name HN   )     1.8 0.0 0.5
assign (resid  39   and name O    )(resid  90   and name N    )     2.8 0.0 0.5
assign (resid  39   and name O    )(resid  90   and name HN   )     1.8 0.0 0.5
assign (resid  41   and name O    )(resid  88   and name N    )     2.8 0.0 0.5
assign (resid  41   and name O    )(resid  88   and name HN   )     1.8 0.0 0.5
assign (resid  42   and name O    )(resid 119   and name N    )     2.8 0.0 0.5
assign (resid  42   and name O    )(resid 119   and name HN   )     1.8 0.0 0.5
assign (resid  43   and name O    )(resid  86   and name N    )     2.8 0.0 0.5
assign (resid  43   and name O    )(resid  86   and name HN   )     1.8 0.0 0.5
assign (resid  45   and name O    )(resid  84   and name N    )     2.8 0.0 0.5
assign (resid  45   and name O    )(resid  84   and name HN   )     1.8 0.0 0.5
assign (resid  49   and name O    )(resid  53   and name N    )     2.8 0.0 0.5
assign (resid  49   and name O    )(resid  53   and name HN   )     1.8 0.0 0.5
assign (resid  50   and name O    )(resid  54   and name N    )     2.8 0.0 0.5
assign (resid  50   and name O    )(resid  54   and name HN   )     1.8 0.0 0.5
assign (resid  51   and name O    )(resid  55   and name N    )     2.8 0.0 0.5
assign (resid  51   and name O    )(resid  55   and name HN   )     1.8 0.0 0.5
assign (resid  52   and name O    )(resid  56   and name N    )     2.8 0.0 0.5
assign (resid  52   and name O    )(resid  56   and name HN   )     1.8 0.0 0.5
assign (resid  53   and name O    )(resid  57   and name N    )     2.8 0.0 0.5
assign (resid  53   and name O    )(resid  57   and name HN   )     1.8 0.0 0.5
assign (resid  54   and name O    )(resid  58   and name N    )     2.8 0.0 0.5
assign (resid  54   and name O    )(resid  58   and name HN   )     1.8 0.0 0.5
assign (resid  55   and name O    )(resid  59   and name N    )     2.8 0.0 0.5
assign (resid  55   and name O    )(resid  59   and name HN   )     1.8 0.0 0.5
assign (resid  56   and name O    )(resid  60   and name N    )     2.8 0.0 0.5
assign (resid  56   and name O    )(resid  60   and name HN   )     1.8 0.0 0.5
assign (resid  57   and name O    )(resid  61   and name N    )     2.8 0.0 0.5
assign (resid  57   and name O    )(resid  61   and name HN   )     1.8 0.0 0.5
assign (resid  58   and name O    )(resid  62   and name N    )     2.8 0.0 0.5
assign (resid  58   and name O    )(resid  62   and name HN   )     1.8 0.0 0.5
assign (resid  59   and name O    )(resid  63   and name N    )     2.8 0.0 0.5
assign (resid  59   and name O    )(resid  63   and name HN   )     1.8 0.0 0.5
assign (resid  66   and name O    )(resid  87   and name N    )     2.8 0.0 0.5
assign (resid  66   and name O    )(resid  87   and name HN   )     1.8 0.0 0.5
assign (resid  68   and name O    )(resid  85   and name N    )     2.8 0.0 0.5
assign (resid  68   and name O    )(resid  85   and name HN   )     1.8 0.0 0.5
assign (resid  82   and name O    )(resid  47   and name N    )     2.8 0.0 0.5
assign (resid  82   and name O    )(resid  47   and name HN   )     1.8 0.0 0.5
assign (resid  84   and name O    )(resid  45   and name N    )     2.8 0.0 0.5
assign (resid  84   and name O    )(resid  45   and name HN   )     1.8 0.0 0.5
assign (resid  86   and name O    )(resid  43   and name N    )     2.8 0.0 0.5
assign (resid  86   and name O    )(resid  43   and name HN   )     1.8 0.0 0.5
assign (resid  88   and name O    )(resid  41   and name N    )     2.8 0.0 0.5
assign (resid  88   and name O    )(resid  41   and name HN   )     1.8 0.0 0.5
assign (resid  90   and name O    )(resid  39   and name N    )     2.8 0.0 0.5
assign (resid  90   and name O    )(resid  39   and name HN   )     1.8 0.0 0.5
assign (resid  93   and name O    )(resid  97   and name N    )     2.8 0.0 0.5
assign (resid  93   and name O    )(resid  97   and name HN   )     1.8 0.0 0.5
assign (resid  94   and name O    )(resid  98   and name N    )     2.8 0.0 0.5
assign (resid  94   and name O    )(resid  98   and name HN   )     1.8 0.0 0.5
assign (resid  95   and name O    )(resid  99   and name N    )     2.8 0.0 0.5
assign (resid  95   and name O    )(resid  99   and name HN   )     1.8 0.0 0.5
assign (resid  96   and name O    )(resid 100   and name N    )     2.8 0.0 0.5
assign (resid  96   and name O    )(resid 100   and name HN   )     1.8 0.0 0.5
assign (resid  97   and name O    )(resid 101   and name N    )     2.8 0.0 0.5
assign (resid  97   and name O    )(resid 101   and name HN   )     1.8 0.0 0.5
assign (resid  98   and name O    )(resid 102   and name N    )     2.8 0.0 0.5
assign (resid  98   and name O    )(resid 102   and name HN   )     1.8 0.0 0.5
assign (resid  99   and name O    )(resid 103   and name N    )     2.8 0.0 0.5
assign (resid  99   and name O    )(resid 103   and name HN   )     1.8 0.0 0.5
assign (resid 100   and name O    )(resid 104   and name N    )     2.8 0.0 0.5
assign (resid 100   and name O    )(resid 104   and name HN   )     1.8 0.0 0.5
assign (resid 101   and name O    )(resid 105   and name N    )     2.8 0.0 0.5
assign (resid 101   and name O    )(resid 105   and name HN   )     1.8 0.0 0.5
assign (resid 102   and name O    )(resid 106   and name N    )     2.8 0.0 0.5
assign (resid 102   and name O    )(resid 106   and name HN   )     1.8 0.0 0.5
assign (resid 103   and name O    )(resid 107   and name N    )     2.8 0.0 0.5
assign (resid 103   and name O    )(resid 107   and name HN   )     1.8 0.0 0.5
assign (resid 104   and name O    )(resid 108   and name N    )     2.8 0.0 0.5
assign (resid 104   and name O    )(resid 108   and name HN   )     1.8 0.0 0.5
assign (resid 105   and name O    )(resid 109   and name N    )     2.8 0.0 0.5
assign (resid 105   and name O    )(resid 109   and name HN   )     1.8 0.0 0.5
assign (resid 106   and name O    )(resid 110   and name N    )     2.8 0.0 0.5
assign (resid 106   and name O    )(resid 110   and name HN   )     1.8 0.0 0.5
assign (resid 107   and name O    )(resid 111   and name N    )     2.8 0.0 0.5
assign (resid 107   and name O    )(resid 111   and name HN   )     1.8 0.0 0.5
assign (resid 117   and name O    )(resid  44   and name N    )     2.8 0.0 0.5
assign (resid 117   and name O    )(resid  44   and name HN   )     1.8 0.0 0.5
assign (resid 119   and name O    )(resid  42   and name N    )     2.8 0.0 0.5
assign (resid 119   and name O    )(resid  42   and name HN   )     1.8 0.0 0.5 
 remarks vc0424 NOE constraints             

 remarks Ni-Ni+1               
assign (resid   8 and name HN )(resid   9 and name HN ) 1.8 0.0 3.2   
assign (resid  10 and name HN )(resid  11 and name HN ) 1.8 0.0 1.7   
assign (resid  11 and name HN )(resid  12 and name HN ) 1.8 0.0 1.7   
assign (resid  12 and name HN )(resid  13 and name HN ) 1.8 0.0 1.7   
assign (resid  13 and name HN )(resid  14 and name HN ) 1.8 0.0 1.7   
assign (resid  14 and name HN )(resid  15 and name HN ) 1.8 0.0 1.7   
assign (resid  15 and name HN )(resid  16 and name HN ) 1.8 0.0 1.7   
assign (resid  16 and name HN )(resid  17 and name HN ) 1.8 0.0 1.7   
assign (resid  18 and name HN )(resid  19 and name HN ) 1.8 0.0 1.7   
assign (resid  19 and name HN )(resid  20 and name HN ) 1.8 0.0 1.7   
assign (resid  20 and name HN )(resid  21 and name HN ) 1.8 0.0 1.7   
assign (resid  21 and name HN )(resid  22 and name HN ) 1.8 0.0 1.7   
assign (resid  22 and name HN )(resid  23 and name HN ) 1.8 0.0 1.7   
assign (resid  23 and name HN )(resid  24 and name HN ) 1.8 0.0 1.7   
assign (resid  24 and name HN )(resid  25 and name HN ) 1.8 0.0 1.7   
assign (resid  25 and name HN )(resid  26 and name HN ) 1.8 0.0 1.7   
assign (resid  26 and name HN )(resid  27 and name HN ) 1.8 0.0 1.7   
assign (resid  27 and name HN )(resid  28 and name HN ) 1.8 0.0 1.7   
assign (resid  28 and name HN )(resid  29 and name HN ) 1.8 0.0 1.7   
assign (resid  29 and name HN )(resid  30 and name HN ) 1.8 0.0 1.7   
assign (resid  30 and name HN )(resid  31 and name HN ) 1.8 0.0 1.7   
assign (resid  31 and name HN )(resid  32 and name HN ) 1.8 0.0 1.7   
assign (resid  32 and name HN )(resid  33 and name HN ) 1.8 0.0 1.7   
assign (resid  36 and name HN )(resid  37 and name HN ) 1.8 0.0 1.0   
assign (resid  37 and name HN )(resid  38 and name HN ) 1.8 0.0 1.7   
assign (resid  38 and name HN )(resid  39 and name HN ) 1.8 0.0 3.2   
assign (resid  39 and name HN )(resid  40 and name HN ) 1.8 0.0 3.2   
assign (resid  43 and name HN )(resid  44 and name HN ) 1.8 0.0 3.2   
assign (resid  44 and name HN )(resid  45 and name HN ) 1.8 0.0 3.2   
assign (resid  45 and name HN )(resid  46 and name HN ) 1.8 0.0 3.2   
assign (resid  46 and name HN )(resid  47 and name HN ) 1.8 0.0 3.2   
assign (resid  48 and name HN )(resid  49 and name HN ) 1.8 0.0 3.2   
assign (resid  50 and name HN )(resid  51 and name HN ) 1.8 0.0 1.7   
assign (resid  51 and name HN )(resid  52 and name HN ) 1.8 0.0 1.7   
assign (resid  52 and name HN )(resid  53 and name HN ) 1.8 0.0 1.7   
assign (resid  53 and name HN )(resid  54 and name HN ) 1.8 0.0 1.7   
assign (resid  54 and name HN )(resid  55 and name HN ) 1.8 0.0 1.7   
assign (resid  55 and name HN )(resid  56 and name HN ) 1.8 0.0 1.7   
assign (resid  56 and name HN )(resid  57 and name HN ) 1.8 0.0 1.7   
assign (resid  57 and name HN )(resid  58 and name HN ) 1.8 0.0 1.7   
assign (resid  58 and name HN )(resid  59 and name HN ) 1.8 0.0 1.7   
assign (resid  59 and name HN )(resid  60 and name HN ) 1.8 0.0 1.7   
assign (resid  60 and name HN )(resid  61 and name HN ) 1.8 0.0 1.7   
assign (resid  61 and name HN )(resid  62 and name HN ) 1.8 0.0 1.7   
assign (resid  62 and name HN )(resid  63 and name HN ) 1.8 0.0 1.7   
assign (resid  65 and name HN )(resid  66 and name HN ) 1.8 0.0 3.2   
assign (resid  66 and name HN )(resid  67 and name HN ) 1.8 0.0 3.2   
assign (resid  67 and name HN )(resid  68 and name HN ) 1.8 0.0 3.2   
assign (resid  68 and name HN )(resid  69 and name HN ) 1.8 0.0 3.2   
assign (resid  69 and name HN )(resid  70 and name HN ) 1.8 0.0 3.2   
assign (resid  70 and name HN )(resid  71 and name HN ) 1.8 0.0 3.2   
assign (resid  72 and name HN )(resid  73 and name HN ) 1.8 0.0 3.2   
assign (resid  73 and name HN )(resid  74 and name HN ) 1.8 0.0 3.2   
assign (resid  75 and name HN )(resid  76 and name HN ) 1.8 0.0 3.2   
assign (resid  76 and name HN )(resid  77 and name HN ) 1.8 0.0 3.2   
assign (resid  78 and name HN )(resid  79 and name HN ) 1.8 0.0 1.7   
assign (resid  82 and name HN )(resid  83 and name HN ) 1.8 0.0 3.2   
assign (resid  84 and name HN )(resid  85 and name HN ) 1.8 0.0 3.2   
assign (resid  85 and name HN )(resid  86 and name HN ) 1.8 0.0 3.2   
assign (resid  86 and name HN )(resid  87 and name HN ) 1.8 0.0 3.2   
assign (resid  87 and name HN )(resid  88 and name HN ) 1.8 0.0 3.2   
assign (resid  88 and name HN )(resid  89 and name HN ) 1.8 0.0 3.2   
assign (resid  89 and name HN )(resid  90 and name HN ) 1.8 0.0 3.2   
assign (resid  90 and name HN )(resid  91 and name HN ) 1.8 0.0 3.2   
assign (resid  91 and name HN )(resid  92 and name HN ) 1.8 0.0 3.2   
assign (resid  92 and name HN )(resid  93 and name HN ) 1.8 0.0 3.2   
assign (resid  93 and name HN )(resid  94 and name HN ) 1.8 0.0 3.2   
assign (resid  94 and name HN )(resid  95 and name HN ) 1.8 0.0 1.7   
assign (resid  95 and name HN )(resid  96 and name HN ) 1.8 0.0 1.7   
assign (resid  96 and name HN )(resid  97 and name HN ) 1.8 0.0 1.7   
assign (resid  97 and name HN )(resid  98 and name HN ) 1.8 0.0 1.7   
assign (resid  98 and name HN )(resid  99 and name HN ) 1.8 0.0 1.7   
assign (resid  99 and name HN )(resid 100 and name HN ) 1.8 0.0 1.7   
assign (resid 100 and name HN )(resid 101 and name HN ) 1.8 0.0 1.7   
assign (resid 101 and name HN )(resid 102 and name HN ) 1.8 0.0 1.7   
assign (resid 102 and name HN )(resid 103 and name HN ) 1.8 0.0 1.7   
assign (resid 103 and name HN )(resid 104 and name HN ) 1.8 0.0 1.7   
assign (resid 104 and name HN )(resid 105 and name HN ) 1.8 0.0 1.7   
assign (resid 105 and name HN )(resid 106 and name HN ) 1.8 0.0 1.7   
assign (resid 106 and name HN )(resid 107 and name HN ) 1.8 0.0 1.7   
assign (resid 107 and name HN )(resid 108 and name HN ) 1.8 0.0 1.7   
assign (resid 108 and name HN )(resid 109 and name HN ) 1.8 0.0 1.7   
assign (resid 112 and name HN )(resid 113 and name HN ) 1.8 0.0 1.7   
assign (resid 113 and name HN )(resid 114 and name HN ) 1.8 0.0 3.2   
assign (resid 115 and name HN )(resid 116 and name HN ) 1.8 0.0 3.2   
assign (resid 116 and name HN )(resid 117 and name HN ) 1.8 0.0 1.7   
assign (resid 117 and name HN )(resid 118 and name HN ) 1.8 0.0 1.7   
assign (resid 118 and name HN )(resid 119 and name HN ) 1.8 0.0 3.2   
assign (resid 119 and name HN )(resid 120 and name HN ) 1.8 0.0 3.2   
assign (resid 120 and name HN )(resid 121 and name HN ) 1.8 0.0 3.2   
assign (resid 121 and name HN )(resid 122 and name HN ) 1.8 0.0 3.2   
assign (resid 123 and name HN )(resid 124 and name HN ) 1.8 0.0 3.2   
assign (resid 124 and name HN )(resid 125 and name HN ) 1.8 0.0 3.2   
assign (resid 125 and name HN )(resid 126 and name HN ) 1.8 0.0 3.2   

 remarks Ni-Ni+2               
assign (resid  14 and name HN )(resid  16 and name HN ) 1.8 0.0 3.2   
assign (resid  15 and name HN )(resid  17 and name HN ) 1.8 0.0 3.2   
assign (resid  16 and name HN )(resid  18 and name HN ) 1.8 0.0 3.2   
assign (resid  18 and name HN )(resid  20 and name HN ) 1.8 0.0 3.2   
assign (resid  19 and name HN )(resid  21 and name HN ) 1.8 0.0 3.2   
assign (resid  20 and name HN )(resid  22 and name HN ) 1.8 0.0 3.2 
assign (resid  21 and name HN )(resid  23 and name HN ) 1.8 0.0 3.2 
assign (resid  22 and name HN )(resid  24 and name HN ) 1.8 0.0 3.2   
assign (resid  23 and name HN )(resid  25 and name HN ) 1.8 0.0 3.2 
assign (resid  24 and name HN )(resid  26 and name HN ) 1.8 0.0 3.2   
assign (resid  27 and name HN )(resid  29 and name HN ) 1.8 0.0 3.2   
assign (resid  28 and name HN )(resid  30 and name HN ) 1.8 0.0 3.2   
assign (resid  29 and name HN )(resid  31 and name HN ) 1.8 0.0 3.2   
assign (resid  30 and name HN )(resid  32 and name HN ) 1.8 0.0 3.2   
assign (resid  31 and name HN )(resid  33 and name HN ) 1.8 0.0 3.2   
assign (resid  51 and name HN )(resid  53 and name HN ) 1.8 0.0 3.2   
assign (resid  52 and name HN )(resid  54 and name HN ) 1.8 0.0 3.2   
assign (resid  54 and name HN )(resid  56 and name HN ) 1.8 0.0 3.2   
assign (resid  55 and name HN )(resid  57 and name HN ) 1.8 0.0 3.2   
assign (resid  57 and name HN )(resid  59 and name HN ) 1.8 0.0 3.2   
assign (resid  58 and name HN )(resid  60 and name HN ) 1.8 0.0 3.2   
assign (resid  59 and name HN )(resid  61 and name HN ) 1.8 0.0 3.2   
assign (resid  60 and name HN )(resid  62 and name HN ) 1.8 0.0 3.2   
assign (resid  61 and name HN )(resid  63 and name HN ) 1.8 0.0 3.2   
assign (resid  62 and name HN )(resid  64 and name HN ) 1.8 0.0 3.2   
assign (resid  75 and name HN )(resid  77 and name HN ) 1.8 0.0 3.2   
assign (resid  76 and name HN )(resid  78 and name HN ) 1.8 0.0 3.2   
assign (resid  77 and name HN )(resid  79 and name HN ) 1.8 0.0 3.2   
assign (resid  94 and name HN )(resid  96 and name HN ) 1.8 0.0 3.2   
assign (resid  96 and name HN )(resid  98 and name HN ) 1.8 0.0 2.2   
assign (resid  97 and name HN )(resid  99 and name HN ) 1.8 0.0 3.2   
assign (resid  99 and name HN )(resid 101 and name HN ) 1.8 0.0 3.2   
assign (resid 100 and name HN )(resid 102 and name HN ) 1.8 0.0 3.2   
assign (resid 102 and name HN )(resid 104 and name HN ) 1.8 0.0 3.2   
assign (resid 103 and name HN )(resid 105 and name HN ) 1.8 0.0 3.2   
assign (resid 105 and name HN )(resid 107 and name HN ) 1.8 0.0 3.2   
assign (resid 106 and name HN )(resid 108 and name HN ) 1.8 0.0 3.2   
assign (resid 108 and name HN )(resid 110 and name HN ) 1.8 0.0 3.2   
assign (resid 111 and name HN )(resid 113 and name HN ) 1.8 0.0 3.2   

 remarks Ni-Ni+3               
assign (resid   9 and name HN )(resid  12 and name HN ) 1.8 0.0 3.2   
assign (resid  19 and name HN )(resid  22 and name HN ) 1.8 0.0 3.2 
assign (resid  20 and name HN )(resid  23 and name HN ) 1.8 0.0 3.2   
assign (resid  23 and name HN )(resid  26 and name HN ) 1.8 0.0 3.2 
assign (resid  26 and name HN )(resid  29 and name HN ) 1.8 0.0 3.2   
assign (resid  27 and name HN )(resid  30 and name HN ) 1.8 0.0 3.2   
assign (resid  28 and name HN )(resid  31 and name HN ) 1.8 0.0 3.2   
assign (resid  29 and name HN )(resid  32 and name HN ) 1.8 0.0 3.2   
assign (resid  49 and name HN )(resid  52 and name HN ) 1.8 0.0 3.2   
assign (resid  60 and name HN )(resid  63 and name HN ) 1.8 0.0 3.2  
assign (resid  75 and name HN )(resid  78 and name HN ) 1.8 0.0 3.2   
assign (resid  99 and name HN )(resid 102 and name HN ) 1.8 0.0 3.2   

 remarks Ni-Ni+4               
assign (resid  75 and name HN )(resid  79 and name HN ) 1.8 0.0 2.2   

 remarks aiNi+1               
assign (resid   4 and name HA  )(resid   5 and name HN ) 1.8 0.0 2.2   
assign (resid   7 and name HA  )(resid   8 and name HN ) 1.8 0.0 1.0   
assign (resid  13 and name HA  )(resid  14 and name HN ) 1.8 0.0 2.2   
assign (resid  14 and name HA  )(resid  15 and name HN ) 1.8 0.0 2.2   
assign (resid  15 and name HA  )(resid  16 and name HN ) 1.8 0.0 2.2   
assign (resid  35 and name HA  )(resid  36 and name HN ) 1.8 0.0 2.2   
assign (resid  36 and name HA  )(resid  37 and name HN ) 1.8 0.0 2.2   
assign (resid  39 and name HA  )(resid  40 and name HN ) 1.8 0.0 1.0   
assign (resid  40 and name HA  )(resid  41 and name HN ) 1.8 0.0 1.0   
assign (resid  41 and name HA  )(resid  42 and name HN ) 1.8 0.0 1.0   
assign (resid  42 and name HA  )(resid  43 and name HN ) 1.8 0.0 1.0   
assign (resid  43 and name HA  )(resid  44 and name HN ) 1.8 0.0 1.0   
assign (resid  45 and name HA  )(resid  46 and name HN ) 1.8 0.0 1.0   
assign (resid  46 and name HA  )(resid  47 and name HN ) 1.8 0.0 1.0   
assign (resid  47 and name HA  )(resid  48 and name HN ) 1.8 0.0 1.0   
assign (resid  48 and name HA  )(resid  49 and name HN ) 1.8 0.0 2.2   
assign (resid  49 and name HA  )(resid  50 and name HN ) 1.8 0.0 1.0   
assign (resid  50 and name HA  )(resid  51 and name HN ) 1.8 0.0 2.2   
assign (resid  51 and name HA  )(resid  52 and name HN ) 1.8 0.0 2.2   
assign (resid  52 and name HA  )(resid  53 and name HN ) 1.8 0.0 2.2   
assign (resid  53 and name HA  )(resid  54 and name HN ) 1.8 0.0 2.2   
assign (resid  55 and name HA  )(resid  56 and name HN ) 1.8 0.0 2.2   
assign (resid  56 and name HA  )(resid  57 and name HN ) 1.8 0.0 2.2   
assign (resid  57 and name HA  )(resid  58 and name HN ) 1.8 0.0 2.2   
assign (resid  58 and name HA  )(resid  59 and name HN ) 1.8 0.0 2.2   
assign (resid  60 and name HA  )(resid  61 and name HN ) 1.8 0.0 2.2   
assign (resid  61 and name HA  )(resid  62 and name HN ) 1.8 0.0 2.2   
assign (resid  62 and name HA  )(resid  63 and name HN ) 1.8 0.0 2.2   
assign (resid  63 and name HA  )(resid  64 and name HN ) 1.8 0.0 2.2   
assign (resid  64 and name HA* )(resid  65 and name HN ) 1.8 0.0 3.2   
assign (resid  65 and name HA  )(resid  66 and name HN ) 1.8 0.0 1.0   
assign (resid  66 and name HA  )(resid  67 and name HN ) 1.8 0.0 1.0   
assign (resid  67 and name HA  )(resid  68 and name HN ) 1.8 0.0 1.0   
assign (resid  68 and name HA  )(resid  69 and name HN ) 1.8 0.0 2.2   
assign (resid  69 and name HA  )(resid  70 and name HN ) 1.8 0.0 1.0   
assign (resid  70 and name HA  )(resid  71 and name HN ) 1.8 0.0 1.0   
assign (resid  71 and name HA  )(resid  72 and name HN ) 1.8 0.0 1.0   
assign (resid  72 and name HA  )(resid  73 and name HN ) 1.8 0.0 2.2   
assign (resid  73 and name HA  )(resid  74 and name HN ) 1.8 0.0 2.2   
assign (resid  74 and name HA  )(resid  75 and name HN ) 1.8 0.0 1.0   
assign (resid  75 and name HA  )(resid  76 and name HN ) 1.8 0.0 2.2   
assign (resid  76 and name HA  )(resid  77 and name HN ) 1.8 0.0 2.2   
assign (resid  77 and name HA  )(resid  78 and name HN ) 1.8 0.0 2.2   
assign (resid  78 and name HA* )(resid  79 and name HN ) 1.8 0.0 3.2   
assign (resid  79 and name HA  )(resid  80 and name HN ) 1.8 0.0 2.2   
assign (resid  80 and name HA  )(resid  81 and name HN ) 1.8 0.0 2.2   
assign (resid  81 and name HA  )(resid  82 and name HN ) 1.8 0.0 1.0   
assign (resid  82 and name HA  )(resid  83 and name HN ) 1.8 0.0 1.0   
assign (resid  83 and name HA  )(resid  84 and name HN ) 1.8 0.0 1.0   
assign (resid  84 and name HA  )(resid  85 and name HN ) 1.8 0.0 1.0   
assign (resid  85 and name HA  )(resid  86 and name HN ) 1.8 0.0 1.0   
assign (resid  86 and name HA  )(resid  87 and name HN ) 1.8 0.0 1.0   
assign (resid  87 and name HA  )(resid  88 and name HN ) 1.8 0.0 1.0   
assign (resid  88 and name HA  )(resid  89 and name HN ) 1.8 0.0 1.0   
assign (resid  89 and name HA  )(resid  90 and name HN ) 1.8 0.0 1.0   
assign (resid  90 and name HA  )(resid  91 and name HN ) 1.8 0.0 1.0   
assign (resid  91 and name HA  )(resid  92 and name HN ) 1.8 0.0 1.0   
assign (resid  92 and name HA  )(resid  93 and name HN ) 1.8 0.0 1.0   
assign (resid  94 and name HA  )(resid  95 and name HN ) 1.8 0.0 2.2   
assign (resid  95 and name HA  )(resid  96 and name HN ) 1.8 0.0 2.2  
assign (resid  96 and name HA  )(resid  97 and name HN ) 1.8 0.0 2.2   
assign (resid  97 and name HA  )(resid  98 and name HN ) 1.8 0.0 2.2   
assign (resid  98 and name HA  )(resid  99 and name HN ) 1.8 0.0 2.2   
assign (resid  99 and name HA  )(resid 100 and name HN ) 1.8 0.0 2.2   
assign (resid 100 and name HA  )(resid 101 and name HN ) 1.8 0.0 2.2   
assign (resid 101 and name HA  )(resid 102 and name HN ) 1.8 0.0 2.2   
assign (resid 102 and name HA  )(resid 103 and name HN ) 1.8 0.0 2.2   
assign (resid 104 and name HA  )(resid 105 and name HN ) 1.8 0.0 2.2   
assign (resid 105 and name HA  )(resid 106 and name HN ) 1.8 0.0 3.2   
assign (resid 106 and name HA  )(resid 107 and name HN ) 1.8 0.0 2.2   
assign (resid 107 and name HA  )(resid 108 and name HN ) 1.8 0.0 2.2   
assign (resid 108 and name HA  )(resid 109 and name HN ) 1.8 0.0 3.2   
assign (resid 109 and name HA  )(resid 110 and name HN ) 1.8 0.0 2.2   
assign (resid 110 and name HA  )(resid 111 and name HN ) 1.8 0.0 2.2   
assign (resid 111 and name HA  )(resid 112 and name HN ) 1.8 0.0 2.2   
assign (resid 112 and name HA  )(resid 113 and name HN ) 1.8 0.0 2.2   
assign (resid 113 and name HA  )(resid 114 and name HN ) 1.8 0.0 1.0   
assign (resid 114 and name HA  )(resid 115 and name HN ) 1.8 0.0 1.0   
assign (resid 115 and name HA  )(resid 116 and name HN ) 1.8 0.0 1.0   
assign (resid 116 and name HA  )(resid 117 and name HN ) 1.8 0.0 2.2   
assign (resid 117 and name HA* )(resid 118 and name HN ) 1.8 0.0 2.0   
assign (resid 118 and name HA  )(resid 119 and name HN ) 1.8 0.0 1.0   
assign (resid 119 and name HA* )(resid 120 and name HN ) 1.8 0.0 2.0   
assign (resid 120 and name HA  )(resid 121 and name HN ) 1.8 0.0 1.0   
assign (resid 121 and name HA  )(resid 122 and name HN ) 1.8 0.0 1.0   
assign (resid 122 and name HA  )(resid 123 and name HN ) 1.8 0.0 1.0   
assign (resid 123 and name HA  )(resid 124 and name HN ) 1.8 0.0 1.0   
assign (resid 124 and name HA* )(resid 125 and name HN ) 1.8 0.0 2.0   
assign (resid 125 and name HA  )(resid 126 and name HN ) 1.8 0.0 1.0   
assign (resid 126 and name HA  )(resid 127 and name HN ) 1.8 0.0 3.2   

 remarks aiNi-1               
assign (resid  31 and name HN  )(resid  32 and name HA* ) 1.8 0.0 4.2   

 remarks ai-di+1, Ni-di+1, Ni-Di-1 (proline)            
assign (resid  35 and name HD* )(resid  36 and name HN ) 1.8 0.0 1.7   

 remarks aiNi+2               
assign (resid   9 and name HA   )(resid  11 and name HN   ) 1.8 0.0 2.2   
assign (resid  29 and name HA   )(resid  31 and name HN   ) 1.8 0.0 3.2   
assign (resid  30 and name HA   )(resid  32 and name HN   ) 1.8 0.0 3.2   
assign (resid  31 and name HA   )(resid  33 and name HN   ) 1.8 0.0 3.2   
assign (resid  35 and name HA   )(resid  37 and name HN   ) 1.8 0.0 3.2   
assign (resid  49 and name HA   )(resid  51 and name HN   ) 1.8 0.0 2.2   
assign (resid  51 and name HA   )(resid  53 and name HN   ) 1.8 0.0 3.2   
assign (resid  56 and name HA   )(resid  58 and name HN   ) 1.8 0.0 3.2   
assign (resid  57 and name HA   )(resid  59 and name HN   ) 1.8 0.0 3.2   
assign (resid  61 and name HA   )(resid  63 and name HN   ) 1.8 0.0 3.2   
assign (resid  62 and name HA   )(resid  64 and name HN   ) 1.8 0.0 3.2   
assign (resid  75 and name HA   )(resid  77 and name HN   ) 1.8 0.0 3.2   
assign (resid  76 and name HA   )(resid  78 and name HN   ) 1.8 0.0 3.2   
assign (resid  97 and name HA   )(resid  99 and name HN   ) 1.8 0.0 3.2   
assign (resid 105 and name HA   )(resid 107 and name HN   ) 1.8 0.0 3.2   
assign (resid 109 and name HA   )(resid 111 and name HN   ) 1.8 0.0 2.2   
assign (resid 115 and name HA   )(resid 117 and name HN   ) 1.8 0.0 3.2   

 remarks aiNi+3               
assign (resid   9 and name HA )(resid  12 and name HN ) 1.8 0.0 3.2   
assign (resid  10 and name HA )(resid  13 and name HN ) 1.8 0.0 2.2   
assign (resid  11 and name HA )(resid  14 and name HN ) 1.8 0.0 2.2   
assign (resid  12 and name HA )(resid  15 and name HN ) 1.8 0.0 2.2   
assign (resid  13 and name HA )(resid  16 and name HN ) 1.8 0.0 2.2   
assign (resid  14 and name HA )(resid  17 and name HN ) 1.8 0.0 3.2   
assign (resid  15 and name HA )(resid  18 and name HN ) 1.8 0.0 2.2   
assign (resid  16 and name HA )(resid  19 and name HN ) 1.8 0.0 2.2   
assign (resid  18 and name HA )(resid  21 and name HN ) 1.8 0.0 3.2   
assign (resid  19 and name HA )(resid  22 and name HN ) 1.8 0.0 2.2   
assign (resid  20 and name HA )(resid  23 and name HN ) 1.8 0.0 2.2   
assign (resid  21 and name HA )(resid  24 and name HN ) 1.8 0.0 3.2  
assign (resid  22 and name HA )(resid  25 and name HN ) 1.8 0.0 2.2   
assign (resid  23 and name HA )(resid  26 and name HN ) 1.8 0.0 2.2   
assign (resid  24 and name HA )(resid  27 and name HN ) 1.8 0.0 2.2   
assign (resid  25 and name HA )(resid  28 and name HN ) 1.8 0.0 2.2   
assign (resid  29 and name HA )(resid  32 and name HN ) 1.8 0.0 3.2  
assign (resid  50 and name HA )(resid  53 and name HN ) 1.8 0.0 3.2   
assign (resid  51 and name HA )(resid  54 and name HN ) 1.8 0.0 2.2   
assign (resid  52 and name HA )(resid  55 and name HN ) 1.8 0.0 3.2   
assign (resid  53 and name HA )(resid  56 and name HN ) 1.8 0.0 2.2   
assign (resid  54 and name HA )(resid  57 and name HN ) 1.8 0.0 2.2   
assign (resid  55 and name HA )(resid  58 and name HN ) 1.8 0.0 3.2   
assign (resid  56 and name HA )(resid  59 and name HN ) 1.8 0.0 2.2   
assign (resid  57 and name HA )(resid  60 and name HN ) 1.8 0.0 2.2   
assign (resid  58 and name HA )(resid  61 and name HN ) 1.8 0.0 2.2   
assign (resid  59 and name HA )(resid  62 and name HN ) 1.8 0.0 2.2   
assign (resid  60 and name HA )(resid  63 and name HN ) 1.8 0.0 2.2   
assign (resid  61 and name HA )(resid  64 and name HN ) 1.8 0.0 3.2   
assign (resid  94 and name HA )(resid  97 and name HN ) 1.8 0.0 2.2   
assign (resid  95 and name HA )(resid  98 and name HN ) 1.8 0.0 2.2   
assign (resid  97 and name HA )(resid 100 and name HN ) 1.8 0.0 2.2   
assign (resid  98 and name HA )(resid 101 and name HN ) 1.8 0.0 2.2   
assign (resid  99 and name HA )(resid 102 and name HN ) 1.8 0.0 2.2   
assign (resid 101 and name HA )(resid 104 and name HN ) 1.8 0.0 2.2   
assign (resid 102 and name HA )(resid 105 and name HN ) 1.8 0.0 2.2   
assign (resid 103 and name HA )(resid 106 and name HN ) 1.8 0.0 2.2   
assign (resid 104 and name HA )(resid 107 and name HN ) 1.8 0.0 2.2   
assign (resid 105 and name HA )(resid 108 and name HN ) 1.8 0.0 2.2   
assign (resid 106 and name HA )(resid 109 and name HN ) 1.8 0.0 2.2   
assign (resid 108 and name HA )(resid 111 and name HN ) 1.8 0.0 3.2   
assign (resid 109 and name HA )(resid 112 and name HN ) 1.8 0.0 3.2  

 remarks aiNi+4               
assign (resid  13 and name HA  )(resid  17 and name HN ) 1.8 0.0 3.2   
assign (resid  14 and name HA  )(resid  18 and name HN ) 1.8 0.0 3.2   
assign (resid  20 and name HA  )(resid  24 and name HN ) 1.8 0.0 3.2   
assign (resid  23 and name HA  )(resid  27 and name HN ) 1.8 0.0 3.2   
assign (resid  25 and name HA  )(resid  29 and name HN ) 1.8 0.0 3.2   
assign (resid  26 and name HA  )(resid  30 and name HN ) 1.8 0.0 3.2   
assign (resid  29 and name HA  )(resid  33 and name HN ) 1.8 0.0 3.2   
assign (resid  50 and name HA  )(resid  54 and name HN ) 1.8 0.0 3.2   
assign (resid  51 and name HA  )(resid  55 and name HN ) 1.8 0.0 3.2   
assign (resid  52 and name HA  )(resid  56 and name HN ) 1.8 0.0 3.2   
assign (resid  56 and name HA  )(resid  60 and name HN ) 1.8 0.0 3.2   
assign (resid  58 and name HA  )(resid  62 and name HN ) 1.8 0.0 3.2   
assign (resid  59 and name HA  )(resid  63 and name HN ) 1.8 0.0 3.2   
assign (resid  61 and name HA  )(resid  65 and name HN ) 1.8 0.0 2.2   
assign (resid  74 and name HA  )(resid  78 and name HN ) 1.8 0.0 3.2   
assign (resid  94 and name HA  )(resid  98 and name HN ) 1.8 0.0 3.2   
assign (resid  97 and name HA  )(resid 101 and name HN ) 1.8 0.0 3.2   
assign (resid  98 and name HA  )(resid 102 and name HN ) 1.8 0.0 3.2   
assign (resid 101 and name HA  )(resid 105 and name HN ) 1.8 0.0 3.2   
assign (resid 102 and name HA  )(resid 106 and name HN ) 1.8 0.0 3.2   
assign (resid 104 and name HA  )(resid 108 and name HN ) 1.8 0.0 3.2   
assign (resid 105 and name HA  )(resid 109 and name HN ) 1.8 0.0 3.2   
assign (resid 106 and name HA  )(resid 110 and name HN ) 1.8 0.0 3.2   
assign (resid 107 and name HA  )(resid 111 and name HN ) 1.8 0.0 3.2   
assign (resid 109 and name HA  )(resid 113 and name HN ) 1.8 0.0 3.2   

 remarks BiNi+1               
assign (resid   8 and name HB* )(resid   9 and name HN ) 1.8 0.0 4.2   
assign (resid  36 and name HB* )(resid  37 and name HN ) 1.8 0.0 4.2   
assign (resid  39 and name HB* )(resid  40 and name HN ) 1.8 0.0 2.7   
assign (resid  69 and name HB* )(resid  70 and name HN ) 1.8 0.0 2.7   
assign (resid  70 and name HB* )(resid  71 and name HN ) 1.8 0.0 2.7   
assign (resid  72 and name HB* )(resid  73 and name HN ) 1.8 0.0 2.7   
assign (resid  73 and name HB  )(resid  74 and name HN ) 1.8 0.0 1.7   
assign (resid  75 and name HB* )(resid  76 and name HN ) 1.8 0.0 2.7   
assign (resid  79 and name HB* )(resid  80 and name HN ) 1.8 0.0 3.2   
assign (resid 105 and name HB  )(resid 106 and name HN ) 1.8 0.0 1.7   

 remarks gi-Ni+1, di-Ni+1              
assign (resid   7 and name HD* )(resid  8 and name HN ) 1.8 0.0 5.6   
assign (resid  17 and name HG* )(resid 18 and name HN ) 1.8 0.0 4.2   
assign (resid  44 and name HD2 )(resid 45 and name HN ) 1.8 0.0 3.2   
assign (resid  46 and name HD* )(resid 47 and name HN ) 1.8 0.0 5.2   
assign (resid  61 and name HD* )(resid 62 and name HN ) 1.8 0.0 5.2   

 remarks (bgd)iNi-1               
assign (resid  36 and name HN )(resid  37 and name HB*  ) 1.8 0.0 4.2   
assign (resid  38 and name HN )(resid  39 and name HD*  ) 1.8 0.0 5.2   
assign (resid  40 and name HN )(resid  41 and name HD1* ) 1.8 0.0 4.2   

 remarks bi-Ni+2, gi-Ni+2, di-Ni+2             
assign (resid  29 and name HB*  )(resid  31 and name HN   ) 1.8 0.0 4.2   
assign (resid  29 and name HD*  )(resid  31 and name HN   ) 1.8 0.0 5.6   
assign (resid  26 and name HB*  )(resid  28 and name HN   ) 1.8 0.0 4.2   
assign (resid  30 and name HB*  )(resid  32 and name HN   ) 1.8 0.0 4.2   
assign (resid  31 and name HB*  )(resid  33 and name HN   ) 1.8 0.0 4.2   
assign (resid   9 and name HB*  )(resid  11 and name HN   ) 1.8 0.0 3.2   
assign (resid  35 and name HD*  )(resid  37 and name HN   ) 1.8 0.0 4.2   
assign (resid  47 and name HB*  )(resid  49 and name HN   ) 1.8 0.0 4.2   
assign (resid  49 and name HB*  )(resid  51 and name HN   ) 1.8 0.0 4.2   
assign (resid  55 and name HB*  )(resid  57 and name HN   ) 1.8 0.0 4.2   
assign (resid  56 and name HB*  )(resid  58 and name HN   ) 1.8 0.0 4.2   
assign (resid  57 and name HB*  )(resid  59 and name HN   ) 1.8 0.0 4.2   
assign (resid  59 and name HB*  )(resid  61 and name HN   ) 1.8 0.0 4.2   
assign (resid  60 and name HB*  )(resid  62 and name HN   ) 1.8 0.0 4.2   
assign (resid  62 and name HB*  )(resid  64 and name HN   ) 1.8 0.0 4.2   
assign (resid  63 and name HB*  )(resid  65 and name HN   ) 1.8 0.0 4.2   
assign (resid  75 and name HB*  )(resid  77 and name HN   ) 1.8 0.0 4.2   
assign (resid  77 and name HB*  )(resid  79 and name HN   ) 1.8 0.0 4.2   
assign (resid  84 and name HD*  )(resid  86 and name HN   ) 1.8 0.0 5.2   
assign (resid  96 and name HB*  )(resid  98 and name HN   ) 1.8 0.0 4.2   
assign (resid  98 and name HB*  )(resid 100 and name HN   ) 1.8 0.0 4.2   
assign (resid 101 and name HG*  )(resid 103 and name HN   ) 1.8 0.0 5.6   
assign (resid 109 and name HB*  )(resid 111 and name HN   ) 1.8 0.0 4.2   
assign (resid 111 and name HB*  )(resid 113 and name HN   ) 1.8 0.0 4.2   
assign (resid 115 and name HD*  )(resid 117 and name HN   ) 1.8 0.0 5.2   

 remarks ai-bi+3               
assign (resid  10 and name HA   )(resid  13 and name HB* ) 1.8 0.0 3.2  
assign (resid  11 and name HA   )(resid  14 and name HB  ) 1.8 0.0 2.2  
assign (resid  12 and name HA   )(resid  15 and name HB* ) 1.8 0.0 4.2   
assign (resid  14 and name HA   )(resid  17 and name HB* ) 1.8 0.0 3.2  
assign (resid  15 and name HA   )(resid  18 and name HB* ) 1.8 0.0 3.2  
assign (resid  16 and name HA   )(resid  19 and name HB* ) 1.8 0.0 3.2  
assign (resid  17 and name HA   )(resid  20 and name HB* ) 1.8 0.0 3.2  
assign (resid  21 and name HA   )(resid  24 and name HB  ) 1.8 0.0 3.2   
assign (resid  22 and name HA   )(resid  25 and name HB  ) 1.8 0.0 2.2  
assign (resid  23 and name HA   )(resid  26 and name HB* ) 1.8 0.0 3.2  
assign (resid  24 and name HA   )(resid  27 and name HB* ) 1.8 0.0 3.2  
assign (resid  25 and name HA   )(resid  28 and name HB* ) 1.8 0.0 4.2   
assign (resid  27 and name HA   )(resid  30 and name HB* ) 1.8 0.0 3.2  
assign (resid  28 and name HA   )(resid  31 and name HB* ) 1.8 0.0 3.2  
assign (resid  50 and name HA   )(resid  53 and name HB* ) 1.8 0.0 3.2   
assign (resid  51 and name HA   )(resid  54 and name HB* ) 1.8 0.0 3.2  
assign (resid  53 and name HA   )(resid  56 and name HB* ) 1.8 0.0 3.2  
assign (resid  54 and name HA   )(resid  57 and name HB* ) 1.8 0.0 3.2  
assign (resid  55 and name HA   )(resid  58 and name HB  ) 1.8 0.0 2.2  
assign (resid  56 and name HA   )(resid  59 and name HB* ) 1.8 0.0 3.2  
assign (resid  57 and name HA   )(resid  60 and name HB* ) 1.8 0.0 3.2  
assign (resid  58 and name HA   )(resid  61 and name HB* ) 1.8 0.0 4.2   
assign (resid  60 and name HA   )(resid  63 and name HB* ) 1.8 0.0 3.2  
assign (resid  98 and name HA   )(resid 101 and name HB  ) 1.8 0.0 3.2  
assign (resid 102 and name HA   )(resid 105 and name HB  ) 1.8 0.0 3.2   
assign (resid 104 and name HA   )(resid 107 and name HB* ) 1.8 0.0 4.2   
assign (resid 105 and name HA   )(resid 108 and name HB* ) 1.8 0.0 3.2  
assign (resid 106 and name HA   )(resid 109 and name HB* ) 1.8 0.0 3.2  
assign (resid 107 and name HA   )(resid 110 and name HB* ) 1.8 0.0 3.2  

 remarks ai-gi+3, ai-di+3              
assign (resid  11 and name HA )(resid  14 and name HG2* ) 1.8 0.0 3.2  
assign (resid  11 and name HA )(resid  14 and name HD1* ) 1.8 0.0 4.2   
assign (resid  13 and name HA )(resid  16 and name HD1* ) 1.8 0.0 4.2   
assign (resid  15 and name HA )(resid  18 and name HD*  ) 1.8 0.0 4.2   
assign (resid  15 and name HA )(resid  18 and name HE*  ) 1.8 0.0 4.2   
assign (resid  21 and name HA )(resid  24 and name HG2* ) 1.8 0.0 4.2   
assign (resid  21 and name HA )(resid  24 and name HD1* ) 1.8 0.0 4.2   
assign (resid  23 and name HA )(resid  26 and name HG*  ) 1.8 0.0 2.2  
assign (resid  25 and name HA )(resid  28 and name HD1* ) 1.8 0.0 4.2   
assign (resid  27 and name HA )(resid  30 and name HG*  ) 1.8 0.0 4.2   
assign (resid  55 and name HA )(resid  58 and name HG*  ) 1.8 0.0 5.6   
assign (resid  56 and name HA )(resid  59 and name HG*  ) 1.8 0.0 4.2   
assign (resid  60 and name HA )(resid  63 and name HG*  ) 1.8 0.0 4.2   
assign (resid  94 and name HA )(resid  97 and name HG2* ) 1.8 0.0 4.2   
assign (resid  94 and name HA )(resid  97 and name HD1* ) 1.8 0.0 4.2   
assign (resid  98 and name HA )(resid 101 and name HG1* ) 1.8 0.0 4.2   
assign (resid  98 and name HA )(resid 101 and name HG2* ) 1.8 0.0 4.2   
assign (resid 101 and name HA )(resid 104 and name HD*  ) 1.8 0.0 5.6  
assign (resid 102 and name HA )(resid 105 and name HG1* ) 1.8 0.0 4.2   
assign (resid 102 and name HA )(resid 105 and name HG2* ) 1.8 0.0 4.2   
assign (resid 107 and name HA )(resid 110 and name HG*  ) 1.8 0.0 4.2   
assign (resid 107 and name HA )(resid 110 and name HD*  ) 1.8 0.0 4.2   

 remarks long range NN             
assign (resid  39 and name HN )(resid  90 and name HN ) 1.8 0.0 2.2   
assign (resid  39 and name HN )(resid  91 and name HN ) 1.8 0.0 3.2   
assign (resid  40 and name HN )(resid 121 and name HN ) 1.8 0.0 3.2   
assign (resid  41 and name HN )(resid  90 and name HN ) 1.8 0.0 3.2   
assign (resid  41 and name HN )(resid  88 and name HN ) 1.8 0.0 3.2   
assign (resid  42 and name HN )(resid 119 and name HN ) 1.8 0.0 2.2   
assign (resid  44 and name HN )(resid 117 and name HN ) 1.8 0.0 3.2   
assign (resid  44 and name HN )(resid 118 and name HN ) 1.8 0.0 3.2 
assign (resid  44 and name HN )(resid 119 and name HN ) 1.8 0.0 4.2   
assign (resid  45 and name HN )(resid  84 and name HN ) 1.8 0.0 2.2   
assign (resid  45 and name HN )(resid  86 and name HN ) 1.8 0.0 4.2    
assign (resid  46 and name HN )(resid 116 and name HN ) 1.8 0.0 3.2   
assign (resid  47 and name HN )(resid  82 and name HN ) 1.8 0.0 2.2   
assign (resid  47 and name HN )(resid  83 and name HN ) 1.8 0.0 4.2   
assign (resid  47 and name HN )(resid  84 and name HN ) 1.8 0.0 4.2   
assign (resid  66 and name HN )(resid  87 and name HN ) 1.8 0.0 2.2   
assign (resid  68 and name HN )(resid  85 and name HN ) 1.8 0.0 3.2   
assign (resid  70 and name HN )(resid  83 and name HN ) 1.8 0.0 4.2   
assign (resid  71 and name HN )(resid  83 and name HN ) 1.8 0.0 3.2   
assign (resid  73 and name HN )(resid  81 and name HN ) 1.8 0.0 2.2   
assign (resid  93 and name HN )(resid  97 and name HN ) 1.8 0.0 3.2   

 remarks long range a-N             
assign (resid  38 and name HA )(resid  92 and name HN ) 1.8 0.0 3.2   
assign (resid  39 and name HN )(resid  91 and name HA ) 1.8 0.0 2.2   
assign (resid  39 and name HN )(resid  89 and name HA ) 1.8 0.0 3.2   
assign (resid  40 and name HA )(resid  88 and name HN ) 1.8 0.0 3.2   
assign (resid  40 and name HA )(resid  90 and name HN ) 1.8 0.0 2.2   
assign (resid  41 and name HN )(resid  89 and name HA ) 1.8 0.0 2.2   
assign (resid  41 and name HN )(resid  87 and name HA ) 1.8 0.0 3.2   
assign (resid  41 and name HA )(resid 121 and name HN ) 1.8 0.0 3.2   
assign (resid  42 and name HA )(resid  88 and name HN ) 1.8 0.0 3.2   
assign (resid  42 and name HN )(resid 120 and name HA ) 1.8 0.0 3.2   
assign (resid  43 and name HN )(resid  87 and name HA ) 1.8 0.0 3.2   
assign (resid  43 and name HA )(resid 119 and name HN ) 1.8 0.0 2.2   
assign (resid  44 and name HN )(resid 118 and name HA ) 1.8 0.0 3.2   
assign (resid  44 and name HA )(resid  86 and name HN ) 1.8 0.0 3.2   
assign (resid  45 and name HN )(resid  85 and name HA ) 1.8 0.0 2.2   
assign (resid  45 and name HA )(resid 116 and name HN ) 1.8 0.0 2.2   
assign (resid  46 and name HN )(resid  83 and name HA ) 1.8 0.0 3.2   
assign (resid  46 and name HN )(resid 115 and name HA ) 1.8 0.0 3.2   
assign (resid  46 and name HA )(resid  83 and name HN ) 1.8 0.0 3.2   
assign (resid  46 and name HA )(resid  84 and name HN ) 1.8 0.0 2.2   
assign (resid  47 and name HN )(resid  83 and name HA ) 1.8 0.0 2.2   
assign (resid  47 and name HN )(resid  81 and name HA ) 1.8 0.0 4.2   
assign (resid  65 and name HA )(resid  87 and name HN ) 1.8 0.0 3.2   
assign (resid  66 and name HN )(resid  86 and name HA ) 1.8 0.0 3.2   
assign (resid  67 and name HA )(resid  87 and name HN ) 1.8 0.0 2.2   
assign (resid  68 and name HN )(resid  86 and name HA ) 1.8 0.0 2.2   
assign (resid  69 and name HA )(resid  85 and name HN ) 1.8 0.0 3.2   
assign (resid  70 and name HN )(resid  84 and name HA ) 1.8 0.0 2.2   
assign (resid  71 and name HN )(resid  84 and name HA ) 1.8 0.0 3.2   
assign (resid  71 and name HN )(resid  82 and name HA ) 1.8 0.0 3.2   
assign (resid  71 and name HA )(resid  83 and name HN ) 1.8 0.0 3.2   
assign (resid  73 and name HN )(resid  82 and name HA ) 1.8 0.0 2.2   
assign (resid  74 and name HA )(resid  79 and name HN ) 1.8 0.0 3.2   
assign (resid  74 and name HA )(resid  80 and name HN ) 1.8 0.0 3.2   
assign (resid  74 and name HA )(resid  81 and name HN ) 1.8 0.0 2.2   
assign (resid  72 and name HA )(resid  83 and name HN ) 1.8 0.0 3.2   
assign (resid 105 and name HA )(resid 115 and  name HN ) 1.8 0.0 3.2   
assign (resid 108 and name HA )(resid 113 and name HN ) 1.8 0.0 2.2   

 remarks long range a-a             
assign (resid  40 and name HA  )(resid  89 and name HA ) 1.8 0.0 3.2   
assign (resid  42 and name HA  )(resid  87 and name HA ) 1.8 0.0 2.2   
assign (resid  43 and name HA  )(resid 118 and name HA ) 1.8 0.0 2.2   
assign (resid  44 and name HA  )(resid  85 and name HA ) 1.8 0.0 3.2   
assign (resid  45 and name HA  )(resid 115 and name HA ) 1.8 0.0 3.2 
assign (resid  46 and name HA  )(resid  83 and name HA ) 1.8 0.0 1.2   
assign (resid  48 and name HA  )(resid  81 and name HA ) 1.8 0.0 3.2   
assign (resid  67 and name HA  )(resid  86 and name HA ) 1.8 0.0 2.2   
assign (resid  69 and name HA  )(resid  84 and name HA ) 1.8 0.0 3.2   
assign (resid  70 and name HA  )(resid  84 and name HA ) 1.8 0.0 4.2   
assign (resid  72 and name HA  )(resid  82 and name HA ) 1.8 0.0 3.2   
assign (resid  74 and name HA  )(resid  80 and name HA ) 1.8 0.0 3.2   
assign (resid 107 and name HA  )(resid 110 and name HA ) 1.8 0.0 4.2   

 remarks other side chain to NH           
assign (resid   9 and name HB*  )(resid  12 and name HN   ) 1.8 0.0 4.2   
assign (resid   9 and name HN   )(resid  12 and name HB*  ) 1.8 0.0 4.2   
assign (resid   9 and name HN   )(resid  12 and name HG*  ) 1.8 0.0 4.2   
assign (resid  11 and name HN   )(resid  14 and name HD1* ) 1.8 0.0 4.2   
assign (resid  16 and name HG2* )(resid  19 and name HN   ) 1.8 0.0 4.2   
assign (resid  16 and name HG2* )(resid  20 and name HN   ) 1.8 0.0 4.2   
assign (resid  21 and name HG2* )(resid  24 and name HN   ) 1.8 0.0 4.2   
assign (resid  21 and name HN   )(resid 118 and name HE1  ) 1.8 0.0 4.2   
assign (resid  21 and name HN   )(resid  24 and name HD1* ) 1.8 0.0 4.2   
assign (resid  24 and name HD1* )(resid 120 and name HN   ) 1.8 0.0 4.2   
assign (resid  24 and name HG2* )(resid 120 and name HN   ) 1.8 0.0 4.2   
assign (resid  24 and name HG2* )(resid  28 and name HN   ) 1.8 0.0 4.2   
assign (resid  25 and name HB   )(resid  94 and name HN   ) 1.8 0.0 3.2   
assign (resid  25 and name HD1* )(resid  93 and name HN   ) 1.8 0.0 4.2   
assign (resid  25 and name HD1* )(resid  94 and name HN   ) 1.8 0.0 4.2   
assign (resid  25 and name HG2* )(resid  94 and name HN   ) 1.8 0.0 4.2   
assign (resid  25 and name HN   )(resid 118 and name HZ2  ) 1.8 0.0 3.2   
assign (resid  25 and name HN   )(resid  97 and name HD1* ) 1.8 0.0 4.2  
assign (resid  26 and name HB*  )(resid  29 and name HN   ) 1.8 0.0 4.2   
assign (resid  28 and name HB*  )(resid  33 and name HN   ) 1.8 0.0 4.2   
assign (resid  28 and name HD*  )(resid 120 and name HN   ) 1.8 0.0 5.6   
assign (resid  28 and name HD*  )(resid 122 and name HN   ) 1.8 0.0 5.6   
assign (resid  28 and name HD*  )(resid 123 and name HN   ) 1.8 0.0 5.6   
assign (resid  28 and name HN   )(resid  92 and name HD*  ) 1.8 0.0 5.6   
assign (resid  29 and name HB*  )(resid  33 and name HN   ) 1.8 0.0 4.2   
assign (resid  29 and name HD*  )(resid  32 and name HN   ) 1.8 0.0 5.6   
assign (resid  29 and name HD*  )(resid  33 and name HN   ) 1.8 0.0 5.6   
assign (resid  29 and name HN   )(resid  92 and name HD*  ) 1.8 0.0 5.6   
assign (resid  33 and name HN   )(resid 122 and name HE*  ) 1.8 0.0 5.2   
assign (resid  33 and name HN   )(resid  39 and name HE*  ) 1.8 0.0 5.2   
assign (resid  37 and name HN   )(resid  39 and name HD*  ) 1.8 0.0 5.2   
assign (resid  38 and name HB*  )(resid  90 and name HN   ) 1.8 0.0 4.2   
assign (resid  38 and name HD*  )(resid  90 and name HN   ) 1.8 0.0 5.6   
assign (resid  38 and name HD*  )(resid  91 and name HN   ) 1.8 0.0 5.6   
assign (resid  38 and name HD*  )(resid  92 and name HN   ) 1.8 0.0 5.6   
assign (resid  39 and name HB*  )(resid  90 and name HN   ) 1.8 0.0 4.2   
assign (resid  39 and name HD*  )(resid  90 and name HN   ) 1.8 0.0 5.2   
assign (resid  39 and name HE*  )(resid 122 and name HN   ) 1.8 0.0 5.2   
assign (resid  39 and name HE*  )(resid  92 and name HN   ) 1.8 0.0 5.2   
assign (resid  39 and name HN   )(resid  41 and name HD1* ) 1.8 0.0 4.2   
assign (resid  40 and name HB*  )(resid 121 and name HN   ) 1.8 0.0 4.2   
assign (resid  40 and name HN   )(resid  89 and name HA   ) 1.8 0.0 3.2   
assign (resid  41 and name HB   )(resid  88 and name HN   ) 1.8 0.0 2.2  
assign (resid  41 and name HD1* )(resid  90 and name HN   ) 1.8 0.0 3.2  
assign (resid  41 and name HG1* )(resid  90 and name HN   ) 1.8 0.0 4.2   
assign (resid  41 and name HG2* )(resid 119 and name HN   ) 1.8 0.0 4.2   
assign (resid  41 and name HG2* )(resid  88 and name HN   ) 1.8 0.0 5.2  
assign (resid  41 and name HN   )(resid  87 and name HG2* ) 1.8 0.0 4.2   
assign (resid  41 and name HN   )(resid  88 and name HB*  ) 1.8 0.0 4.2   
assign (resid  42 and name HB*  )(resid 119 and name HN   ) 1.8 0.0 4.2   
assign (resid  42 and name HN   )(resid 118 and name HB*  ) 1.8 0.0 4.2   
assign (resid  42 and name HN   )(resid 120 and name HB   ) 1.8 0.0 3.2   
assign (resid  42 and name HN   )(resid  87 and name HG2* ) 1.8 0.0 4.2   
assign (resid  43 and name HA   )(resid  86 and name HN   ) 1.8 0.0 4.2   
assign (resid  43 and name HB*  )(resid  86 and name HN   ) 1.8 0.0 4.2   
assign (resid  43 and name HE1  )(resid 101 and name HN   ) 1.8 0.0 3.2   
assign (resid  43 and name HN   )(resid 104 and name HD1* ) 1.8 0.0 4.2   
assign (resid  43 and name HN   )(resid  85 and name HB*  ) 1.8 0.0 5.2  
assign (resid  43 and name HN   )(resid  86 and name HB*  ) 1.8 0.0 4.2   
assign (resid  43 and name HN   )(resid  87 and name HG2* ) 1.8 0.0 4.2   
assign (resid  44 and name HB*  )(resid 117 and name HN   ) 1.8 0.0 4.2   
assign (resid  44 and name HN   )(resid 115 and name HD*  ) 1.8 0.0 5.2   
assign (resid  45 and name HB*  )(resid  84 and name HN   ) 1.8 0.0 4.2   
assign (resid  45 and name HD*  )(resid 108 and name HN   ) 1.8 0.0 5.6   
assign (resid  45 and name HD*  )(resid 116 and name HN   ) 1.8 0.0 5.6   
assign (resid  45 and name HD*  )(resid  86 and name HN   ) 1.8 0.0 5.6   
assign (resid  45 and name HG   )(resid 116 and name HN   ) 1.8 0.0 4.2   
assign (resid  45 and name HG   )(resid 117 and name HN   ) 1.8 0.0 4.2   
assign (resid  46 and name HB*  )(resid  84 and name HN   ) 1.8 0.0 4.2   
assign (resid  46 and name HN   )(resid 113 and name HB   ) 1.8 0.0 3.2   
assign (resid  46 and name HN   )(resid 113 and name HD1* ) 1.8 0.0 4.2   
assign (resid  46 and name HN   )(resid 113 and name HG2* ) 1.8 0.0 4.2   
assign (resid  46 and name HN   )(resid  84 and name HZ   ) 1.8 0.0 3.2   
assign (resid  46 and name HZ   )(resid 116 and name HN   ) 1.8 0.0 3.2   
assign (resid  47 and name HB*  )(resid 114 and name HN   ) 1.8 0.0 4.2   
assign (resid  47 and name HN   )(resid  53 and name HD*  ) 1.8 0.0 5.6   
assign (resid  47 and name HN   )(resid  81 and name HD*  ) 1.8 0.0 5.6   
assign (resid  47 and name HN   )(resid  82 and name HB*  ) 1.8 0.0 4.2   
assign (resid  47 and name HN   )(resid  84 and name HE*  ) 1.8 0.0 5.2   
assign (resid  48 and name HN   )(resid 113 and name HG2* ) 1.8 0.0 4.2   
assign (resid  49 and name HB*  )(resid  52 and name HN   ) 1.8 0.0 4.2   
assign (resid  49 and name HN   )(resid 112 and name HB*  ) 1.8 0.0 4.2   
assign (resid  49 and name HN   )(resid 113 and name HG2* ) 1.8 0.0 4.2   
assign (resid  49 and name HN   )(resid  52 and name HG*  ) 1.8 0.0 4.2   
assign (resid  49 and name HN   )(resid  82 and name HD*  ) 1.8 0.0 5.6   
assign (resid  50 and name HN   )(resid  53 and name HD*  ) 1.8 0.0 5.6   
assign (resid  50 and name HN   )(resid  82 and name HD*  ) 1.8 0.0 5.6   
assign (resid  51 and name HN   )(resid  53 and name HD*  ) 1.8 0.0 5.6   
assign (resid  52 and name HG*  )(resid 113 and name HN   ) 1.8 0.0 4.2   
assign (resid  53 and name HD*  )(resid  70 and name HN   ) 1.8 0.0 5.6   
assign (resid  53 and name HD*  )(resid  83 and name HN   ) 1.8 0.0 5.6   
assign (resid  53 and name HD*  )(resid  84 and name HN   ) 1.8 0.0 5.6   
assign (resid  56 and name HB*  )(resid 111 and name HN   ) 1.8 0.0 4.2   
assign (resid  56 and name HB*  )(resid 113 and name HN   ) 1.8 0.0 4.2   
assign (resid  58 and name HG*  )(resid  61 and name HN   ) 1.8 0.0 5.6   
assign (resid  58 and name HG*  )(resid  62 and name HN   ) 1.8 0.0 5.6   
assign (resid  60 and name HB*  )(resid  63 and name HN   ) 1.8 0.0 4.2   
assign (resid  60 and name HB*  )(resid  65 and name HN   ) 1.8 0.0 4.2   
assign (resid  60 and name HN   )(resid 107 and name HD*  ) 1.8 0.0 5.6   
assign (resid  60 and name HN   )(resid  67 and name HG*  ) 1.8 0.0 5.6   
assign (resid  61 and name HN   )(resid  67 and name HB   ) 1.8 0.0 3.2   
assign (resid  61 and name HN   )(resid  67 and name HG*  ) 1.8 0.0 5.6   
assign (resid  64 and name HN   )(resid  88 and name HE*  ) 1.8 0.0 4.2   
assign (resid  65 and name HB*  )(resid  87 and name HN   ) 1.8 0.0 4.2   
assign (resid  65 and name HD*  )(resid  88 and name HN   ) 1.8 0.0 5.2   
assign (resid  65 and name HN   )(resid  88 and name HE*  ) 1.8 0.0 4.2   
assign (resid  66 and name HB*  )(resid  87 and name HN   ) 1.8 0.0 4.2   
assign (resid  66 and name HG*  )(resid  87 and name HN   ) 1.8 0.0 4.2   
assign (resid  66 and name HN   )(resid  87 and name HB   ) 1.8 0.0 3.2   
assign (resid  66 and name HN   )(resid  87 and name HG2* ) 1.8 0.0 4.2   
assign (resid  68 and name HB*  )(resid  85 and name HN   ) 1.8 0.0 4.2   
assign (resid  68 and name HN   )(resid  84 and name HD*  ) 1.8 0.0 5.2   
assign (resid  68 and name HN   )(resid  85 and name HB*  ) 1.8 0.0 4.2   
assign (resid  70 and name HB*  )(resid  83 and name HN   ) 1.8 0.0 4.2   
assign (resid  70 and name HB*  )(resid  84 and name HN   ) 1.8 0.0 4.2   
assign (resid  70 and name HB*  )(resid  85 and name HN   ) 1.8 0.0 4.2   
assign (resid  70 and name HN   )(resid  84 and name HB*  ) 1.8 0.0 4.2   
assign (resid  71 and name HB*  )(resid  83 and name HN   ) 1.8 0.0 4.2   
assign (resid  71 and name HN   )(resid  82 and name HD*  ) 1.8 0.0 5.6   
assign (resid  71 and name HN   )(resid  83 and name HB*  ) 1.8 0.0 4.2   
assign (resid  72 and name HB*  )(resid  81 and name HN   ) 1.8 0.0 4.2   
assign (resid  73 and name HG2* )(resid  81 and name HN   ) 1.8 0.0 4.2   
assign (resid  73 and name HG2* )(resid  83 and name HN   ) 1.8 0.0 4.2   
assign (resid  73 and name HN   )(resid  82 and name HD*  ) 1.8 0.0 5.6   
assign (resid  74 and name HB*  )(resid  78 and name HN   ) 1.8 0.0 4.2   
assign (resid  74 and name HB*  )(resid  79 and name HN   ) 1.8 0.0 4.2   
assign (resid  74 and name HG*  )(resid  78 and name HN   ) 1.8 0.0 4.2   
assign (resid  74 and name HG*  )(resid  79 and name HN   ) 1.8 0.0 4.2   
assign (resid  75 and name HN   )(resid  79 and name HB*  ) 1.8 0.0 4.2   
assign (resid  75 and name HN   )(resid  81 and name HD*  ) 1.8 0.0 5.6   
assign (resid  75 and name HN   )(resid  81 and name HG   ) 1.8 0.0 3.2   
assign (resid  76 and name HN   )(resid  81 and name HD*  ) 1.8 0.0 5.6   
assign (resid  77 and name HN   )(resid  79 and name HB*  ) 1.8 0.0 4.2   
assign (resid  90 and name HG   )(resid  93 and name HN   ) 1.8 0.0 3.2   
assign (resid  91 and name HN   )(resid  96 and name HD*  ) 1.8 0.0 5.6   
assign (resid  93 and name HB*  )(resid  95 and name HN   ) 1.8 0.0 4.2   
assign (resid  93 and name HB*  )(resid  96 and name HN   ) 1.8 0.0 3.2   
assign (resid  93 and name HB*  )(resid  97 and name HN   ) 1.8 0.0 4.2   
assign (resid  93 and name HN   )(resid  96 and name HD*  ) 1.8 0.0 5.6   
assign (resid  93 and name HN   )(resid  97 and name HD1* ) 1.8 0.0 4.2   
assign (resid  94 and name HN   )(resid  96 and name HB*  ) 1.8 0.0 4.2   
assign (resid  97 and name HG2* )(resid 100 and name HN   ) 1.8 0.0 4.2   
assign (resid  97 and name HG2* )(resid 101 and name HN   ) 1.8 0.0 4.2   
assign (resid  98 and name HN   )(resid 101 and name HG*  ) 1.8 0.0 5.6   
assign (resid 101 and name HG*  )(resid 105 and name HN   ) 1.8 0.0 5.6   
assign (resid 101 and name HG*  )(resid 118 and name HN   ) 1.8 0.0 5.6   
assign (resid 102 and name HN   )(resid 105 and name HB   ) 1.8 0.0 3.2   
assign (resid 102 and name HN   )(resid 105 and name HG*  ) 1.8 0.0 5.6   
assign (resid 104 and name HD*  )(resid 107 and name HN   ) 1.8 0.0 5.6   
assign (resid 104 and name HD*  )(resid 108 and name HN   ) 1.8 0.0 5.6   
assign (resid 104 and name HN   )(resid 115 and name HD*  ) 1.8 0.0 5.2   
assign (resid 105 and name HN   )(resid 115 and name HD*  ) 1.8 0.0 5.2   
assign (resid 107 and name HD*  )(resid 110 and name HN   ) 1.8 0.0 5.6   
assign (resid 108 and name HB*  )(resid 113 and name HN   ) 1.8 0.0 3.2   
assign (resid 111 and name HN   )(resid 113 and name HD1* ) 1.8 0.0 4.2   
assign (resid 111 and name HN   )(resid 113 and name HG1* ) 1.8 0.0 4.2   
assign (resid 115 and name HD*  )(resid 118 and name HN   ) 1.8 0.0 5.2   
assign (resid 122 and name HN   )(resid 125 and name HD*  ) 1.8 0.0 5.6   

 remarks side chain amide protons            

 remarks long range side chain to alpha          
assign (resid  10 and name HA   )(resid 109 and name HG*  ) 1.8 0.0 4.2   
assign (resid  10 and name HA   )(resid  12 and name HG*  ) 1.8 0.0 4.2 
assign (resid  10 and name HG*  )(resid 106 and name HA   ) 1.8 0.0 5.6   
assign (resid  14 and name HA   )(resid 105 and name HG*  ) 1.8 0.0 5.6  
assign (resid  14 and name HD1* )(resid 102 and name HA   ) 1.8 0.0 3.2  
assign (resid  14 and name HG2* )(resid 102 and name HA   ) 1.8 0.0 4.2   
assign (resid  18 and name HA   )(resid  21 and name HG2* ) 1.8 0.0 4.2   
assign (resid  19 and name HA   )(resid  22 and name HE   ) 1.8 0.0 3.2   
assign (resid  20 and name HA   )(resid  23 and name HB*  ) 1.8 0.0 4.2   
assign (resid  21 and name HA   )(resid 118 and name HE1  ) 1.8 0.0 3.2  
assign (resid  21 and name HA   )(resid  25 and name HD1* ) 1.8 0.0 4.2   
assign (resid  21 and name HA   )(resid  97 and name HG2* ) 1.8 0.0 4.2   
assign (resid  21 and name HG2* )(resid  94 and name HA   ) 1.8 0.0 4.2   
assign (resid  22 and name HA   )(resid  94 and name HB*  ) 1.8 0.0 4.2  
assign (resid  24 and name HA   )(resid  28 and name HN   ) 1.8 0.0 3.2   
assign (resid  25 and name HA   )(resid  92 and name HD*  ) 1.8 0.0 5.6   
assign (resid  25 and name HD1* )(resid  92 and name HA   ) 1.8 0.0 4.2   
assign (resid  25 and name HD1* )(resid  93 and name HA   ) 1.8 0.0 4.2   
assign (resid  25 and name HD1* )(resid  94 and name HA   ) 1.8 0.0 4.2   
assign (resid  26 and name HA   )(resid  29 and name HD*  ) 1.8 0.0 5.6   
assign (resid  29 and name HD*  )(resid  35 and name HA   ) 1.8 0.0 5.6  
assign (resid  35 and name HA   )(resid  92 and name HD*  ) 1.8 0.0 5.6   
assign (resid  38 and name HA   )(resid  91 and name HB*  ) 1.8 0.0 4.2   
assign (resid  38 and name HD*  )(resid  89 and name HA   ) 1.8 0.0 5.6   
assign (resid  38 and name HD*  )(resid  90 and name HA   ) 1.8 0.0 5.6   
assign (resid  39 and name HA   )(resid  41 and name HD1* ) 1.8 0.0 4.2   
assign (resid  41 and name HA   )(resid 120 and name HG2* ) 1.8 0.0 4.2   
assign (resid  41 and name HD1* )(resid 120 and name HA   ) 1.8 0.0 5.2   
assign (resid  41 and name HG2* )(resid 118 and name HA   ) 1.8 0.0 4.2   
assign (resid  42 and name HA   )(resid  87 and name HG2* ) 1.8 0.0 3.2   
assign (resid  45 and name HD*  )(resid 108 and name HA   ) 1.8 0.0 5.6  
assign (resid  45 and name HD*  )(resid 115 and name HA   ) 1.8 0.0 5.6  
assign (resid  45 and name HG   )(resid 115 and name HA   ) 1.8 0.0 3.2   
assign (resid  46 and name HA   )(resid  53 and name HD*  ) 1.8 0.0 6.6   
assign (resid  46 and name HA   )(resid  53 and name HG   ) 1.8 0.0 3.2   
assign (resid  46 and name HA   )(resid  83 and name HB*  ) 1.8 0.0 4.2   
assign (resid  47 and name HA   )(resid 113 and name HG2* ) 1.8 0.0 4.2   
assign (resid  47 and name HA   )(resid 114 and name HG2* ) 1.8 0.0 4.2   
assign (resid  47 and name HB*  )(resid 113 and name HA   ) 1.8 0.0 3.2  
assign (resid  47 and name HB*  )(resid  53 and name HA   ) 1.8 0.0 4.2   
assign (resid  48 and name HA   )(resid  81 and name HD*  ) 1.8 0.0 5.6   
assign (resid  50 and name HA   )(resid  82 and name HD*  ) 1.8 0.0 5.6   
assign (resid  52 and name HA   )(resid 113 and name HG2* ) 1.8 0.0 5.2   
assign (resid  52 and name HD*  )(resid 111 and name HA   ) 1.8 0.0 4.2   
assign (resid  53 and name HA   )(resid 113 and name HD1* ) 1.8 0.0 4.2   
assign (resid  53 and name HA   )(resid 113 and name HG2* ) 1.8 0.0 4.2   
assign (resid  53 and name HD*  )(resid  83 and name HA   ) 1.8 0.0 5.6   
assign (resid  56 and name HA   )(resid 107 and name HD1* ) 1.8 0.0 3.2   
assign (resid  56 and name HA   )(resid 107 and name HD2* ) 1.8 0.0 3.2   
assign (resid  56 and name HB*  )(resid 111 and name HA   ) 1.8 0.0 5.2   
assign (resid  57 and name HA   )(resid  67 and name HG1* ) 1.8 0.0 4.2   
assign (resid  57 and name HA   )(resid  67 and name HG2* ) 1.8 0.0 4.2   
assign (resid  60 and name HA   )(resid 107 and name HD*  ) 1.8 0.0 5.6   
assign (resid  60 and name HA   )(resid  63 and name HE*  ) 1.8 0.0 4.2   
assign (resid  60 and name HB*  )(resid  61 and name HA   ) 1.8 0.0 4.2   
assign (resid  61 and name HA   )(resid  67 and name HG*  ) 1.8 0.0 5.6   
assign (resid  63 and name HE*  )(resid 104 and name HA   ) 1.8 0.0 4.2   
assign (resid  64 and name HA*  )(resid  88 and name HE*  ) 1.8 0.0 5.2   
assign (resid  65 and name HA   )(resid  86 and name HB*  ) 1.8 0.0 4.2   
assign (resid  65 and name HA   )(resid  88 and name HB*  ) 1.8 0.0 4.2   
assign (resid  65 and name HA   )(resid  88 and name HE*  ) 1.8 0.0 4.2   
assign (resid  67 and name HG1* )(resid  86 and name HA   ) 1.8 0.0 4.2   
assign (resid  67 and name HG2* )(resid  86 and name HA   ) 1.8 0.0 4.2   
assign (resid  69 and name HA   )(resid  70 and name HB*  ) 1.8 0.0 4.2   
assign (resid  70 and name HB*  )(resid  71 and name HA   ) 1.8 0.0 4.2   
assign (resid  70 and name HB*  )(resid  83 and name HA   ) 1.8 0.0 4.2   
assign (resid  70 and name HB*  )(resid  84 and name HA   ) 1.8 0.0 4.2   
assign (resid  72 and name HA   )(resid  73 and name HG2* ) 1.8 0.0 4.2   
assign (resid  72 and name HA   )(resid  82 and name HD*  ) 1.8 0.0 5.6   
assign (resid  73 and name HG2* )(resid  74 and name HA   ) 1.8 0.0 4.2   
assign (resid  74 and name HA   )(resid  81 and name HD*  ) 1.8 0.0 5.6   
assign (resid  75 and name HA   )(resid  81 and name HD*  ) 1.8 0.0 5.6   
assign (resid  85 and name HA   )(resid  86 and name HB*  ) 1.8 0.0 5.2   
assign (resid  88 and name HE*  )(resid 100 and name HA   ) 1.8 0.0 4.2   
assign (resid  90 and name HA   )(resid  91 and name HB*  ) 1.8 0.0 4.2   
assign (resid  92 and name HA   )(resid  97 and name HD1* ) 1.8 0.0 4.2   
assign (resid  97 and name HG2* )(resid  98 and name HA   ) 1.8 0.0 4.2   
assign (resid 100 and name HA   )(resid 103 and name HD*  ) 1.8 0.0 4.2   
assign (resid 101 and name HA   )(resid 105 and name HG*  ) 1.8 0.0 5.6  
assign (resid 101 and name HG1* )(resid 102 and name HA   ) 1.8 0.0 4.2  
assign (resid 102 and name HA   )(resid 106 and name HD2* ) 1.8 0.0 4.2   
assign (resid 103 and name HA   )(resid 106 and name HD2* ) 1.8 0.0 4.2   
assign (resid 108 and name HA   )(resid 113 and name HB   ) 1.8 0.0 3.2  
assign (resid 108 and name HA   )(resid 113 and name HD1* ) 1.8 0.0 4.2   
assign (resid 108 and name HA   )(resid 113 and name HG2* ) 1.8 0.0 4.2   
assign (resid 108 and name HB*  )(resid 114 and name HA   ) 1.8 0.0 4.2   
assign (resid 108 and name HB*  )(resid 115 and name HA   ) 1.8 0.0 3.2   
assign (resid 111 and name HA   )(resid 113 and name HG2* ) 1.8 0.0 5.2   
assign (resid 113 and name HA   )(resid 114 and name HG2* ) 1.8 0.0 4.2  
assign (resid 114 and name HD1* )(resid 116 and name HA   ) 1.8 0.0 4.2   

 remarks long range side chain to side chain         
assign (resid   9 and name HB*  )(resid  13 and name HG   ) 1.8 0.0 3.2   
assign (resid  10 and name HG*  )(resid  14 and name HD1* ) 1.8 0.0 6.6   
assign (resid  10 and name HG*  )(resid 106 and name HD2* ) 1.8 0.0 6.6   
assign (resid  10 and name HG*  )(resid 109 and name HB*  ) 1.8 0.0 6.6   
assign (resid  10 and name HG*  )(resid 109 and name HG*  ) 1.8 0.0 5.6   
assign (resid  13 and name HD*  )(resid  16 and name HB   ) 1.8 0.0 5.6   
assign (resid  13 and name HD*  )(resid  16 and name HD1* ) 1.8 0.0 6.6   
assign (resid  13 and name HD*  )(resid 115 and name HD*  ) 1.8 0.0 7.6   
assign (resid  13 and name HD*  )(resid 115 and name HE*  ) 1.8 0.0 7.6   
assign (resid  13 and name HG   )(resid 105 and name HG*  ) 1.8 0.0 5.6   
assign (resid  14 and name HD1* )(resid  18 and name HE*  ) 1.8 0.0 5.2   
assign (resid  14 and name HD1* )(resid 102 and name HB*  ) 1.8 0.0 5.2   
assign (resid  14 and name HD1* )(resid 102 and name HG*  ) 1.8 0.0 4.2  
assign (resid  14 and name HD1* )(resid 105 and name HB   ) 1.8 0.0 4.2  
assign (resid  14 and name HD1* )(resid 105 and name HG*  ) 1.8 0.0 6.6  
assign (resid  14 and name HD1* )(resid 106 and name HD2* ) 1.8 0.0 5.2   
assign (resid  14 and name HG1* )(resid 105 and name HG*  ) 1.8 0.0 6.6  
assign (resid  14 and name HG2* )(resid  18 and name HD*  ) 1.8 0.0 5.2  
assign (resid  14 and name HG2* )(resid  18 and name HE*  ) 1.8 0.0 5.2  
assign (resid  14 and name HG2* )(resid  18 and name HG*  ) 1.8 0.0 5.2  
assign (resid  14 and name HG2* )(resid 102 and name HG*  ) 1.8 0.0 5.2   
assign (resid  14 and name HG2* )(resid 105 and name HG*  ) 1.8 0.0 6.6  
assign (resid  15 and name HB*  )(resid  16 and name HG2* ) 1.8 0.0 5.2   
assign (resid  17 and name HB*  )(resid 101 and name HG1* ) 1.8 0.0 5.2  
assign (resid  17 and name HB*  )(resid 101 and name HG2* ) 1.8 0.0 5.2 
assign (resid  17 and name HG*  )(resid 101 and name HG1* ) 1.8 0.0 5.2  
assign (resid  17 and name HG*  )(resid 101 and name HG2* ) 1.8 0.0 5.2  
assign (resid  20 and name HB*  )(resid  24 and name HD1* ) 1.8 0.0 5.2   
assign (resid  20 and name HG*  )(resid  24 and name HD1* ) 1.8 0.0 5.2   
assign (resid  21 and name HA   )(resid 118 and name HH2  ) 1.8 0.0 3.2   
assign (resid  21 and name HA   )(resid 118 and name HZ2  ) 1.8 0.0 2.2  
assign (resid  21 and name HB   )(resid  25 and name HD1* ) 1.8 0.0 4.2   
assign (resid  21 and name HG2* )(resid  24 and name HD1* ) 1.8 0.0 5.2  
assign (resid  21 and name HG2* )(resid  24 and name HG2* ) 1.8 0.0 5.2  
assign (resid  21 and name HG2* )(resid  25 and name HD1* ) 1.8 0.0 4.2 
assign (resid  21 and name HG2* )(resid  25 and name HG2* ) 1.8 0.0 5.2  
assign (resid  21 and name HG2* )(resid  94 and name HB*  ) 1.8 0.0 5.2  
assign (resid  21 and name HG2* )(resid  97 and name HD1* ) 1.8 0.0 5.2  
assign (resid  21 and name HG2* )(resid  97 and name HG2* ) 1.8 0.0 4.2 
assign (resid  21 and name HG2* )(resid 118 and name HH2  ) 1.8 0.0 5.2 
assign (resid  21 and name HG2* )(resid 118 and name HZ2  ) 1.8 0.0 4.2  
assign (resid  24 and name HD1* )(resid 118 and name HZ2  ) 1.8 0.0 5.2 
assign (resid  24 and name HG2* )(resid  28 and name HD*  ) 1.8 0.0 6.6   
assign (resid  24 and name HG2* )(resid  28 and name HG   ) 1.8 0.0 4.2 
assign (resid  24 and name HG2* )(resid 118 and name HH2  ) 1.8 0.0 4.2  
assign (resid  24 and name HG2* )(resid 118 and name HZ2  ) 1.8 0.0 4.2  
assign (resid  24 and name HG2* )(resid 118 and name HZ3  ) 1.8 0.0 5.2 
assign (resid  24 and name HG2* )(resid 120 and name HG2* ) 1.8 0.0 5.2  
assign (resid  25 and name HD1* )(resid  39 and name HE*  ) 1.8 0.0 6.2    
assign (resid  25 and name HD1* )(resid  92 and name HD*  ) 1.8 0.0 6.6  
assign (resid  25 and name HD1* )(resid  92 and name HG   ) 1.8 0.0 4.2  
assign (resid  25 and name HD1* )(resid  94 and name HB*  ) 1.8 0.0 5.2  
assign (resid  25 and name HD1* )(resid  97 and name HD1* ) 1.8 0.0 5.2  
assign (resid  25 and name HD1* )(resid  97 and name HG2* ) 1.8 0.0 5.2  
assign (resid  25 and name HD1* )(resid 118 and name HH2  ) 1.8 0.0 4.2  
assign (resid  25 and name HD1* )(resid 118 and name HZ2  ) 1.8 0.0 5.2 
assign (resid  25 and name HG1* )(resid  92 and name HD*  ) 1.8 0.0 6.6    
assign (resid  25 and name HG2* )(resid  28 and name HD*  ) 1.8 0.0 6.6 
assign (resid  25 and name HG2* )(resid  29 and name HD*  ) 1.8 0.0 6.6   
assign (resid  25 and name HG2* )(resid  29 and name HG   ) 1.8 0.0 4.2   
assign (resid  25 and name HG2* )(resid  92 and name HD*  ) 1.8 0.0 6.6  
assign (resid  25 and name HG2* )(resid  92 and name HG   ) 1.8 0.0 4.2   
assign (resid  25 and name HG2* )(resid  94 and name HB*  ) 1.8 0.0 5.2  
assign (resid  25 and name HG2* )(resid  97 and name HD1* ) 1.8 0.0 5.2  
assign (resid  25 and name HN   )(resid 118 and name HH2  ) 1.8 0.0 3.2   
assign (resid  27 and name HB*  )(resid  30 and name HB*  ) 1.8 0.0 5.2   
assign (resid  28 and name HD*  )(resid 122 and name HE*  ) 1.8 0.0 7.6  
assign (resid  28 and name HD1* )(resid  92 and name HD*  ) 1.8 0.0 6.6  
assign (resid  28 and name HD1* )(resid 120 and name HG2* ) 1.8 0.0 6.6  
assign (resid  29 and name HD*  )(resid  35 and name HB*  ) 1.8 0.0 6.6   
assign (resid  29 and name HG   )(resid  92 and name HD*  ) 1.8 0.0 5.6  
assign (resid  34 and name HB*  )(resid  37 and name HB*  ) 1.8 0.0 5.2   
assign (resid  37 and name HB*  )(resid  39 and name HD*  ) 1.8 0.0 6.2    
assign (resid  37 and name HB*  )(resid  39 and name HE*  ) 1.8 0.0 6.2    
assign (resid  37 and name HB*  )(resid 123 and name HB*  ) 1.8 0.0 5.2   
assign (resid  37 and name HB*  )(resid 123 and name HG*  ) 1.8 0.0 5.2   
assign (resid  38 and name HD*  )(resid  89 and name HB*  ) 1.8 0.0 6.6   
assign (resid  38 and name HD*  )(resid  89 and name HE*  ) 1.8 0.0 6.6    
assign (resid  38 and name HD*  )(resid  89 and name HG*  ) 1.8 0.0 6.6   
assign (resid  38 and name HD*  )(resid  91 and name HB*  ) 1.8 0.0 6.6   
assign (resid  39 and name HB*  )(resid  41 and name HD1* ) 1.8 0.0 5.2   
assign (resid  39 and name HD*  )(resid  92 and name HD*  ) 1.8 0.0 7.6    
assign (resid  39 and name HD*  )(resid 120 and name HG2* ) 1.8 0.0 6.2   
assign (resid  39 and name HD*  )(resid 121 and name HN   ) 1.8 0.0 5.6   
assign (resid  39 and name HE*  )(resid  92 and name HD*  ) 1.8 0.0 7.6   
assign (resid  39 and name HE*  )(resid 120 and name HG2* ) 1.8 0.0 6.2   
assign (resid  39 and name HE*  )(resid 123 and name HN   ) 1.8 0.0 5.6   
assign (resid  40 and name HB*  )(resid  87 and name HG2* ) 1.8 0.0 5.2   
assign (resid  40 and name HG*  )(resid  87 and name HG2* ) 1.8 0.0 5.2   
assign (resid  41 and name HD1* )(resid  90 and name HB*  ) 1.8 0.0 5.2   
assign (resid  41 and name HD1* )(resid  92 and name HD*  ) 1.8 0.0 6.6   
assign (resid  41 and name HD1* )(resid  97 and name HD1* ) 1.8 0.0 5.2   
assign (resid  41 and name HD1* )(resid  97 and name HG1* ) 1.8 0.0 5.2    
assign (resid  41 and name HD1* )(resid 118 and name HZ3  ) 1.8 0.0 4.2 
assign (resid  41 and name HD1* )(resid 120 and name HB   ) 1.8 0.0 4.2   
assign (resid  41 and name HD1* )(resid 120 and name HG2* ) 1.8 0.0 5.2  
assign (resid  41 and name HG2* )(resid  97 and name HD1* ) 1.8 0.0 5.2   
assign (resid  41 and name HG2* )(resid 101 and name HG2* ) 1.8 0.0 5.2   
assign (resid  41 and name HG2* )(resid 118 and name HB*  ) 1.8 0.0 5.2   
assign (resid  41 and name HG2* )(resid 120 and name HG2* ) 1.8 0.0 5.2    
assign (resid  42 and name HB*  )(resid  87 and name HG2* ) 1.8 0.0 4.2    
assign (resid  42 and name HN   )(resid 118 and name HE3  ) 1.8 0.0 4.2   
assign (resid  43 and name HB*  )(resid  86 and name HB*  ) 1.8 0.0 5.2   
assign (resid  43 and name HB*  )(resid 104 and name HD*  ) 1.8 0.0 6.6   
assign (resid  43 and name HD2  )(resid  86 and name HB*  ) 1.8 0.0 4.2  
assign (resid  43 and name HD2  )(resid 104 and name HD1* ) 1.8 0.0 4.2   
assign (resid  43 and name HE1  )(resid 101 and name HG2* ) 1.8 0.0 4.2   
assign (resid  44 and name HD2  )(resid  86 and name HN   ) 1.8 0.0 4.2  
assign (resid  45 and name HD*  )(resid  56 and name HB*  ) 1.8 0.0 6.6   
assign (resid  45 and name HD*  )(resid  60 and name HB*  ) 1.8 0.0 6.6   
assign (resid  45 and name HD*  )(resid  84 and name HE*  ) 1.8 0.0 7.6  
assign (resid  45 and name HD*  )(resid  84 and name HZ   ) 1.8 0.0 5.6   
assign (resid  45 and name HD*  )(resid  86 and name HB*  ) 1.8 0.0 6.6   
assign (resid  45 and name HD*  )(resid 104 and name HD*  ) 1.8 0.0 8.0  
assign (resid  45 and name HD*  )(resid 108 and name HB*  ) 1.8 0.0 6.6   
assign (resid  45 and name HD*  )(resid 113 and name HD1* ) 1.8 0.0 6.6   
assign (resid  45 and name HD*  )(resid 113 and name HG1* ) 1.8 0.0 6.6   
assign (resid  45 and name HD*  )(resid 115 and name HD*  ) 1.8 0.0 7.6   
assign (resid  45 and name HD*  )(resid 115 and name HE*  ) 1.8 0.0 5.6
assign (resid  45 and name HG   )(resid 115 and name HE*  ) 1.8 0.0 5.2 
assign (resid  46 and name HD*  )(resid  73 and name HG2* ) 1.8 0.0 6.2  
assign (resid  46 and name HD*  )(resid  83 and name HB*  ) 1.8 0.0 4.2  
assign (resid  46 and name HD*  )(resid  84 and name HN   ) 1.8 0.0 5.2   
assign (resid  46 and name HD*  )(resid 114 and name HD1* ) 1.8 0.0 6.2  
assign (resid  46 and name HD*  )(resid 114 and name HG2* ) 1.8 0.0 6.2  
assign (resid  46 and name HE*  )(resid  73 and name HG2* ) 1.8 0.0 6.2  
assign (resid  46 and name HE*  )(resid 114 and name HD1* ) 1.8 0.0 6.2  
assign (resid  46 and name HE*  )(resid 116 and name HN   ) 1.8 0.0 5.6   
assign (resid  46 and name HZ   )(resid 114 and name HD1* ) 1.8 0.0 4.2 
assign (resid  46 and name HZ   )(resid 114 and name HG2* ) 1.8 0.0 4.2 
assign (resid  47 and name HB*  )(resid  53 and name HD*  ) 1.8 0.0 6.6   
assign (resid  47 and name HB*  )(resid  56 and name HB*  ) 1.8 0.0 5.2   
assign (resid  47 and name HB*  )(resid 113 and name HB   ) 1.8 0.0 4.2   
assign (resid  47 and name HB*  )(resid 113 and name HD1* ) 1.8 0.0 5.2   
assign (resid  47 and name HB*  )(resid 113 and name HG2* ) 1.8 0.0 5.2   
assign (resid  47 and name HB*  )(resid 114 and name HG2* ) 1.8 0.0 6.2  
assign (resid  48 and name HG*  )(resid  81 and name HD*  ) 1.8 0.0 6.6   
assign (resid  50 and name HB*  )(resid  82 and name HD*  ) 1.8 0.0 5.6   
assign (resid  50 and name HD*  )(resid  82 and name HD*  ) 1.8 0.0 7.6   
assign (resid  52 and name HB*  )(resid 113 and name HG2* ) 1.8 0.0 5.2  
assign (resid  52 and name HG*  )(resid  84 and name HE*  ) 1.8 0.0 6.2  
assign (resid  53 and name HD*  )(resid  56 and name HB*  ) 1.8 0.0 6.6  
assign (resid  53 and name HD*  )(resid  70 and name HB*  ) 1.8 0.0 5.6   
assign (resid  53 and name HD*  )(resid  82 and name HD*  ) 1.8 0.0 8.0   
assign (resid  53 and name HD*  )(resid  84 and name HD*  ) 1.8 0.0 6.6   
assign (resid  53 and name HD*  )(resid  84 and name HE*  ) 1.8 0.0 7.6   
assign (resid  53 and name HG   )(resid  56 and name HB*  ) 1.8 0.0 4.2   
assign (resid  54 and name HB*  )(resid  57 and name HB*  ) 1.8 0.0 5.2   
assign (resid  56 and name HA   )(resid 111 and name HE*  ) 1.8 0.0 5.2   
assign (resid  56 and name HB*  )(resid  59 and name HB*  ) 1.8 0.0 5.2   
assign (resid  56 and name HB*  )(resid  84 and name HD*  ) 1.8 0.0 6.2   
assign (resid  56 and name HB*  )(resid  84 and name HE*  ) 1.8 0.0 6.2   
assign (resid  56 and name HB*  )(resid  84 and name HZ   ) 1.8 0.0 5.2   
assign (resid  56 and name HB*  )(resid 107 and name HD*  ) 1.8 0.0 6.6   
assign (resid  56 and name HB*  )(resid 107 and name HG   ) 1.8 0.0 4.2   
assign (resid  56 and name HB*  )(resid 108 and name HB*  ) 1.8 0.0 5.2  
assign (resid  56 and name HB*  )(resid 111 and name HD*  ) 1.8 0.0 6.2   
assign (resid  56 and name HB*  )(resid 111 and name HE*  ) 1.8 0.0 6.2  
assign (resid  56 and name HB*  )(resid 113 and name HD1* ) 1.8 0.0 5.2   
assign (resid  56 and name HB*  )(resid 113 and name HG2* ) 1.8 0.0 5.2   
assign (resid  57 and name HA   )(resid  84 and name HE*  ) 1.8 0.0 5.2   
assign (resid  57 and name HA   )(resid  84 and name HZ   ) 1.8 0.0 3.2  
assign (resid  57 and name HB*  )(resid  60 and name HB*  ) 1.8 0.0 5.2   
assign (resid  57 and name HB*  )(resid  84 and name HD*  ) 1.8 0.0 6.2  
assign (resid  57 and name HB*  )(resid  84 and name HE*  ) 1.8 0.0 6.2   
assign (resid  57 and name HB*  )(resid  84 and name HZ   ) 1.8 0.0 4.2  
assign (resid  59 and name HB*  )(resid  60 and name HB*  ) 1.8 0.0 5.2   
assign (resid  59 and name HG*  )(resid 107 and name HD*  ) 1.8 0.0 6.6  
assign (resid  60 and name HB*  )(resid  63 and name HE*  ) 1.8 0.0 4.2   
assign (resid  60 and name HB*  )(resid  65 and name HB*  ) 1.8 0.0 5.2   
assign (resid  60 and name HB*  )(resid  65 and name HD*  ) 1.8 0.0 6.2   
assign (resid  60 and name HB*  )(resid  67 and name HG1* ) 1.8 0.0 5.2   
assign (resid  60 and name HB*  )(resid  67 and name HG2* ) 1.8 0.0 5.2   
assign (resid  60 and name HB*  )(resid  84 and name HD*  ) 1.8 0.0 6.2  
assign (resid  60 and name HB*  )(resid  84 and name HE*  ) 1.8 0.0 6.2  
assign (resid  60 and name HB*  )(resid  84 and name HZ   ) 1.8 0.0 5.2   
assign (resid  60 and name HB*  )(resid  86 and name HB*  ) 1.8 0.0 5.2   
assign (resid  60 and name HB*  )(resid 104 and name HD2* ) 1.8 0.0 5.2  
assign (resid  60 and name HB*  )(resid 107 and name HD*  ) 1.8 0.0 6.6   
assign (resid  61 and name HD*  )(resid  67 and name HG1* ) 1.8 0.0 6.2   
assign (resid  61 and name HD*  )(resid  67 and name HN   ) 1.8 0.0 5.2   
assign (resid  63 and name HE*  )(resid  59 and name HG*  ) 1.8 0.0 5.2  
assign (resid  63 and name HE*  )(resid  65 and name HD*  ) 1.8 0.0 6.2   
assign (resid  63 and name HE*  )(resid 103 and name HD*  ) 1.8 0.0 5.2  
assign (resid  63 and name HE*  )(resid 103 and name HG*  ) 1.8 0.0 5.2   
assign (resid  63 and name HE*  )(resid 104 and name HD2* ) 1.8 0.0 5.2  
assign (resid  63 and name HE*  )(resid 107 and name HB*  ) 1.8 0.0 5.2  
assign (resid  63 and name HE*  )(resid 107 and name HD*  ) 1.8 0.0 5.6  
assign (resid  63 and name HE*  )(resid 107 and name HG   ) 1.8 0.0 4.2   
assign (resid  63 and name HN   )(resid  65 and name HD*  ) 1.8 0.0 5.2   
assign (resid  64 and name HN   )(resid  65 and name HD*  ) 1.8 0.0 4.2  
assign (resid  65 and name HB*  )(resid  86 and name HB*  ) 1.8 0.0 5.2   
assign (resid  65 and name HD*  )(resid  86 and name HB*  ) 1.8 0.0 6.2   
assign (resid  65 and name HD*  )(resid  87 and name HN   ) 1.8 0.0 5.2   
assign (resid  65 and name HD*  )(resid  88 and name HB*  ) 1.8 0.0 6.2   
assign (resid  65 and name HD*  )(resid  88 and name HE*  ) 1.8 0.0 6.2   
assign (resid  65 and name HE*  )(resid  88 and name HB*  ) 1.8 0.0 6.2   
assign (resid  65 and name HE*  )(resid  88 and name HE*  ) 1.8 0.0 6.2   
assign (resid  67 and name HG2* )(resid  84 and name HD*  ) 1.8 0.0 6.2   
assign (resid  67 and name HG2* )(resid  84 and name HE*  ) 1.8 0.0 6.2   
assign (resid  68 and name HD*  )(resid  87 and name HG2* ) 1.8 0.0 6.6   
assign (resid  70 and name HB*  )(resid  82 and name HD1* ) 1.8 0.0 5.2   
assign (resid  70 and name HB*  )(resid  82 and name HD2* ) 1.8 0.0 5.2   
assign (resid  70 and name HB*  )(resid  82 and name HG   ) 1.8 0.0 4.2   
assign (resid  70 and name HB*  )(resid  83 and name HB*  ) 1.8 0.0 5.2   
assign (resid  70 and name HB*  )(resid  84 and name HD*  ) 1.8 0.0 6.2   
assign (resid  71 and name HG2  )(resid  73 and name HG2* ) 1.8 0.0 5.2   
assign (resid  72 and name HB*  )(resid  82 and name HD*  ) 1.8 0.0 6.6   
assign (resid  72 and name HG*  )(resid  82 and name HD*  ) 1.8 0.0 6.6   
assign (resid  73 and name HB   )(resid  81 and name HD*  ) 1.8 0.0 5.6   
assign (resid  73 and name HG2* )(resid  81 and name HB*  ) 1.8 0.0 6.6   
assign (resid  73 and name HG2* )(resid  81 and name HD*  ) 1.8 0.0 6.6   
assign (resid  73 and name HG2* )(resid  81 and name HG   ) 1.8 0.0 4.2   
assign (resid  73 and name HG2* )(resid  83 and name HB*  ) 1.8 0.0 5.2   
assign (resid  75 and name HB*  )(resid  81 and name HD*  ) 1.8 0.0 6.6   
assign (resid  84 and name HD*  )(resid  86 and name HB*  ) 1.8 0.0 6.2   
assign (resid  84 and name HE*  )(resid  86 and name HB*  ) 1.8 0.0 6.2   
assign (resid  84 and name HE*  )(resid 113 and name HD1* ) 1.8 0.0 6.2   
assign (resid  84 and name HZ   )(resid 113 and name HD1* ) 1.8 0.0 5.2  
assign (resid  86 and name HB*  )(resid 104 and name HD1* ) 1.8 0.0 5.2   
assign (resid  86 and name HB*  )(resid 104 and name HD2* ) 1.8 0.0 5.2  
assign (resid  87 and name HG2* )(resid  89 and name HE2* ) 1.8 0.0 5.2   
assign (resid  91 and name HB*  )(resid  93 and name HB*  ) 1.8 0.0 5.2   
assign (resid  91 and name HB*  )(resid  96 and name HD*  ) 1.8 0.0 6.6   
assign (resid  92 and name HD*  )(resid  97 and name HD1* ) 1.8 0.0 6.6  
assign (resid  92 and name HD*  )(resid 118 and name HH2  ) 1.8 0.0 5.6  
assign (resid  92 and name HD*  )(resid 120 and name HG2* ) 1.8 0.0 6.6  
assign (resid  94 and name HB*  )(resid  97 and name HD1* ) 1.8 0.0 4.2   
assign (resid  97 and name HD1* )(resid 118 and name HH2  ) 1.8 0.0 5.2 
assign (resid  97 and name HD1* )(resid 118 and name HZ2  ) 1.8 0.0 5.2 
assign (resid  97 and name HD1* )(resid 120 and name HG2* ) 1.8 0.0 5.2   
assign (resid  97 and name HG2* )(resid 101 and name HG2* ) 1.8 0.0 4.2  
assign (resid  97 and name HG2* )(resid 118 and name HE1  ) 1.8 0.0 4.2   
assign (resid  97 and name HG2* )(resid 118 and name HZ2  ) 1.8 0.0 4.2  
assign (resid 101 and name HG*  )(resid 115 and name HD*  ) 1.8 0.0 7.6   
assign (resid 101 and name HG1* )(resid 105 and name HG*  ) 1.8 0.0 5.6  
assign (resid 101 and name HG1* )(resid 115 and name HE*  ) 1.8 0.0 6.2   
assign (resid 101 and name HG2* )(resid 105 and name HG*  ) 1.8 0.0 6.6   
assign (resid 101 and name HG2* )(resid 115 and name HE*  ) 1.8 0.0 6.2   
assign (resid 102 and name HG*  )(resid 106 and name HD2* ) 1.8 0.0 5.2   
assign (resid 104 and name HD*  )(resid 107 and name HD*  ) 1.8 0.0 8.0   
assign (resid 104 and name HD*  )(resid 107 and name HG   ) 1.8 0.0 6.6  
assign (resid 104 and name HD*  )(resid 115 and name HD*  ) 1.8 0.0 7.6   
assign (resid 105 and name HG*  )(resid 108 and name HB*  ) 1.8 0.0 6.6  
assign (resid 105 and name HG*  )(resid 115 and name HD*  ) 1.8 0.0 7.6   
assign (resid 107 and name HD*  )(resid 108 and name HB*  ) 1.8 0.0 6.6   
assign (resid 107 and name HD*  )(resid 113 and name HD1* ) 1.8 0.0 6.6  
assign (resid 107 and name HG   )(resid 108 and name HB*  ) 1.8 0.0 4.2  
assign (resid 108 and name HB*  )(resid 113 and name HD1* ) 1.8 0.0 5.2  
assign (resid 108 and name HB*  )(resid 113 and name HG2* ) 1.8 0.0 5.2   
assign (resid 108 and name HB*  )(resid 115 and name HD*  ) 1.8 0.0 6.2   
assign (resid 111 and name HB*  )(resid 113 and name HD1* ) 1.8 0.0 5.2   
assign (resid 118 and name HE3  )(resid 119 and name HN   ) 1.8 0.0 4.2   
assign (resid 118 and name HE3  )(resid 120 and name HN   ) 1.8 0.0 4.2   
assign (resid 118 and name HZ3  )(resid 119 and name HN   ) 1.8 0.0 4.2   
assign (resid 118 and name HZ3  )(resid 120 and name HG2* ) 1.8 0.0 4.2   
assign (resid 118 and name HZ3  )(resid 120 and name HN   ) 1.8 0.0 4.2   
assign (resid 122 and name HD*  )(resid 123 and name HN   ) 1.8 0.0 5.2   
assign (resid 122 and name HD*  )(resid 124 and name HN   ) 1.8 0.0 5.2   
assign (resid 122 and name HD*  )(resid 125 and name HD*  ) 1.8 0.0 7.6  
assign (resid 122 and name HE*  )(resid 125 and name HD*  ) 1.8 0.0 7.6  

 remarks intraresidue               
assign (resid  24 and name HA   )(resid  24 and name HD1* ) 1.8 0.0 3.2   
assign (resid  43 and name HD2  )(resid  43 and name HN   ) 1.8 0.0 3.2   
assign (resid  88 and name HA   )(resid  88 and name HE*  ) 1.8 0.0 4.2   
assign (resid 110 and name HA   )(resid 110 and name HD*  ) 1.8 0.0 3.2   
assign (resid 110 and name HA   )(resid 110 and name HE*  ) 1.8 0.0 4.2   

 remarks other sequential              
assign (resid   9 and name HA   )(resid  10 and name HG*  ) 1.8 0.0 5.6  
assign (resid  14 and name HG2* )(resid  15 and name HA   ) 1.8 0.0 3.2  
assign (resid  16 and name HG2* )(resid  17 and name HA   ) 1.8 0.0 3.2  
assign (resid  21 and name HG2* )(resid  22 and name HA   ) 1.8 0.0 4.2  
assign (resid  24 and name HG2* )(resid  25 and name HA   ) 1.8 0.0 4.2   
assign (resid  24 and name HN   )(resid  25 and name HD1* ) 1.8 0.0 4.2   
assign (resid  25 and name HN   )(resid  26 and name HB*  ) 1.8 0.0 4.2   
assign (resid  26 and name HN   )(resid  27 and name HB*  ) 1.8 0.0 4.2   
assign (resid  26 and name HG*  )(resid  27 and name HB*  ) 1.8 0.0 6.2   
assign (resid  27 and name HB*  )(resid  28 and name HA   ) 1.8 0.0 4.2   
assign (resid  27 and name HN   )(resid  28 and name HB*  ) 1.8 0.0 4.2   
assign (resid  28 and name HN   )(resid  29 and name HD*  ) 1.8 0.0 5.6   
assign (resid  29 and name HN   )(resid  30 and name HB*  ) 1.8 0.0 4.2   
assign (resid  30 and name HN   )(resid  31 and name HB*  ) 1.8 0.0 4.2   
assign (resid  32 and name HN   )(resid  33 and name HB*  ) 1.8 0.0 4.2   
assign (resid  51 and name HN   )(resid  52 and name HB*  ) 1.8 0.0 4.2   
assign (resid  56 and name HN   )(resid  57 and name HB*  ) 1.8 0.0 4.2   
assign (resid  59 and name HN   )(resid  60 and name HB*  ) 1.8 0.0 4.2   
assign (resid  66 and name HA   )(resid  67 and name HG1* ) 1.8 0.0 4.2   
assign (resid  66 and name HN   )(resid  65 and name HD*  ) 1.8 0.0 5.2   
assign (resid  86 and name HN   )(resid  87 and name HG2* ) 1.8 0.0 4.2   
assign (resid  90 and name HG   )(resid  91 and name HN   ) 1.8 0.0 3.2   
assign (resid  98 and name HN   )(resid  99 and name HB*  ) 1.8 0.0 4.2   
assign (resid  98 and name HN   )(resid  99 and name HG*  ) 1.8 0.0 4.2   
assign (resid 100 and name HN   )(resid 101 and name HG*  ) 1.8 0.0 5.6   
assign (resid 103 and name HN   )(resid 104 and name HG   ) 1.8 0.0 3.2   
assign (resid 105 and name HN   )(resid 106 and name HB*  ) 1.8 0.0 4.2   
assign (resid 107 and name HN   )(resid 108 and name HB*  ) 1.8 0.0 4.2   
assign (resid 108 and name HB*  )(resid 109 and name HA   ) 1.8 0.0 3.2  
assign (resid 109 and name HB*  )(resid 110 and name HA   ) 1.8 0.0 4.2   
assign (resid 109 and name HN   )(resid 110 and name HB*  ) 1.8 0.0 4.2   
assign (resid 110 and name HN   )(resid 111 and name HB*  ) 1.8 0.0 4.2   
assign (resid 115 and name HD*  )(resid 116 and name HN   ) 1.8 0.0 5.2  
remarks table of backbone dihedrals 

remarks : PHI CONSTRAINTS

remarks:  HELIX
! phi is restrained to -57 + or - 25 degrees for J < 6
assign (resid    9 and  name C    ) (resid   10 and  name N    ) 
       (resid   10 and  name CA   ) (resid   10 and  name C    ) 1.0 -57.0 25 2

assign (resid   10 and  name C    ) (resid   11 and  name N    ) 
       (resid   11 and  name CA   ) (resid   11 and  name C    ) 1.0 -57.0 25 2

assign (resid   11 and  name C    ) (resid   12 and  name N    ) 
       (resid   12 and  name CA   ) (resid   12 and  name C    ) 1.0 -57.0 25 2

assign (resid   13 and  name C    ) (resid   14 and  name N    ) 
       (resid   14 and  name CA   ) (resid   14 and  name C    ) 1.0 -57.0 25 2

assign (resid   14 and  name C    ) (resid   15 and  name N    ) 
       (resid   15 and  name CA   ) (resid   15 and  name C    ) 1.0 -57.0 25 2

assign (resid   15 and  name C    ) (resid   16 and  name N    ) 
       (resid   16 and  name CA   ) (resid   16 and  name C    ) 1.0 -57.0 25 2

assign (resid   20 and  name C    ) (resid   21 and  name N    ) 
       (resid   21 and  name CA   ) (resid   21 and  name C    ) 1.0 -57.0 25 2

assign (resid   22 and  name C    ) (resid   23 and  name N    ) 
       (resid   23 and  name CA   ) (resid   23 and  name C    ) 1.0 -57.0 25 2

assign (resid   23 and  name C    ) (resid   24 and  name N    ) 
       (resid   24 and  name CA   ) (resid   24 and  name C    ) 1.0 -57.0 25 2

assign (resid   25 and  name C   ) (resid    26 and  name N    ) 
       (resid   26 and  name CA   ) (resid   26 and  name C    ) 1.0 -57.0 25 2

assign (resid   26 and  name C    ) (resid   27 and  name N    ) 
       (resid   27 and  name CA   ) (resid   27 and  name C    ) 1.0 -57.0 25 2

assign (resid   29 and  name C    ) (resid   30 and  name N    ) 
       (resid   30 and  name CA   ) (resid   30 and  name C    ) 1.0 -57.0 25 2

assign (resid   49 and  name C    ) (resid   50 and  name N    ) 
       (resid   50 and  name CA   ) (resid   50 and  name C    ) 1.0 -57.0 25 2

assign (resid   50 and  name C    ) (resid   51 and  name N    ) 
       (resid   51 and  name CA   ) (resid   51 and  name C    ) 1.0 -57.0 25 2

assign (resid   59 and  name C    ) (resid   60 and  name N    ) 
       (resid   60 and  name CA   ) (resid   60 and  name C    ) 1.0 -57.0 25 2

assign (resid   60 and  name C    ) (resid   61 and  name N    ) 
       (resid   61 and  name CA   ) (resid   61 and  name C    ) 1.0 -57.0 25 2

assign (resid   93 and  name C    ) (resid   94 and  name N    ) 
       (resid   94 and  name CA   ) (resid   94 and  name C    ) 1.0 -57.0 25 2

assign (resid   94 and  name C    ) (resid   95 and  name N    ) 
       (resid   95 and  name CA   ) (resid   95 and  name C    ) 1.0 -57.0 25 2

assign (resid   96 and  name C    ) (resid   97 and  name N    ) 
       (resid   97 and  name CA   ) (resid   97 and  name C    ) 1.0 -57.0 25 2

assign (resid   98 and  name C    ) (resid   99 and  name N    ) 
       (resid   99 and  name CA   ) (resid   99 and  name C    ) 1.0 -57.0 25 2

assign (resid  100 and  name C    ) (resid  101 and  name N    ) 
       (resid  101 and  name CA   ) (resid  101 and  name C    ) 1.0 -57.0 25 2

assign (resid  101 and  name C    ) (resid  102 and  name N    ) 
       (resid  102 and  name CA   ) (resid  102 and  name C    ) 1.0 -57.0 25 2

assign (resid  103 and  name C    ) (resid  104 and  name N    ) 
       (resid  104 and  name CA   ) (resid  104 and  name C    ) 1.0 -57.0 25 2

assign (resid  106 and  name C    ) (resid  107 and  name N    ) 
       (resid  107 and  name CA   ) (resid  107 and  name C    ) 1.0 -57.0 25 2

assign (resid  107 and  name C    ) (resid  108 and  name N    ) 
       (resid  108 and  name CA   ) (resid  108 and  name C    ) 1.0 -57.0 25 2

assign (resid  108 and  name C    ) (resid  109 and  name N    ) 
       (resid  109 and  name CA   ) (resid  109 and  name C    ) 1.0 -57.0 25 2

assign (resid  109 and  name C    ) (resid  110 and  name N    ) 
       (resid  110 and  name CA   ) (resid  110 and  name C    ) 1.0 -57.0 25 2

remarks:  SHEET
! phi is restrained to -139 (used to be -120) + or - 40 degrees for J > 8
assign (resid   38 and  name C    ) (resid   39 and  name N   ) 
       (resid   39 and  name CA   ) (resid   39 and  name C   ) 1.0 -139.0 40 2

assign (resid   39 and  name C    ) (resid   40 and  name N   ) 
       (resid   40 and  name CA   ) (resid   40 and  name C   ) 1.0 -139.0 40 2

assign (resid   41 and  name C    ) (resid   42 and  name N   ) 
       (resid   42 and  name CA   ) (resid   42 and  name C   ) 1.0 -139.0 40 2

assign (resid   43 and  name C    ) (resid   44 and  name N   ) 
       (resid   44 and  name CA   ) (resid   44 and  name C   ) 1.0 -139.0 40 2

assign (resid   45 and  name C    ) (resid   46 and  name N   ) 
       (resid   46 and  name CA   ) (resid   46 and  name C   ) 1.0 -139.0 40 2

assign (resid   46 and  name C    ) (resid   47 and  name N   ) 
       (resid   47 and  name CA   ) (resid   47 and  name C   ) 1.0 -139.0 40 2

assign (resid   67 and  name C    ) (resid   68 and  name N   ) 
       (resid   68 and  name CA   ) (resid   68 and  name C   ) 1.0 -139.0 40 2

assign (resid   72 and  name C    ) (resid   73 and  name N   ) 
       (resid   73 and  name CA   ) (resid   73 and  name C   ) 1.0 -139.0 40 2

assign (resid   80 and  name C    ) (resid   81 and  name N   ) 
       (resid   81 and  name CA   ) (resid   81 and  name C   ) 1.0 -139.0 40 2

assign (resid   82 and  name C    ) (resid   83 and  name N   ) 
       (resid   83 and  name CA   ) (resid   83 and  name C   ) 1.0 -139.0 40 2

assign (resid   86 and  name C    ) (resid   87 and  name N   ) 
       (resid   87 and  name CA   ) (resid   87 and  name C   ) 1.0 -139.0 40 2

assign (resid   87 and  name C    ) (resid   88 and  name N   ) 
       (resid   88 and  name CA   ) (resid   88 and  name C   ) 1.0 -139.0 40 2

assign (resid  115 and  name C    ) (resid  116 and  name N   ) 
       (resid  116 and  name CA   ) (resid  116 and  name C   ) 1.0 -139.0 40 2

assign (resid  117 and  name C    ) (resid  118 and  name N   ) 
       (resid  118 and  name CA   ) (resid  118 and  name C   ) 1.0 -139.0 40 2

remarks: OTHER
! phi is restrained to -57 + or - 30 degrees for J < 6
assign (resid   32 and  name C    ) (resid   33 and  name N   )
       (resid   33 and  name CA   ) (resid   33 and  name C   ) 1.0 -57.0 30 2


! phi is restrained to -130 + or - 50 degrees for J > 8
assign (resid   92 and  name C    ) (resid   93 and  name N   )
       (resid   93 and  name CA   ) (resid   93 and  name C   ) 1.0 -130.0 50 2

assign (resid  112 and  name C    ) (resid  113 and  name N   )
       (resid  113 and  name CA   ) (resid  113 and  name C   ) 1.0 -130.0 50 2


remarks: PSI CONSTRAINTS

remarks:  HELIX

assign (resid   10 and  name N    ) (resid   10 and  name CA   ) 
       (resid   10 and  name C    ) (resid   11 and  name N    ) 1.0 -47.0 30 2

assign (resid   11 and  name N    ) (resid   11 and  name CA   ) 
       (resid   11 and  name C    ) (resid   12 and  name N    ) 1.0 -47.0 30 2

assign (resid   12 and  name N    ) (resid   12 and  name CA   ) 
       (resid   12 and  name C    ) (resid   13 and  name N    ) 1.0 -47.0 30 2

assign (resid   14 and  name N    ) (resid   14 and  name CA   ) 
       (resid   14 and  name C    ) (resid   15 and  name N    ) 1.0 -47.0 30 2

assign (resid   15 and  name N    ) (resid   15 and  name CA   ) 
       (resid   15 and  name C    ) (resid   16 and  name N    ) 1.0 -47.0 30 2

assign (resid   16 and  name N    ) (resid   16 and  name CA   ) 
       (resid   16 and  name C    ) (resid   17 and  name N    ) 1.0 -47.0 30 2

assign (resid   21 and  name N    ) (resid   21 and  name CA   ) 
       (resid   21 and  name C    ) (resid   22 and  name N    ) 1.0 -47.0 30 2

assign (resid   22 and  name N    ) (resid   22 and  name CA   ) 
       (resid   22 and  name C    ) (resid   23 and  name N    ) 1.0 -47.0 30 2

assign (resid   23 and  name N    ) (resid   23 and  name CA   ) 
       (resid   23 and  name C    ) (resid   24 and  name N    ) 1.0 -47.0 30 2

assign (resid   24 and  name N    ) (resid   24 and  name CA   ) 
       (resid   24 and  name C    ) (resid   25 and  name N    ) 1.0 -47.0 30 2

assign (resid   26 and  name N    ) (resid   26 and  name CA   ) 
       (resid   26 and  name C    ) (resid   27 and  name N    ) 1.0 -47.0 30 2

assign (resid   27 and  name N    ) (resid   27 and  name CA   ) 
       (resid   27 and  name C    ) (resid   28 and  name N    ) 1.0 -47.0 30 2

assign (resid   28 and  name N    ) (resid   28 and  name CA   ) 
       (resid   28 and  name C    ) (resid   29 and  name N    ) 1.0 -47.0 30 2

assign (resid   29 and  name N    ) (resid   29 and  name CA   ) 
       (resid   29 and  name C    ) (resid   30 and  name N    ) 1.0 -47.0 30 2

assign (resid   51 and  name N    ) (resid   51 and  name CA   ) 
       (resid   51 and  name C    ) (resid   52 and  name N    ) 1.0 -47.0 30 2

assign (resid   52 and  name N    ) (resid   52 and  name CA   ) 
       (resid   52 and  name C    ) (resid   53 and  name N    ) 1.0 -47.0 30 2

assign (resid   53 and  name N    ) (resid   53 and  name CA   ) 
       (resid   53 and  name C    ) (resid   54 and  name N    ) 1.0 -47.0 30 2

assign (resid   55 and  name N    ) (resid   55 and  name CA   ) 
       (resid   55 and  name C    ) (resid   56 and  name N    ) 1.0 -47.0 30 2

assign (resid   56 and  name N    ) (resid   56 and  name CA   ) 
       (resid   56 and  name C    ) (resid   57 and  name N    ) 1.0 -47.0 30 2

assign (resid   57 and  name N    ) (resid   57 and  name CA   ) 
       (resid   57 and  name C    ) (resid   58 and  name N    ) 1.0 -47.0 30 2

assign (resid   58 and  name N    ) (resid   58 and  name CA   ) 
       (resid   58 and  name C    ) (resid   59 and  name N    ) 1.0 -47.0 30 2

assign (resid   59 and  name N    ) (resid   59 and  name CA   ) 
       (resid   59 and  name C    ) (resid   60 and  name N    ) 1.0 -47.0 30 2

assign (resid   61 and  name N    ) (resid   61 and  name CA   ) 
       (resid   61 and  name C    ) (resid   62 and  name N    ) 1.0 -47.0 30 2

assign (resid   62 and  name N    ) (resid   62 and  name CA   ) 
       (resid   62 and  name C    ) (resid   63 and  name N    ) 1.0 -47.0 30 2

assign (resid   63 and  name N    ) (resid   63 and  name CA   ) 
       (resid   63 and  name C    ) (resid   64 and  name N    ) 1.0 -47.0 30 2

assign (resid   95 and  name N    ) (resid   95 and  name CA   ) 
       (resid   95 and  name C    ) (resid   96 and  name N    ) 1.0 -47.0 30 2

assign (resid   97 and  name N    ) (resid   97 and  name CA   ) 
       (resid   97 and  name C    ) (resid   98 and  name N    ) 1.0 -47.0 30 2

assign (resid   98 and  name N    ) (resid   98 and  name CA   ) 
       (resid   98 and  name C    ) (resid   99 and  name N    ) 1.0 -47.0 30 2

assign (resid   99 and  name N    ) (resid   99 and  name CA   ) 
       (resid   99 and  name C    ) (resid  100 and  name N    ) 1.0 -47.0 30 2

assign (resid  100 and  name N    ) (resid  100 and  name CA   ) 
       (resid  100 and  name C    ) (resid  101 and  name N    ) 1.0 -47.0 30 2

assign (resid  101 and  name N    ) (resid  101 and  name CA   ) 
       (resid  101 and  name C    ) (resid  102 and  name N    ) 1.0 -47.0 30 2

assign (resid  102 and  name N    ) (resid  102 and  name CA   ) 
       (resid  102 and  name C    ) (resid  103 and  name N    ) 1.0 -47.0 30 2

assign (resid  103 and  name N    ) (resid  103 and  name CA   ) 
       (resid  103 and  name C    ) (resid  104 and  name N    ) 1.0 -47.0 30 2

assign (resid  105 and  name N    ) (resid  105 and  name CA   ) 
       (resid  105 and  name C    ) (resid  106 and  name N    ) 1.0 -47.0 30 2

assign (resid  106 and  name N    ) (resid  106 and  name CA   ) 
       (resid  106 and  name C    ) (resid  107 and  name N    ) 1.0 -47.0 30 2

assign (resid  107 and  name N    ) (resid  107 and  name CA   ) 
       (resid  107 and  name C    ) (resid  108 and  name N    ) 1.0 -47.0 30 2

assign (resid  108 and  name N    ) (resid  108 and  name CA   ) 
       (resid  108 and  name C    ) (resid  109 and  name N    ) 1.0 -47.0 30 2

assign (resid  109 and  name N    ) (resid  109 and  name CA   ) 
       (resid  109 and  name C    ) (resid  110 and  name N    ) 1.0 -47.0 30 2

assign (resid  110 and  name N    ) (resid  110 and  name CA   ) 
       (resid  110 and  name C    ) (resid  111 and  name N    ) 1.0 -47.0 30 2

assign (resid  111 and  name N    ) (resid  111 and  name CA   ) 
       (resid  111 and  name C    ) (resid  112 and  name N    ) 1.0 -47.0 30 2


remarks: SHEET

assign (resid   40 and  name N    ) (resid   40 and  name CA   ) 
       (resid   40 and  name C    ) (resid   41 and  name N    ) 1.0  140.0 40 2

assign (resid   41 and  name N    ) (resid   41 and  name CA   ) 
       (resid   41 and  name C    ) (resid   42 and  name N    ) 1.0  140.0 40 2

assign (resid   42 and  name N    ) (resid   42 and  name CA   ) 
       (resid   42 and  name C    ) (resid   43 and  name N    ) 1.0  140.0 40 2

assign (resid   44 and  name N    ) (resid   44 and  name CA   ) 
       (resid   44 and  name C    ) (resid   45 and  name N    ) 1.0  140.0 40 2

assign (resid   46 and  name N    ) (resid   46 and  name CA   ) 
       (resid   46 and  name C    ) (resid   47 and  name N    ) 1.0  140.0 40 2

assign (resid   47 and  name N    ) (resid   47 and  name CA   ) 
       (resid   47 and  name C    ) (resid   48 and  name N    ) 1.0  140.0 40 2

assign (resid   67 and  name N    ) (resid   67 and  name CA   ) 
       (resid   67 and  name C    ) (resid   68 and  name N    ) 1.0  140.0 40 2

assign (resid   68 and  name N    ) (resid   68 and  name CA   ) 
       (resid   68 and  name C    ) (resid   69 and  name N    ) 1.0  140.0 40 2

assign (resid   70 and  name N    ) (resid   70 and  name CA   ) 
       (resid   70 and  name C    ) (resid   71 and  name N    ) 1.0  140.0 40 2

assign (resid   82 and  name N    ) (resid   82 and  name CA   ) 
       (resid   82 and  name C    ) (resid   83 and  name N    ) 1.0  140.0 40 2

assign (resid   83 and  name N    ) (resid   83 and  name CA   ) 
       (resid   83 and  name C    ) (resid   84 and  name N    ) 1.0  140.0 40 2

assign (resid   84 and  name N    ) (resid   84 and  name CA   ) 
       (resid   84 and  name C    ) (resid   85 and  name N    ) 1.0  140.0 40 2

assign (resid   85 and  name N    ) (resid   85 and  name CA   ) 
       (resid   85 and  name C    ) (resid   86 and  name N    ) 1.0  140.0 40 2

assign (resid   86 and  name N    ) (resid   86 and  name CA   ) 
       (resid   86 and  name C    ) (resid   87 and  name N    ) 1.0  140.0 40 2

assign (resid   87 and  name N    ) (resid   87 and  name CA   ) 
       (resid   87 and  name C    ) (resid   88 and  name N    ) 1.0  140.0 40 2

assign (resid   89 and  name N    ) (resid   89 and  name CA   ) 
       (resid   89 and  name C    ) (resid   90 and  name N    ) 1.0  140.0 40 2

assign (resid  113 and  name N    ) (resid  113 and  name CA   ) 
       (resid  113 and  name C    ) (resid  114 and  name N    ) 1.0  140.0 40 2

assign (resid  114 and  name N    ) (resid  114 and  name CA   ) 
       (resid  114 and  name C    ) (resid  115 and  name N    ) 1.0  140.0 40 2

assign (resid  118 and  name N    ) (resid  118 and  name CA   ) 
       (resid  118 and  name C    ) (resid  119 and  name N    ) 1.0  140.0 40 2

assign (resid  119 and  name N    ) (resid  119 and  name CA   ) 
       (resid  119 and  name C    ) (resid  120 and  name N    ) 1.0  140.0 40 2

assign (resid  120 and  name N    ) (resid  120 and  name CA   ) 
       (resid  120 and  name C    ) (resid  121 and  name N    ) 1.0  140.0 40 2

assign (resid  121 and  name N    ) (resid  121 and  name CA   ) 
       (resid  121 and  name C    ) (resid  122 and  name N    ) 1.0  140.0 40 2


remarks: X1 restraints

remarks:  Threonine

! T21, HNHB small, NOEab small, constrained to g+
assign (resid   21 and  name N    ) (resid   21 and  name CA   ) 
       (resid   21 and  name CB   ) (resid   21 and  name OG1  ) 1.0  -60.0 30 2

! T120, HNHB small, NOEab strong, constrained to t
assign (resid  120 and  name N    ) (resid  120 and  name CA   ) 
       (resid  120 and  name CB   ) (resid  120 and  name OG1  ) 1.0  180.0 30 2

remarks:  Isoleucine
! I24, HNHB small, NOEab small, constrained to g+
assign (resid   24 and  name N    ) (resid   24 and  name CA   ) 
       (resid   24 and  name CB   ) (resid   24 and  name CG1  ) 1.0  -60.0 30 2

! I25, HNHB small, NOEab small, constrained to g+
assign (resid   25 and  name N    ) (resid   25 and  name CA   ) 
       (resid   25 and  name CB   ) (resid   25 and  name CG1  ) 1.0  -60.0 30 2

! I41, HNHB small, NOEab small, constrained to g+
assign (resid   41 and  name N    ) (resid   41 and  name CA   ) 
       (resid   41 and  name CB   ) (resid   41 and  name CG1  ) 1.0  -60.0 30 2

! I97, HNHB small, NOEab small, constrained to g+
assign (resid   97 and  name N    ) (resid   97 and  name CA   ) 
       (resid   97 and  name CB   ) (resid   97 and  name CG1  ) 1.0  -60.0 30 2

! I113, HNHB strong, constrained to g-
assign (resid  113 and  name N    ) (resid  113 and  name CA   ) 
       (resid  113 and  name CB   ) (resid  113 and  name CG1  ) 1.0   60.0 30 2

! I114, HNHB small, NOEab strong, constrained to t
assign (resid  114 and  name N    ) (resid  114 and  name CA   ) 
       (resid  114 and  name CB   ) (resid  114 and  name CG1  ) 1.0  180.0 30 2

remarks:  Valine
! V67, HNHB small, NOEab med, constrained to g-
assign (resid  67 and  name N    ) (resid  67 and  name CA   ) 
       (resid  67 and  name CB   ) (resid  67 and  name CG1  ) 1.0   60.0 30 2

! V101, HNHB small, NOEab small, constrained to t
assign (resid 101 and  name N    ) (resid 101 and  name CA   ) 
       (resid 101 and  name CB   ) (resid 101 and  name CG1  ) 1.0   180.0 30 2

! V105, HNHB small, NOEab small, constrained to t
assign (resid 105 and  name N    ) (resid 105 and  name CA   ) 
       (resid 105 and  name CB   ) (resid 105 and  name CG1  ) 1.0   180.0 30 2




  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1          1H        MET   1 -17.443 -13.116  10.314
    2   2H    MET   1          2H        MET   1 -15.967 -12.294  10.138
    3   3H    MET   1          3H        MET   1 -16.951 -12.581   8.783
    4    HA   MET   1           HA       MET   1 -18.470 -10.971   9.341
    5   1HB   MET   1          2HB       MET   1 -17.415 -11.402  12.137
    6   2HB   MET   1          1HB       MET   1 -18.399  -9.994  11.731
    7   1HG   MET   1          2HG       MET   1 -20.083 -11.653  10.737
    8   2HG   MET   1          1HG       MET   1 -19.168 -12.913  11.565
    9   1HE   MET   1          1HE       MET   1 -22.611 -11.680  12.533
   10   2HE   MET   1          2HE       MET   1 -22.102 -12.967  13.624
   11   3HE   MET   1          3HE       MET   1 -21.660 -13.040  11.920
   12    H    SER   2           H        SER   2 -16.472  -9.587  11.756
   13    HA   SER   2           HA       SER   2 -15.195  -7.602  11.619
   14   1HB   SER   2          2HB       SER   2 -13.098  -7.971  10.583
   15   2HB   SER   2          1HB       SER   2 -13.647  -9.587  11.023
   16    HG   SER   2           HG       SER   2 -14.676  -9.109   8.678
   17    H    HIS   3           H        HIS   3 -16.910  -6.255  10.745
   18    HA   HIS   3           HA       HIS   3 -17.198  -6.001   7.846
   19   1HB   HIS   3          2HB       HIS   3 -18.594  -3.951   8.568
   20   2HB   HIS   3          1HB       HIS   3 -19.180  -5.540   9.063
   21    HD2  HIS   3           HD2      HIS   3 -20.292  -3.736  11.252
   22    HE1  HIS   3           HE1      HIS   3 -16.650  -3.950  13.382
   23    HE2  HIS   3           HE2      HIS   3 -19.103  -3.324  13.538
   24    H    GLN   4           H        GLN   4 -14.515  -5.616   8.580
   25    HA   GLN   4           HA       GLN   4 -14.063  -2.692   8.626
   26   1HB   GLN   4          2HB       GLN   4 -12.680  -4.615   9.842
   27   2HB   GLN   4          1HB       GLN   4 -11.836  -4.663   8.294
   28   1HG   GLN   4          2HG       GLN   4 -10.650  -3.086   9.655
   29   2HG   GLN   4          1HG       GLN   4 -11.578  -2.139   8.490
   30   1HE2  GLN   4          1HE2      GLN   4 -11.294  -0.417  10.293
   31   2HE2  GLN   4          2HE2      GLN   4 -12.457  -0.394  11.528
   32    H    ASP   5           H        ASP   5 -15.248  -2.721   6.409
   33    HA   ASP   5           HA       ASP   5 -13.166  -2.631   4.327
   34   1HB   ASP   5          2HB       ASP   5 -15.492  -4.551   4.275
   35   2HB   ASP   5          1HB       ASP   5 -14.774  -3.955   2.777
   36    H    ASP   6           H        ASP   6 -14.019  -0.348   4.991
   37    HA   ASP   6           HA       ASP   6 -16.161   0.366   3.048
   38   1HB   ASP   6          2HB       ASP   6 -16.306   0.574   5.946
   39   2HB   ASP   6          1HB       ASP   6 -16.475   2.156   5.184
   40    H    TYR   7           H        TYR   7 -14.193   1.008   1.817
   41    HA   TYR   7           HA       TYR   7 -12.689   3.313   2.888
   42   1HB   TYR   7          2HB       TYR   7 -12.365   2.407   0.063
   43   2HB   TYR   7          1HB       TYR   7 -11.139   2.898   1.232
   44    HD1  TYR   7           HD1      TYR   7 -11.897   0.220  -0.619
   45    HD2  TYR   7           HD2      TYR   7 -11.615   1.233   3.545
   46    HE1  TYR   7           HE1      TYR   7 -11.464  -2.160  -0.070
   47    HE2  TYR   7           HE2      TYR   7 -11.181  -1.147   4.095
   48    HH   TYR   7           HH       TYR   7 -11.648  -3.670   1.827
   49    H    LEU   8           H        LEU   8 -14.169   5.038   2.908
   50    HA   LEU   8           HA       LEU   8 -14.912   6.055   0.219
   51   1HB   LEU   8          2HB       LEU   8 -16.813   4.748   1.600
   52   2HB   LEU   8          1HB       LEU   8 -16.977   6.337   2.349
   53    HG   LEU   8           HG       LEU   8 -17.183   7.355   0.089
   54   1HD1  LEU   8          1HD1      LEU   8 -16.562   4.560  -0.671
   55   2HD1  LEU   8          2HD1      LEU   8 -16.238   6.062  -1.538
   56   3HD1  LEU   8          3HD1      LEU   8 -17.840   5.329  -1.612
   57   1HD2  LEU   8          1HD2      LEU   8 -19.450   6.545  -0.356
   58   2HD2  LEU   8          2HD2      LEU   8 -19.193   6.640   1.386
   59   3HD2  LEU   8          3HD2      LEU   8 -19.133   5.078   0.571
   60    H    SER   9           H        SER   9 -12.988   7.389   0.987
   61    HA   SER   9           HA       SER   9 -13.930   9.941   1.958
   62   1HB   SER   9          2HB       SER   9 -12.290   8.210   3.824
   63   2HB   SER   9          1HB       SER   9 -12.413   9.958   3.999
   64    HG   SER   9           HG       SER   9 -14.381   9.736   4.722
   65    H    VAL  10           H        VAL  10 -12.740   9.656  -0.341
   66    HA   VAL  10           HA       VAL  10 -10.085   9.375  -0.828
   67    HB   VAL  10           HB       VAL  10 -10.208  11.208  -2.445
   68   1HG1  VAL  10          1HG1      VAL  10 -12.817   9.697  -2.115
   69   2HG1  VAL  10          2HG1      VAL  10 -11.404   9.166  -3.027
   70   3HG1  VAL  10          3HG1      VAL  10 -12.340  10.555  -3.580
   71   1HG2  VAL  10          1HG2      VAL  10 -12.386  12.089  -0.599
   72   2HG2  VAL  10          2HG2      VAL  10 -12.587  12.429  -2.318
   73   3HG2  VAL  10          3HG2      VAL  10 -11.183  13.054  -1.453
   74    H    GLU  11           H        GLU  11 -11.503  12.039   1.029
   75    HA   GLU  11           HA       GLU  11  -9.321  13.753   1.303
   76   1HB   GLU  11          2HB       GLU  11 -11.074  12.913   3.626
   77   2HB   GLU  11          1HB       GLU  11 -10.267  14.465   3.396
   78   1HG   GLU  11          2HG       GLU  11 -11.663  14.557   1.176
   79   2HG   GLU  11          1HG       GLU  11 -12.681  13.364   1.984
   80    H    GLU  12           H        GLU  12  -9.868  10.643   2.911
   81    HA   GLU  12           HA       GLU  12  -7.541  10.868   4.632
   82   1HB   GLU  12          2HB       GLU  12  -8.975   8.345   3.750
   83   2HB   GLU  12          1HB       GLU  12  -7.960   8.545   5.179
   84   1HG   GLU  12          2HG       GLU  12 -10.222  10.448   4.927
   85   2HG   GLU  12          1HG       GLU  12 -10.660   8.768   5.243
   86    H    LEU  13           H        LEU  13  -8.198   8.854   1.736
   87    HA   LEU  13           HA       LEU  13  -5.624   7.800   1.392
   88   1HB   LEU  13          2HB       LEU  13  -7.180   8.748  -1.000
   89   2HB   LEU  13          1HB       LEU  13  -6.273   7.249  -0.786
   90    HG   LEU  13           HG       LEU  13  -8.929   7.976   0.476
   91   1HD1  LEU  13          1HD1      LEU  13  -9.682   6.951  -1.391
   92   2HD1  LEU  13          2HD1      LEU  13  -9.034   5.457  -0.712
   93   3HD1  LEU  13          3HD1      LEU  13  -8.061   6.411  -1.832
   94   1HD2  LEU  13          1HD2      LEU  13  -7.670   6.850   2.182
   95   2HD2  LEU  13          2HD2      LEU  13  -7.013   5.694   1.023
   96   3HD2  LEU  13          3HD2      LEU  13  -8.720   5.631   1.460
   97    H    ILE  14           H        ILE  14  -6.897  10.929   0.255
   98    HA   ILE  14           HA       ILE  14  -4.588  11.775  -1.164
   99    HB   ILE  14           HB       ILE  14  -6.689  13.337   0.359
  100   1HG1  ILE  14          2HG1      ILE  14  -6.231  13.194  -2.622
  101   2HG1  ILE  14          1HG1      ILE  14  -7.186  11.968  -1.786
  102   1HG2  ILE  14          1HG2      ILE  14  -4.143  14.210  -0.775
  103   2HG2  ILE  14          2HG2      ILE  14  -5.281  15.100   0.236
  104   3HG2  ILE  14          3HG2      ILE  14  -5.517  15.035  -1.511
  105   1HD1  ILE  14          1HD1      ILE  14  -8.286  14.218  -2.773
  106   2HD1  ILE  14          2HD1      ILE  14  -7.829  14.810  -1.176
  107   3HD1  ILE  14          3HD1      ILE  14  -8.905  13.420  -1.326
  108    H    GLU  15           H        GLU  15  -5.470  12.257   2.265
  109    HA   GLU  15           HA       GLU  15  -3.192  13.749   3.033
  110   1HB   GLU  15          2HB       GLU  15  -5.389  12.682   4.336
  111   2HB   GLU  15          1HB       GLU  15  -4.047  11.775   5.032
  112   1HG   GLU  15          2HG       GLU  15  -4.027  13.623   6.423
  113   2HG   GLU  15          1HG       GLU  15  -2.942  14.198   5.156
  114    H    ILE  16           H        ILE  16  -3.668  10.216   3.437
  115    HA   ILE  16           HA       ILE  16  -1.122   9.504   4.280
  116    HB   ILE  16           HB       ILE  16  -2.853   8.039   2.265
  117   1HG1  ILE  16          2HG1      ILE  16  -2.585   7.485   5.221
  118   2HG1  ILE  16          1HG1      ILE  16  -3.756   8.658   4.618
  119   1HG2  ILE  16          1HG2      ILE  16  -0.691   7.055   2.146
  120   2HG2  ILE  16          2HG2      ILE  16  -1.592   6.037   3.270
  121   3HG2  ILE  16          3HG2      ILE  16  -0.436   7.219   3.883
  122   1HD1  ILE  16          1HD1      ILE  16  -4.502   6.772   3.004
  123   2HD1  ILE  16          2HD1      ILE  16  -4.985   6.648   4.695
  124   3HD1  ILE  16          3HD1      ILE  16  -3.631   5.693   4.094
  125    H    GLN  17           H        GLN  17  -1.959   9.005   0.848
  126    HA   GLN  17           HA       GLN  17   0.513   8.797  -0.270
  127   1HB   GLN  17          2HB       GLN  17  -2.043   9.556  -1.225
  128   2HB   GLN  17          1HB       GLN  17  -0.906  10.748  -1.857
  129   1HG   GLN  17          2HG       GLN  17  -0.909   8.991  -3.460
  130   2HG   GLN  17          1HG       GLN  17   0.568   8.754  -2.524
  131   1HE2  GLN  17          1HE2      GLN  17   0.802   6.506  -2.365
  132   2HE2  GLN  17          2HE2      GLN  17  -0.421   5.446  -1.854
  133    H    LYS  18           H        LYS  18  -0.903  11.802   0.947
  134    HA   LYS  18           HA       LYS  18   1.009  13.634  -0.059
  135   1HB   LYS  18          2HB       LYS  18  -1.188  13.896   1.484
  136   2HB   LYS  18          1HB       LYS  18   0.053  14.040   2.730
  137   1HG   LYS  18          2HG       LYS  18   0.028  16.237   2.091
  138   2HG   LYS  18          1HG       LYS  18   1.126  15.649   0.842
  139   1HD   LYS  18          2HD       LYS  18  -0.506  16.853  -0.369
  140   2HD   LYS  18          1HD       LYS  18  -1.016  15.173  -0.533
  141   1HE   LYS  18          2HE       LYS  18  -2.758  15.418   1.029
  142   2HE   LYS  18          1HE       LYS  18  -2.048  16.873   1.729
  143   1HZ   LYS  18          1HZ       LYS  18  -3.939  17.400   0.322
  144   2HZ   LYS  18          2HZ       LYS  18  -3.189  16.647  -1.003
  145   3HZ   LYS  18          3HZ       LYS  18  -2.512  18.050  -0.324
  146    H    GLU  19           H        GLU  19   0.996  12.110   3.187
  147    HA   GLU  19           HA       GLU  19   3.660  12.958   3.829
  148   1HB   GLU  19          2HB       GLU  19   2.438  12.338   5.713
  149   2HB   GLU  19          1HB       GLU  19   1.755  10.916   4.925
  150   1HG   GLU  19          2HG       GLU  19   3.845   9.731   5.077
  151   2HG   GLU  19          1HG       GLU  19   4.692  11.183   5.609
  152    H    GLU  20           H        GLU  20   2.530   9.636   3.088
  153    HA   GLU  20           HA       GLU  20   4.921   8.320   2.819
  154   1HB   GLU  20          2HB       GLU  20   2.309   8.107   1.440
  155   2HB   GLU  20          1HB       GLU  20   3.664   7.338   0.611
  156   1HG   GLU  20          2HG       GLU  20   4.238   6.147   2.725
  157   2HG   GLU  20          1HG       GLU  20   2.809   6.854   3.481
  158    H    THR  21           H        THR  21   3.391   9.774  -0.081
  159    HA   THR  21           HA       THR  21   5.456   9.656  -1.871
  160    HB   THR  21           HB       THR  21   3.964  12.252  -1.441
  161    HG1  THR  21           HG1      THR  21   3.060   9.988  -2.876
  162   1HG2  THR  21          1HG2      THR  21   5.794  12.019  -3.199
  163   2HG2  THR  21          2HG2      THR  21   4.213  12.514  -3.805
  164   3HG2  THR  21          3HG2      THR  21   4.750  10.845  -4.001
  165    H    ARG  22           H        ARG  22   5.082  12.476   0.317
  166    HA   ARG  22           HA       ARG  22   7.483  13.763  -0.169
  167   1HB   ARG  22          2HB       ARG  22   6.338  13.299   2.602
  168   2HB   ARG  22          1HB       ARG  22   7.384  14.630   2.104
  169   1HG   ARG  22          2HG       ARG  22   4.928  14.268   0.487
  170   2HG   ARG  22          1HG       ARG  22   4.671  14.800   2.149
  171   1HD   ARG  22          2HD       ARG  22   6.775  16.135   0.468
  172   2HD   ARG  22          1HD       ARG  22   5.082  16.593   0.279
  173    HE   ARG  22           HE       ARG  22   5.507  16.694   3.021
  174   1HH1  ARG  22          1HH2      ARG  22   6.968  18.022   0.195
  175   2HH1  ARG  22          2HH2      ARG  22   7.505  19.465   0.989
  176   1HH2  ARG  22          2HH1      ARG  22   6.201  18.568   4.075
  177   2HH2  ARG  22          1HH1      ARG  22   7.071  19.774   3.187
  178    H    ASP  23           H        ASP  23   7.037  11.137   2.232
  179    HA   ASP  23           HA       ASP  23   9.686  10.883   3.091
  180   1HB   ASP  23          2HB       ASP  23   7.961   8.480   2.475
  181   2HB   ASP  23          1HB       ASP  23   9.143   8.671   3.772
  182    H    ILE  24           H        ILE  24   8.186   9.222   0.296
  183    HA   ILE  24           HA       ILE  24  10.530   7.914  -0.616
  184    HB   ILE  24           HB       ILE  24   8.472   9.044  -2.506
  185   1HG1  ILE  24          2HG1      ILE  24   8.165   6.774  -0.523
  186   2HG1  ILE  24          1HG1      ILE  24   7.133   8.195  -0.700
  187   1HG2  ILE  24          1HG2      ILE  24  10.630   7.459  -2.936
  188   2HG2  ILE  24          2HG2      ILE  24   9.159   7.369  -3.905
  189   3HG2  ILE  24          3HG2      ILE  24   9.415   6.231  -2.581
  190   1HD1  ILE  24          1HD1      ILE  24   7.158   5.685  -2.249
  191   2HD1  ILE  24          2HD1      ILE  24   7.052   7.147  -3.230
  192   3HD1  ILE  24          3HD1      ILE  24   5.844   6.831  -1.984
  193    H    ILE  25           H        ILE  25   9.148  10.998  -1.820
  194    HA   ILE  25           HA       ILE  25  11.182  11.750  -3.563
  195    HB   ILE  25           HB       ILE  25   9.846  13.653  -1.620
  196   1HG1  ILE  25          2HG1      ILE  25   8.031  12.463  -2.548
  197   2HG1  ILE  25          1HG1      ILE  25   8.203  13.848  -3.628
  198   1HG2  ILE  25          1HG2      ILE  25  10.206  14.493  -4.387
  199   2HG2  ILE  25          2HG2      ILE  25  11.741  14.059  -3.636
  200   3HG2  ILE  25          3HG2      ILE  25  10.720  15.293  -2.902
  201   1HD1  ILE  25          1HD1      ILE  25   9.702  12.381  -5.072
  202   2HD1  ILE  25          2HD1      ILE  25   7.999  11.923  -5.040
  203   3HD1  ILE  25          3HD1      ILE  25   9.173  11.019  -4.084
  204    H    GLN  26           H        GLN  26  11.140  12.074  -0.023
  205    HA   GLN  26           HA       GLN  26  13.538  13.556   0.276
  206   1HB   GLN  26          2HB       GLN  26  12.452  11.373   2.082
  207   2HB   GLN  26          1HB       GLN  26  13.641  12.591   2.542
  208   1HG   GLN  26          2HG       GLN  26  11.346  13.876   1.351
  209   2HG   GLN  26          1HG       GLN  26  10.823  12.816   2.660
  210   1HE2  GLN  26          1HE2      GLN  26  10.869  15.789   2.706
  211   2HE2  GLN  26          2HE2      GLN  26  11.902  16.224   3.981
  212    H    ALA  27           H        ALA  27  13.091  10.000   0.321
  213    HA   ALA  27           HA       ALA  27  15.865   9.361   0.485
  214   1HB   ALA  27          1HB       ALA  27  15.193   7.180   0.233
  215   2HB   ALA  27          2HB       ALA  27  14.101   7.561  -1.099
  216   3HB   ALA  27          3HB       ALA  27  13.610   7.884   0.564
  217    H    LEU  28           H        LEU  28  13.736   9.414  -2.401
  218    HA   LEU  28           HA       LEU  28  15.649   8.904  -4.368
  219   1HB   LEU  28          2HB       LEU  28  13.010  10.003  -4.280
  220   2HB   LEU  28          1HB       LEU  28  13.990  11.033  -5.324
  221    HG   LEU  28           HG       LEU  28  14.063   8.029  -5.593
  222   1HD1  LEU  28          1HD1      LEU  28  12.412   8.444  -7.512
  223   2HD1  LEU  28          2HD1      LEU  28  12.075   9.996  -6.744
  224   3HD1  LEU  28          3HD1      LEU  28  11.744   8.494  -5.880
  225   1HD2  LEU  28          1HD2      LEU  28  14.560   8.833  -8.007
  226   2HD2  LEU  28          2HD2      LEU  28  15.818   9.071  -6.794
  227   3HD2  LEU  28          3HD2      LEU  28  14.796  10.424  -7.282
  228    H    LEU  29           H        LEU  29  14.825  12.082  -2.952
  229    HA   LEU  29           HA       LEU  29  16.756  13.576  -4.436
  230   1HB   LEU  29          2HB       LEU  29  15.054  14.004  -2.072
  231   2HB   LEU  29          1HB       LEU  29  16.565  14.914  -2.035
  232    HG   LEU  29           HG       LEU  29  14.586  14.900  -4.334
  233   1HD1  LEU  29          1HD1      LEU  29  13.651  16.143  -2.498
  234   2HD1  LEU  29          2HD1      LEU  29  14.314  17.322  -3.628
  235   3HD1  LEU  29          3HD1      LEU  29  15.198  16.915  -2.157
  236   1HD2  LEU  29          1HD2      LEU  29  16.266  17.063  -4.632
  237   2HD2  LEU  29          2HD2      LEU  29  16.445  15.529  -5.483
  238   3HD2  LEU  29          3HD2      LEU  29  17.362  15.831  -4.008
  239    H    GLU  30           H        GLU  30  16.971  12.709  -0.966
  240    HA   GLU  30           HA       GLU  30  19.581  13.264  -0.414
  241   1HB   GLU  30          2HB       GLU  30  17.749  11.824   0.899
  242   2HB   GLU  30          1HB       GLU  30  18.742  10.490   0.312
  243   1HG   GLU  30          2HG       GLU  30  20.733  11.979   1.193
  244   2HG   GLU  30          1HG       GLU  30  19.476  12.712   2.189
  245    H    ASP  31           H        ASP  31  18.459  10.559  -2.408
  246    HA   ASP  31           HA       ASP  31  20.942   9.217  -2.721
  247   1HB   ASP  31          2HB       ASP  31  18.676   8.412  -3.523
  248   2HB   ASP  31          1HB       ASP  31  18.832   9.536  -4.874
  249    H    GLY  32           H        GLY  32  19.676  12.139  -4.221
  250   1HA   GLY  32          2HA       GLY  32  21.507  13.751  -4.902
  251   2HA   GLY  32          1HA       GLY  32  22.255  12.380  -5.723
  252    H    SER  33           H        SER  33  18.976  12.023  -6.053
  253    HA   SER  33           HA       SER  33  18.897  12.356  -8.836
  254   1HB   SER  33          2HB       SER  33  16.741  12.538  -6.733
  255   2HB   SER  33          1HB       SER  33  16.370  12.733  -8.444
  256    HG   SER  33           HG       SER  33  17.150  10.683  -8.822
  257    H    ASP  34           H        ASP  34  17.512  14.078 -10.002
  258    HA   ASP  34           HA       ASP  34  17.938  16.767  -8.776
  259   1HB   ASP  34          2HB       ASP  34  19.142  15.663 -11.200
  260   2HB   ASP  34          1HB       ASP  34  18.265  17.161 -11.512
  261    HA   PRO  35           HA       PRO  35  13.734  17.391  -9.994
  262   1HB   PRO  35          2HB       PRO  35  13.698  20.128 -10.115
  263   2HB   PRO  35          1HB       PRO  35  13.706  19.216  -8.594
  264   1HG   PRO  35          2HG       PRO  35  15.939  20.599  -9.985
  265   2HG   PRO  35          1HG       PRO  35  15.596  20.462  -8.253
  266   1HD   PRO  35          2HD       PRO  35  17.492  18.946  -9.539
  267   2HD   PRO  35          1HD       PRO  35  16.642  18.414  -8.071
  268    H    ASP  36           H        ASP  36  16.360  18.442 -11.976
  269    HA   ASP  36           HA       ASP  36  14.554  19.235 -14.191
  270   1HB   ASP  36          2HB       ASP  36  17.258  19.207 -15.051
  271   2HB   ASP  36          1HB       ASP  36  16.265  20.616 -14.678
  272    H    ALA  37           H        ALA  37  15.957  16.441 -12.976
  273    HA   ALA  37           HA       ALA  37  16.708  15.130 -15.438
  274   1HB   ALA  37          1HB       ALA  37  17.612  14.113 -13.528
  275   2HB   ALA  37          2HB       ALA  37  16.285  13.026 -13.938
  276   3HB   ALA  37          3HB       ALA  37  16.089  14.205 -12.642
  277    H    LEU  38           H        LEU  38  13.707  16.065 -14.212
  278    HA   LEU  38           HA       LEU  38  11.508  15.537 -14.839
  279   1HB   LEU  38          2HB       LEU  38  13.203  15.043 -17.194
  280   2HB   LEU  38          1HB       LEU  38  11.685  14.143 -17.209
  281    HG   LEU  38           HG       LEU  38  11.898  17.125 -16.701
  282   1HD1  LEU  38          1HD1      LEU  38  12.538  16.496 -19.021
  283   2HD1  LEU  38          2HD1      LEU  38  11.018  17.388 -18.974
  284   3HD1  LEU  38          3HD1      LEU  38  11.007  15.638 -19.192
  285   1HD2  LEU  38          1HD2      LEU  38   9.792  15.154 -16.389
  286   2HD2  LEU  38          2HD2      LEU  38   9.333  16.361 -17.591
  287   3HD2  LEU  38          3HD2      LEU  38   9.781  16.865 -15.961
  288    H    TYR  39           H        TYR  39  10.281  13.949 -13.953
  289    HA   TYR  39           HA       TYR  39  11.357  11.157 -14.033
  290   1HB   TYR  39          2HB       TYR  39  10.080  12.767 -11.873
  291   2HB   TYR  39          1HB       TYR  39   9.689  11.049 -11.937
  292    HD1  TYR  39           HD1      TYR  39  11.116   9.540 -10.877
  293    HD2  TYR  39           HD2      TYR  39  12.658  13.339 -12.158
  294    HE1  TYR  39           HE1      TYR  39  13.302   9.004  -9.837
  295    HE2  TYR  39           HE2      TYR  39  14.844  12.802 -11.117
  296    HH   TYR  39           HH       TYR  39  15.922  11.387  -9.735
  297    H    GLU  40           H        GLU  40   9.855   9.477 -14.449
  298    HA   GLU  40           HA       GLU  40   7.346  10.396 -15.757
  299   1HB   GLU  40          2HB       GLU  40   8.379   7.568 -15.811
  300   2HB   GLU  40          1HB       GLU  40   7.395   8.408 -17.009
  301   1HG   GLU  40          2HG       GLU  40   9.401   9.952 -17.369
  302   2HG   GLU  40          1HG       GLU  40  10.338   8.790 -16.429
  303    H    ILE  41           H        ILE  41   5.671  10.461 -14.313
  304    HA   ILE  41           HA       ILE  41   5.595   8.731 -11.973
  305    HB   ILE  41           HB       ILE  41   3.208  10.247 -12.997
  306   1HG1  ILE  41          2HG1      ILE  41   5.003  11.830 -13.317
  307   2HG1  ILE  41          1HG1      ILE  41   4.182  12.264 -11.817
  308   1HG2  ILE  41          1HG2      ILE  41   4.367   9.468 -10.321
  309   2HG2  ILE  41          2HG2      ILE  41   2.769   9.110 -10.975
  310   3HG2  ILE  41          3HG2      ILE  41   3.162  10.749 -10.453
  311   1HD1  ILE  41          1HD1      ILE  41   5.906  11.016 -10.535
  312   2HD1  ILE  41          2HD1      ILE  41   6.611  12.322 -11.486
  313   3HD1  ILE  41          3HD1      ILE  41   6.744  10.655 -12.044
  314    H    GLU  42           H        GLU  42   4.210   6.963 -11.621
  315    HA   GLU  42           HA       GLU  42   2.766   5.950 -14.038
  316   1HB   GLU  42          2HB       GLU  42   4.977   4.762 -13.377
  317   2HB   GLU  42          1HB       GLU  42   4.061   4.134 -12.008
  318   1HG   GLU  42          2HG       GLU  42   2.411   3.148 -13.523
  319   2HG   GLU  42          1HG       GLU  42   3.250   3.833 -14.914
  320    H    HIS  43           H        HIS  43   0.707   5.151 -13.644
  321    HA   HIS  43           HA       HIS  43  -0.143   4.886 -10.797
  322   1HB   HIS  43          2HB       HIS  43  -1.930   6.165 -12.864
  323   2HB   HIS  43          1HB       HIS  43  -2.064   6.225 -11.107
  324    HD2  HIS  43           HD2      HIS  43   0.304   7.771 -13.902
  325    HE1  HIS  43           HE1      HIS  43   0.601  10.108 -10.397
  326    HE2  HIS  43           HE2      HIS  43   1.319   9.917 -12.821
  327    H    HIS  44           H        HIS  44  -1.347   3.057 -10.459
  328    HA   HIS  44           HA       HIS  44  -2.091   1.476 -12.871
  329   1HB   HIS  44          2HB       HIS  44  -1.867   0.640  -9.963
  330   2HB   HIS  44          1HB       HIS  44  -2.243  -0.435 -11.308
  331    HD2  HIS  44           HD2      HIS  44  -0.031  -1.039 -13.011
  332    HE1  HIS  44           HE1      HIS  44   2.873   0.890 -10.630
  333    HE2  HIS  44           HE2      HIS  44   2.517  -0.658 -12.607
  334    H    LEU  45           H        LEU  45  -4.212   1.167 -13.376
  335    HA   LEU  45           HA       LEU  45  -6.266   1.677 -11.278
  336   1HB   LEU  45          2HB       LEU  45  -6.138   2.913 -14.039
  337   2HB   LEU  45          1HB       LEU  45  -7.623   2.853 -13.090
  338    HG   LEU  45           HG       LEU  45  -5.798   3.824 -11.264
  339   1HD1  LEU  45          1HD1      LEU  45  -4.046   4.150 -12.882
  340   2HD1  LEU  45          2HD1      LEU  45  -4.726   5.739 -12.534
  341   3HD1  LEU  45          3HD1      LEU  45  -5.161   4.900 -14.023
  342   1HD2  LEU  45          1HD2      LEU  45  -8.000   4.736 -11.477
  343   2HD2  LEU  45          2HD2      LEU  45  -7.714   5.215 -13.150
  344   3HD2  LEU  45          3HD2      LEU  45  -6.896   6.063 -11.837
  345    H    PHE  46           H        PHE  46  -7.860   0.130 -11.316
  346    HA   PHE  46           HA       PHE  46  -8.057  -1.558 -13.775
  347   1HB   PHE  46          2HB       PHE  46  -8.810  -3.207 -11.663
  348   2HB   PHE  46          1HB       PHE  46  -7.269  -3.263 -12.519
  349    HD1  PHE  46           HD1      PHE  46  -8.755  -2.913  -9.351
  350    HD2  PHE  46           HD2      PHE  46  -5.519  -1.396 -11.734
  351    HE1  PHE  46           HE1      PHE  46  -7.579  -2.187  -7.291
  352    HE2  PHE  46           HE2      PHE  46  -4.343  -0.671  -9.675
  353    HZ   PHE  46           HZ       PHE  46  -5.373  -1.066  -7.453
  354    H    ALA  47           H        ALA  47 -10.178  -2.626 -14.021
  355    HA   ALA  47           HA       ALA  47 -12.370  -1.345 -12.461
  356   1HB   ALA  47          1HB       ALA  47 -11.717  -0.376 -14.922
  357   2HB   ALA  47          2HB       ALA  47 -13.353  -0.343 -14.263
  358   3HB   ALA  47          3HB       ALA  47 -12.873  -1.632 -15.366
  359    H    GLU  48           H        GLU  48 -14.550  -2.444 -13.278
  360    HA   GLU  48           HA       GLU  48 -13.993  -5.378 -13.452
  361   1HB   GLU  48          2HB       GLU  48 -16.248  -3.849 -12.128
  362   2HB   GLU  48          1HB       GLU  48 -16.285  -5.595 -12.377
  363   1HG   GLU  48          2HG       GLU  48 -14.010  -4.199 -10.953
  364   2HG   GLU  48          1HG       GLU  48 -15.422  -4.829 -10.104
  365    H    ASP  49           H        ASP  49 -15.396  -2.695 -15.026
  366    HA   ASP  49           HA       ASP  49 -17.031  -4.499 -16.760
  367   1HB   ASP  49          2HB       ASP  49 -17.566  -1.938 -15.599
  368   2HB   ASP  49          1HB       ASP  49 -17.507  -1.742 -17.351
  369    H    PHE  50           H        PHE  50 -16.071  -4.988 -18.670
  370    HA   PHE  50           HA       PHE  50 -13.639  -3.937 -19.604
  371   1HB   PHE  50          2HB       PHE  50 -15.476  -4.680 -21.769
  372   2HB   PHE  50          1HB       PHE  50 -13.937  -5.404 -21.306
  373    HD1  PHE  50           HD1      PHE  50 -17.573  -5.329 -20.576
  374    HD2  PHE  50           HD2      PHE  50 -13.832  -7.310 -19.848
  375    HE1  PHE  50           HE1      PHE  50 -18.778  -7.205 -19.492
  376    HE2  PHE  50           HE2      PHE  50 -15.037  -9.187 -18.764
  377    HZ   PHE  50           HZ       PHE  50 -17.510  -9.135 -18.585
  378    H    ASP  51           H        ASP  51 -16.956  -2.885 -20.352
  379    HA   ASP  51           HA       ASP  51 -16.130  -0.836 -22.221
  380   1HB   ASP  51          2HB       ASP  51 -18.398  -1.651 -22.342
  381   2HB   ASP  51          1HB       ASP  51 -18.688  -1.250 -20.649
  382    H    LYS  52           H        LYS  52 -17.494  -0.530 -18.916
  383    HA   LYS  52           HA       LYS  52 -17.035   2.178 -18.497
  384   1HB   LYS  52          2HB       LYS  52 -18.056   0.492 -16.869
  385   2HB   LYS  52          1HB       LYS  52 -16.404   0.091 -16.396
  386   1HG   LYS  52          2HG       LYS  52 -16.787   1.763 -14.866
  387   2HG   LYS  52          1HG       LYS  52 -16.248   2.769 -16.212
  388   1HD   LYS  52          2HD       LYS  52 -18.296   3.736 -15.403
  389   2HD   LYS  52          1HD       LYS  52 -18.678   2.932 -16.927
  390   1HE   LYS  52          2HE       LYS  52 -18.902   1.154 -14.605
  391   2HE   LYS  52          1HE       LYS  52 -20.006   2.529 -14.533
  392   1HZ   LYS  52          1HZ       LYS  52 -20.405   0.250 -15.952
  393   2HZ   LYS  52          2HZ       LYS  52 -19.858   1.337 -17.137
  394   3HZ   LYS  52          3HZ       LYS  52 -21.219   1.719 -16.195
  395    H    LEU  53           H        LEU  53 -14.695  -0.445 -18.497
  396    HA   LEU  53           HA       LEU  53 -12.493   0.994 -17.375
  397   1HB   LEU  53          2HB       LEU  53 -12.690  -1.527 -17.828
  398   2HB   LEU  53          1HB       LEU  53 -12.264  -1.148 -19.496
  399    HG   LEU  53           HG       LEU  53 -10.525   0.053 -17.409
  400   1HD1  LEU  53          1HD1      LEU  53 -10.600  -2.037 -16.350
  401   2HD1  LEU  53          2HD1      LEU  53  -9.246  -2.227 -17.462
  402   3HD1  LEU  53          3HD1      LEU  53 -10.823  -2.904 -17.869
  403   1HD2  LEU  53          1HD2      LEU  53  -8.844  -0.313 -19.063
  404   2HD2  LEU  53          2HD2      LEU  53 -10.281   0.172 -19.964
  405   3HD2  LEU  53          3HD2      LEU  53  -9.818  -1.528 -19.890
  406    H    GLU  54           H        GLU  54 -12.912   0.121 -20.826
  407    HA   GLU  54           HA       GLU  54 -11.017   1.915 -21.861
  408   1HB   GLU  54          2HB       GLU  54 -13.662   1.162 -23.148
  409   2HB   GLU  54          1HB       GLU  54 -12.225   1.753 -23.984
  410   1HG   GLU  54          2HG       GLU  54 -11.137  -0.253 -23.817
  411   2HG   GLU  54          1HG       GLU  54 -11.823  -0.607 -22.231
  412    H    LYS  55           H        LYS  55 -14.158   2.562 -20.535
  413    HA   LYS  55           HA       LYS  55 -14.551   5.150 -21.767
  414   1HB   LYS  55          2HB       LYS  55 -16.078   3.464 -20.186
  415   2HB   LYS  55          1HB       LYS  55 -15.724   4.807 -19.100
  416   1HG   LYS  55          2HG       LYS  55 -16.446   6.366 -20.972
  417   2HG   LYS  55          1HG       LYS  55 -17.035   4.938 -21.826
  418   1HD   LYS  55          2HD       LYS  55 -17.914   5.049 -19.029
  419   2HD   LYS  55          1HD       LYS  55 -18.492   6.409 -19.994
  420   1HE   LYS  55          2HE       LYS  55 -18.709   3.553 -20.958
  421   2HE   LYS  55          1HE       LYS  55 -19.970   4.313 -19.987
  422   1HZ   LYS  55          1HZ       LYS  55 -20.095   4.439 -22.546
  423   2HZ   LYS  55          2HZ       LYS  55 -18.938   5.673 -22.384
  424   3HZ   LYS  55          3HZ       LYS  55 -20.455   5.823 -21.633
  425    H    ALA  56           H        ALA  56 -13.650   4.291 -18.402
  426    HA   ALA  56           HA       ALA  56 -12.834   6.947 -17.708
  427   1HB   ALA  56          1HB       ALA  56 -13.282   5.480 -15.897
  428   2HB   ALA  56          2HB       ALA  56 -11.531   5.693 -15.868
  429   3HB   ALA  56          3HB       ALA  56 -12.229   4.223 -16.549
  430    H    ALA  57           H        ALA  57 -11.133   4.231 -19.179
  431    HA   ALA  57           HA       ALA  57  -8.480   5.310 -18.887
  432   1HB   ALA  57          1HB       ALA  57  -7.900   3.348 -19.839
  433   2HB   ALA  57          2HB       ALA  57  -8.816   3.726 -21.299
  434   3HB   ALA  57          3HB       ALA  57  -9.619   2.963 -19.927
  435    H    VAL  58           H        VAL  58 -11.030   5.731 -21.292
  436    HA   VAL  58           HA       VAL  58  -9.392   7.099 -23.232
  437    HB   VAL  58           HB       VAL  58 -12.324   6.752 -22.750
  438   1HG1  VAL  58          1HG1      VAL  58 -12.414   9.059 -23.237
  439   2HG1  VAL  58          2HG1      VAL  58 -12.625   8.297 -24.813
  440   3HG1  VAL  58          3HG1      VAL  58 -11.057   8.966 -24.360
  441   1HG2  VAL  58          1HG2      VAL  58 -12.193   5.497 -24.657
  442   2HG2  VAL  58          2HG2      VAL  58 -10.472   5.461 -24.274
  443   3HG2  VAL  58          3HG2      VAL  58 -11.090   6.628 -25.443
  444    H    GLU  59           H        GLU  59 -11.711   8.333 -20.791
  445    HA   GLU  59           HA       GLU  59 -11.290  11.082 -21.200
  446   1HB   GLU  59          2HB       GLU  59 -12.900   9.853 -19.562
  447   2HB   GLU  59          1HB       GLU  59 -11.557   9.944 -18.422
  448   1HG   GLU  59          2HG       GLU  59 -12.723  11.924 -17.972
  449   2HG   GLU  59          1HG       GLU  59 -11.483  12.468 -19.103
  450    H    ALA  60           H        ALA  60  -9.596   9.009 -18.815
  451    HA   ALA  60           HA       ALA  60  -7.739  10.840 -17.850
  452   1HB   ALA  60          1HB       ALA  60  -7.832   8.572 -16.981
  453   2HB   ALA  60          2HB       ALA  60  -6.196   8.877 -17.564
  454   3HB   ALA  60          3HB       ALA  60  -7.312   7.915 -18.533
  455    H    PHE  61           H        PHE  61  -7.134   8.652 -20.628
  456    HA   PHE  61           HA       PHE  61  -4.710   9.857 -21.457
  457   1HB   PHE  61          2HB       PHE  61  -5.117   7.848 -22.548
  458   2HB   PHE  61          1HB       PHE  61  -6.821   8.219 -22.814
  459    HD1  PHE  61           HD1      PHE  61  -3.439   9.575 -23.737
  460    HD2  PHE  61           HD2      PHE  61  -7.478   8.791 -24.971
  461    HE1  PHE  61           HE1      PHE  61  -2.905  10.405 -26.013
  462    HE2  PHE  61           HE2      PHE  61  -6.943   9.621 -27.246
  463    HZ   PHE  61           HZ       PHE  61  -4.657  10.428 -27.767
  464    H    LYS  62           H        LYS  62  -8.020  10.899 -21.881
  465    HA   LYS  62           HA       LYS  62  -7.563  12.720 -24.062
  466   1HB   LYS  62          2HB       LYS  62  -9.786  11.843 -22.740
  467   2HB   LYS  62          1HB       LYS  62  -9.623  13.470 -22.078
  468   1HG   LYS  62          2HG       LYS  62  -9.637  14.446 -24.289
  469   2HG   LYS  62          1HG       LYS  62  -9.567  12.855 -25.045
  470   1HD   LYS  62          2HD       LYS  62 -11.827  13.672 -23.209
  471   2HD   LYS  62          1HD       LYS  62 -11.878  13.954 -24.949
  472   1HE   LYS  62          2HE       LYS  62 -11.080  11.301 -24.763
  473   2HE   LYS  62          1HE       LYS  62 -12.256  11.463 -23.459
  474   1HZ   LYS  62          1HZ       LYS  62 -13.706  11.115 -25.124
  475   2HZ   LYS  62          2HZ       LYS  62 -12.633  11.640 -26.332
  476   3HZ   LYS  62          3HZ       LYS  62 -13.497  12.775 -25.408
  477    H    MET  63           H        MET  63  -7.421  13.077 -20.529
  478    HA   MET  63           HA       MET  63  -6.964  15.914 -20.540
  479   1HB   MET  63          2HB       MET  63  -6.325  13.733 -18.542
  480   2HB   MET  63          1HB       MET  63  -5.959  15.431 -18.236
  481   1HG   MET  63          2HG       MET  63  -8.448  15.846 -18.871
  482   2HG   MET  63          1HG       MET  63  -8.647  14.118 -18.579
  483   1HE   MET  63          1HE       MET  63  -9.572  14.038 -15.134
  484   2HE   MET  63          2HE       MET  63  -8.571  12.985 -16.130
  485   3HE   MET  63          3HE       MET  63  -9.962  13.796 -16.842
  486    H    GLY  64           H        GLY  64  -4.654  13.207 -20.095
  487   1HA   GLY  64          2HA       GLY  64  -2.678  13.890 -21.858
  488   2HA   GLY  64          1HA       GLY  64  -2.386  15.012 -20.528
  489    H    PHE  65           H        PHE  65  -3.398  11.580 -20.573
  490    HA   PHE  65           HA       PHE  65  -0.999  10.996 -18.882
  491   1HB   PHE  65          2HB       PHE  65  -3.862  10.089 -18.603
  492   2HB   PHE  65          1HB       PHE  65  -2.542   9.131 -17.931
  493    HD1  PHE  65           HD1      PHE  65  -4.098  12.517 -17.903
  494    HD2  PHE  65           HD2      PHE  65  -1.457   9.773 -15.917
  495    HE1  PHE  65           HE1      PHE  65  -3.993  14.034 -15.943
  496    HE2  PHE  65           HE2      PHE  65  -1.352  11.290 -13.959
  497    HZ   PHE  65           HZ       PHE  65  -2.619  13.421 -13.972
  498    H    GLU  66           H        GLU  66   0.258   9.335 -19.622
  499    HA   GLU  66           HA       GLU  66  -0.346   8.127 -22.187
  500   1HB   GLU  66          2HB       GLU  66   1.879   8.040 -20.220
  501   2HB   GLU  66          1HB       GLU  66   1.706   6.623 -21.255
  502   1HG   GLU  66          2HG       GLU  66   1.661   9.414 -22.402
  503   2HG   GLU  66          1HG       GLU  66   3.179   8.556 -22.131
  504    H    VAL  67           H        VAL  67  -2.458   7.161 -21.532
  505    HA   VAL  67           HA       VAL  67  -2.739   5.152 -19.553
  506    HB   VAL  67           HB       VAL  67  -4.580   6.261 -20.936
  507   1HG1  VAL  67          1HG1      VAL  67  -5.169   5.193 -23.045
  508   2HG1  VAL  67          2HG1      VAL  67  -3.835   4.051 -22.876
  509   3HG1  VAL  67          3HG1      VAL  67  -3.504   5.763 -23.139
  510   1HG2  VAL  67          1HG2      VAL  67  -4.765   3.244 -20.898
  511   2HG2  VAL  67          2HG2      VAL  67  -6.050   4.419 -20.613
  512   3HG2  VAL  67          3HG2      VAL  67  -4.778   4.194 -19.411
  513    H    LEU  68           H        LEU  68  -2.310   2.945 -19.552
  514    HA   LEU  68           HA       LEU  68  -0.848   1.907 -21.948
  515   1HB   LEU  68          2HB       LEU  68   0.372   2.177 -19.667
  516   2HB   LEU  68          1HB       LEU  68  -0.574   0.775 -19.168
  517    HG   LEU  68           HG       LEU  68   0.333  -0.103 -21.567
  518   1HD1  LEU  68          1HD1      LEU  68   2.419   0.720 -22.138
  519   2HD1  LEU  68          2HD1      LEU  68   2.783   1.237 -20.492
  520   3HD1  LEU  68          3HD1      LEU  68   1.688   2.190 -21.494
  521   1HD2  LEU  68          1HD2      LEU  68   0.546  -1.409 -19.571
  522   2HD2  LEU  68          2HD2      LEU  68   1.629  -0.228 -18.833
  523   3HD2  LEU  68          3HD2      LEU  68   2.184  -1.206 -20.193
  524    H    GLU  69           H        GLU  69  -1.497  -0.085 -22.778
  525    HA   GLU  69           HA       GLU  69  -4.151  -0.948 -22.455
  526   1HB   GLU  69          2HB       GLU  69  -2.455  -1.602 -24.276
  527   2HB   GLU  69          1HB       GLU  69  -1.897  -2.838 -23.148
  528   1HG   GLU  69          2HG       GLU  69  -3.875  -4.042 -23.270
  529   2HG   GLU  69          1HG       GLU  69  -4.836  -2.624 -23.689
  530    H    ALA  70           H        ALA  70  -5.082  -2.710 -21.277
  531    HA   ALA  70           HA       ALA  70  -3.647  -3.287 -18.743
  532   1HB   ALA  70          1HB       ALA  70  -5.850  -2.525 -18.321
  533   2HB   ALA  70          2HB       ALA  70  -5.954  -4.275 -18.134
  534   3HB   ALA  70          3HB       ALA  70  -6.528  -3.512 -19.617
  535    H    GLU  71           H        GLU  71  -4.367  -5.642 -17.903
  536    HA   GLU  71           HA       GLU  71  -4.410  -7.673 -20.013
  537   1HB   GLU  71          2HB       GLU  71  -1.999  -7.025 -19.897
  538   2HB   GLU  71          1HB       GLU  71  -1.995  -7.462 -18.188
  539   1HG   GLU  71          2HG       GLU  71  -3.031  -9.731 -19.183
  540   2HG   GLU  71          1HG       GLU  71  -2.105  -9.217 -20.594
  541    H    GLU  72           H        GLU  72  -5.030  -9.710 -19.168
  542    HA   GLU  72           HA       GLU  72  -6.699  -9.942 -17.032
  543   1HB   GLU  72          2HB       GLU  72  -4.724 -11.874 -18.193
  544   2HB   GLU  72          1HB       GLU  72  -5.582 -12.329 -16.721
  545   1HG   GLU  72          2HG       GLU  72  -6.885 -13.111 -18.602
  546   2HG   GLU  72          1HG       GLU  72  -7.739 -11.745 -17.885
  547    H    THR  73           H        THR  73  -6.492  -9.313 -14.944
  548    HA   THR  73           HA       THR  73  -3.802  -9.602 -13.664
  549    HB   THR  73           HB       THR  73  -5.454  -7.779 -12.206
  550    HG1  THR  73           HG1      THR  73  -6.387  -6.661 -13.701
  551   1HG2  THR  73          1HG2      THR  73  -3.032  -7.388 -13.983
  552   2HG2  THR  73          2HG2      THR  73  -3.013  -7.741 -12.255
  553   3HG2  THR  73          3HG2      THR  73  -3.640  -6.196 -12.834
  554    H    GLU  74           H        GLU  74  -4.038  -9.779 -11.181
  555    HA   GLU  74           HA       GLU  74  -6.486 -11.282 -10.403
  556   1HB   GLU  74          2HB       GLU  74  -4.899 -13.010 -11.049
  557   2HB   GLU  74          1HB       GLU  74  -3.634 -12.261 -10.075
  558   1HG   GLU  74          2HG       GLU  74  -6.130 -12.850  -8.609
  559   2HG   GLU  74          1HG       GLU  74  -5.255 -14.271  -9.181
  560    H    ASP  75           H        ASP  75  -7.219 -10.408  -8.530
  561    HA   ASP  75           HA       ASP  75  -5.206  -9.159  -6.698
  562   1HB   ASP  75          2HB       ASP  75  -7.143  -7.789  -8.003
  563   2HB   ASP  75          1HB       ASP  75  -8.037  -8.267  -6.560
  564    H    GLU  76           H        GLU  76  -5.630 -11.802  -6.305
  565    HA   GLU  76           HA       GLU  76  -6.624 -13.422  -4.884
  566   1HB   GLU  76          2HB       GLU  76  -6.316 -11.082  -2.977
  567   2HB   GLU  76          1HB       GLU  76  -6.383 -12.788  -2.535
  568   1HG   GLU  76          2HG       GLU  76  -4.071 -12.322  -2.561
  569   2HG   GLU  76          1HG       GLU  76  -4.359 -13.064  -4.135
  570    H    ASP  77           H        ASP  77  -8.516 -11.431  -6.235
  571    HA   ASP  77           HA       ASP  77 -10.880 -12.212  -4.668
  572   1HB   ASP  77          2HB       ASP  77  -9.913  -9.882  -3.885
  573   2HB   ASP  77          1HB       ASP  77 -10.676  -9.299  -5.365
  574    H    GLY  78           H        GLY  78  -9.321 -11.447  -7.571
  575   1HA   GLY  78          2HA       GLY  78 -11.937 -11.577  -9.016
  576   2HA   GLY  78          1HA       GLY  78 -10.627 -10.534  -9.571
  577    H    ASN  79           H        ASN  79  -8.437 -12.253  -9.199
  578    HA   ASN  79           HA       ASN  79  -7.311 -14.033 -10.238
  579   1HB   ASN  79          2HB       ASN  79  -9.327 -15.277  -9.143
  580   2HB   ASN  79          1HB       ASN  79  -9.978 -15.326 -10.782
  581   1HD2  ASN  79          1HD2      ASN  79  -8.231 -16.132 -12.483
  582   2HD2  ASN  79          2HD2      ASN  79  -7.288 -17.454 -11.989
  583    H    LYS  80           H        LYS  80  -9.673 -12.136 -11.727
  584    HA   LYS  80           HA       LYS  80  -8.371 -12.366 -14.315
  585   1HB   LYS  80          2HB       LYS  80  -9.959 -14.377 -14.192
  586   2HB   LYS  80          1HB       LYS  80 -11.276 -13.204 -14.227
  587   1HG   LYS  80          2HG       LYS  80  -9.333 -12.582 -16.280
  588   2HG   LYS  80          1HG       LYS  80  -9.881 -14.251 -16.442
  589   1HD   LYS  80          2HD       LYS  80 -12.206 -13.540 -16.473
  590   2HD   LYS  80          1HD       LYS  80 -11.736 -11.872 -16.150
  591   1HE   LYS  80          2HE       LYS  80 -11.355 -11.492 -18.336
  592   2HE   LYS  80          1HE       LYS  80 -10.292 -12.896 -18.442
  593   1HZ   LYS  80          1HZ       LYS  80 -11.988 -13.483 -19.846
  594   2HZ   LYS  80          2HZ       LYS  80 -13.187 -12.713 -18.921
  595   3HZ   LYS  80          3HZ       LYS  80 -12.523 -14.187 -18.399
  596    H    LEU  81           H        LEU  81  -8.253 -10.061 -13.529
  597    HA   LEU  81           HA       LEU  81 -10.748  -8.595 -14.288
  598   1HB   LEU  81          2HB       LEU  81 -10.167  -6.880 -12.629
  599   2HB   LEU  81          1HB       LEU  81 -10.323  -8.454 -11.847
  600    HG   LEU  81           HG       LEU  81  -7.613  -8.053 -12.801
  601   1HD1  LEU  81          1HD1      LEU  81  -7.801  -5.723 -12.496
  602   2HD1  LEU  81          2HD1      LEU  81  -7.163  -6.285 -10.950
  603   3HD1  LEU  81          3HD1      LEU  81  -8.878  -5.901 -11.111
  604   1HD2  LEU  81          1HD2      LEU  81  -8.097  -9.700 -11.131
  605   2HD2  LEU  81          2HD2      LEU  81  -8.949  -8.528 -10.127
  606   3HD2  LEU  81          3HD2      LEU  81  -7.198  -8.427 -10.306
  607    H    LEU  82           H        LEU  82 -10.269  -6.349 -15.093
  608    HA   LEU  82           HA       LEU  82  -7.857  -6.427 -16.818
  609   1HB   LEU  82          2HB       LEU  82 -10.384  -4.772 -16.823
  610   2HB   LEU  82          1HB       LEU  82  -9.002  -4.367 -17.842
  611    HG   LEU  82           HG       LEU  82  -9.102  -6.809 -18.648
  612   1HD1  LEU  82          1HD1      LEU  82 -11.659  -6.547 -17.083
  613   2HD1  LEU  82          2HD1      LEU  82 -10.522  -7.895 -17.132
  614   3HD1  LEU  82          3HD1      LEU  82 -11.595  -7.597 -18.499
  615   1HD2  LEU  82          1HD2      LEU  82 -10.517  -6.187 -20.422
  616   2HD2  LEU  82          2HD2      LEU  82  -9.985  -4.629 -19.792
  617   3HD2  LEU  82          3HD2      LEU  82 -11.579  -5.252 -19.370
  618    H    CYS  83           H        CYS  83  -6.122  -5.101 -16.449
  619    HA   CYS  83           HA       CYS  83  -6.490  -2.817 -14.566
  620   1HB   CYS  83          2HB       CYS  83  -5.508  -4.616 -13.262
  621   2HB   CYS  83          1HB       CYS  83  -4.279  -4.886 -14.499
  622    HG   CYS  83           HG       CYS  83  -3.235  -3.331 -12.663
  623    H    PHE  84           H        PHE  84  -6.104  -1.080 -15.885
  624    HA   PHE  84           HA       PHE  84  -3.904  -1.285 -17.877
  625   1HB   PHE  84          2HB       PHE  84  -4.849   1.014 -18.584
  626   2HB   PHE  84          1HB       PHE  84  -5.841  -0.405 -18.914
  627    HD1  PHE  84           HD1      PHE  84  -5.855   2.833 -17.535
  628    HD2  PHE  84           HD2      PHE  84  -7.459  -1.101 -16.905
  629    HE1  PHE  84           HE1      PHE  84  -7.702   3.802 -16.191
  630    HE2  PHE  84           HE2      PHE  84  -9.306  -0.132 -15.559
  631    HZ   PHE  84           HZ       PHE  84  -9.426   2.319 -15.204
  632    H    ASP  85           H        ASP  85  -2.485   0.734 -18.044
  633    HA   ASP  85           HA       ASP  85  -2.007   1.866 -15.315
  634   1HB   ASP  85          2HB       ASP  85   0.250   1.447 -17.247
  635   2HB   ASP  85          1HB       ASP  85   0.284   1.496 -15.484
  636    H    ALA  86           H        ALA  86  -1.112   4.019 -15.285
  637    HA   ALA  86           HA       ALA  86  -1.356   5.479 -17.883
  638   1HB   ALA  86          1HB       ALA  86  -3.235   5.766 -16.039
  639   2HB   ALA  86          2HB       ALA  86  -2.632   7.169 -16.922
  640   3HB   ALA  86          3HB       ALA  86  -2.041   6.828 -15.295
  641    H    THR  87           H        THR  87   0.245   7.020 -18.254
  642    HA   THR  87           HA       THR  87   2.284   7.343 -16.087
  643    HB   THR  87           HB       THR  87   3.600   7.738 -18.529
  644    HG1  THR  87           HG1      THR  87   3.086   5.617 -19.478
  645   1HG2  THR  87          1HG2      THR  87   4.790   5.685 -17.907
  646   2HG2  THR  87          2HG2      THR  87   3.492   5.255 -16.795
  647   3HG2  THR  87          3HG2      THR  87   4.491   6.674 -16.478
  648    H    MET  88           H        MET  88   3.516   9.397 -16.252
  649    HA   MET  88           HA       MET  88   2.451  11.497 -17.996
  650   1HB   MET  88          2HB       MET  88   0.923  11.205 -15.867
  651   2HB   MET  88          1HB       MET  88   2.235  12.059 -15.053
  652   1HG   MET  88          2HG       MET  88   2.068  13.885 -16.716
  653   2HG   MET  88          1HG       MET  88   0.733  13.039 -17.500
  654   1HE   MET  88          1HE       MET  88  -1.449  14.532 -17.138
  655   2HE   MET  88          2HE       MET  88   0.005  15.525 -17.192
  656   3HE   MET  88          3HE       MET  88  -1.239  15.862 -15.992
  657    H    GLN  89           H        GLN  89   4.257  12.590 -18.574
  658    HA   GLN  89           HA       GLN  89   6.716  12.398 -17.037
  659   1HB   GLN  89          2HB       GLN  89   5.849  13.763 -19.560
  660   2HB   GLN  89          1HB       GLN  89   7.329  14.316 -18.775
  661   1HG   GLN  89          2HG       GLN  89   7.681  12.496 -20.493
  662   2HG   GLN  89          1HG       GLN  89   8.300  12.112 -18.887
  663   1HE2  GLN  89          1HE2      GLN  89   5.065  11.871 -20.495
  664   2HE2  GLN  89          2HE2      GLN  89   4.779  10.274 -19.993
  665    H    SER  90           H        SER  90   7.377  13.759 -15.430
  666    HA   SER  90           HA       SER  90   6.633  16.563 -15.370
  667   1HB   SER  90          2HB       SER  90   5.058  16.605 -13.670
  668   2HB   SER  90          1HB       SER  90   4.610  15.100 -14.468
  669    HG   SER  90           HG       SER  90   4.834  14.789 -12.234
  670    H    ALA  91           H        ALA  91   7.707  17.686 -13.598
  671    HA   ALA  91           HA       ALA  91  10.285  16.638 -12.966
  672   1HB   ALA  91          1HB       ALA  91  10.333  18.921 -12.751
  673   2HB   ALA  91          2HB       ALA  91   9.967  18.542 -11.068
  674   3HB   ALA  91          3HB       ALA  91   8.670  19.003 -12.171
  675    H    LEU  92           H        LEU  92  10.995  16.542 -10.517
  676    HA   LEU  92           HA       LEU  92   9.225  14.539  -9.241
  677   1HB   LEU  92          2HB       LEU  92  11.691  14.113  -9.520
  678   2HB   LEU  92          1HB       LEU  92  11.995  15.442  -8.401
  679    HG   LEU  92           HG       LEU  92  10.169  14.011  -6.979
  680   1HD1  LEU  92          1HD1      LEU  92  10.656  11.645  -7.191
  681   2HD1  LEU  92          2HD1      LEU  92  11.884  11.965  -8.416
  682   3HD1  LEU  92          3HD1      LEU  92  10.181  12.252  -8.777
  683   1HD2  LEU  92          1HD2      LEU  92  12.091  14.604  -5.823
  684   2HD2  LEU  92          2HD2      LEU  92  13.161  14.040  -7.106
  685   3HD2  LEU  92          3HD2      LEU  92  12.386  12.878  -6.028
  686    H    ASP  93           H        ASP  93   7.606  15.667  -8.166
  687    HA   ASP  93           HA       ASP  93   8.503  17.353  -5.896
  688   1HB   ASP  93          2HB       ASP  93   6.729  18.239  -8.160
  689   2HB   ASP  93          1HB       ASP  93   6.505  18.919  -6.547
  690    H    ALA  94           H        ALA  94   7.227  17.038  -4.093
  691    HA   ALA  94           HA       ALA  94   5.339  14.858  -4.100
  692   1HB   ALA  94          1HB       ALA  94   5.117  15.253  -1.773
  693   2HB   ALA  94          2HB       ALA  94   5.527  16.961  -1.939
  694   3HB   ALA  94          3HB       ALA  94   6.776  15.730  -2.136
  695    H    LYS  95           H        LYS  95   5.003  18.393  -4.084
  696    HA   LYS  95           HA       LYS  95   2.177  18.485  -3.699
  697   1HB   LYS  95          2HB       LYS  95   3.941  20.375  -5.291
  698   2HB   LYS  95          1HB       LYS  95   2.311  20.731  -4.719
  699   1HG   LYS  95          2HG       LYS  95   3.927  19.758  -2.530
  700   2HG   LYS  95          1HG       LYS  95   4.732  21.118  -3.314
  701   1HD   LYS  95          2HD       LYS  95   2.531  22.367  -3.190
  702   2HD   LYS  95          1HD       LYS  95   1.928  21.058  -2.173
  703   1HE   LYS  95          2HE       LYS  95   2.927  23.101  -0.965
  704   2HE   LYS  95          1HE       LYS  95   3.504  21.514  -0.458
  705   1HZ   LYS  95          1HZ       LYS  95   5.311  23.114  -0.816
  706   2HZ   LYS  95          2HZ       LYS  95   4.860  23.252  -2.448
  707   3HZ   LYS  95          3HZ       LYS  95   5.431  21.770  -1.845
  708    H    LEU  96           H        LEU  96   4.117  18.407  -6.699
  709    HA   LEU  96           HA       LEU  96   1.875  18.392  -8.483
  710   1HB   LEU  96          2HB       LEU  96   4.311  18.822  -9.086
  711   2HB   LEU  96          1HB       LEU  96   4.554  17.077  -8.991
  712    HG   LEU  96           HG       LEU  96   2.214  17.865 -10.592
  713   1HD1  LEU  96          1HD1      LEU  96   3.704  19.723 -11.186
  714   2HD1  LEU  96          2HD1      LEU  96   3.589  18.589 -12.531
  715   3HD1  LEU  96          3HD1      LEU  96   5.018  18.590 -11.498
  716   1HD2  LEU  96          1HD2      LEU  96   3.283  16.210 -12.145
  717   2HD2  LEU  96          2HD2      LEU  96   3.035  15.571 -10.520
  718   3HD2  LEU  96          3HD2      LEU  96   4.642  16.095 -11.026
  719    H    ILE  97           H        ILE  97   4.004  15.650  -7.581
  720    HA   ILE  97           HA       ILE  97   2.522  13.568  -8.671
  721    HB   ILE  97           HB       ILE  97   4.017  13.676  -6.039
  722   1HG1  ILE  97          2HG1      ILE  97   4.846  12.218  -8.535
  723   2HG1  ILE  97          1HG1      ILE  97   5.097  13.961  -8.422
  724   1HG2  ILE  97          1HG2      ILE  97   4.040  11.142  -6.310
  725   2HG2  ILE  97          2HG2      ILE  97   2.758  11.345  -7.502
  726   3HG2  ILE  97          3HG2      ILE  97   2.493  11.838  -5.830
  727   1HD1  ILE  97          1HD1      ILE  97   6.802  12.010  -7.418
  728   2HD1  ILE  97          2HD1      ILE  97   5.920  12.560  -5.992
  729   3HD1  ILE  97          3HD1      ILE  97   6.816  13.717  -6.976
  730    H    ASP  98           H        ASP  98   1.948  15.238  -5.585
  731    HA   ASP  98           HA       ASP  98  -0.211  13.588  -4.701
  732   1HB   ASP  98          2HB       ASP  98   0.375  16.520  -4.192
  733   2HB   ASP  98          1HB       ASP  98  -0.857  15.594  -3.335
  734    H    GLU  99           H        GLU  99  -0.069  16.350  -6.897
  735    HA   GLU  99           HA       GLU  99  -2.909  16.754  -7.099
  736   1HB   GLU  99          2HB       GLU  99  -0.489  17.683  -8.485
  737   2HB   GLU  99          1HB       GLU  99  -1.896  17.545  -9.542
  738   1HG   GLU  99          2HG       GLU  99  -1.849  19.023  -6.893
  739   2HG   GLU  99          1HG       GLU  99  -1.760  19.786  -8.481
  740    H    GLN 100           H        GLN 100  -0.623  15.034  -9.263
  741    HA   GLN 100           HA       GLN 100  -2.469  14.044 -11.121
  742   1HB   GLN 100          2HB       GLN 100  -0.067  12.590  -9.967
  743   2HB   GLN 100          1HB       GLN 100  -0.891  12.166 -11.466
  744   1HG   GLN 100          2HG       GLN 100  -0.380  14.443 -12.350
  745   2HG   GLN 100          1HG       GLN 100   0.535  14.776 -10.879
  746   1HE2  GLN 100          1HE2      GLN 100   1.570  14.569 -13.693
  747   2HE2  GLN 100          2HE2      GLN 100   2.746  13.345 -13.654
  748    H    VAL 101           H        VAL 101  -1.743  12.859  -7.866
  749    HA   VAL 101           HA       VAL 101  -3.380  10.478  -8.101
  750    HB   VAL 101           HB       VAL 101  -2.481  11.969  -5.616
  751   1HG1  VAL 101          1HG1      VAL 101  -3.805   9.327  -6.127
  752   2HG1  VAL 101          2HG1      VAL 101  -4.105  10.494  -4.840
  753   3HG1  VAL 101          3HG1      VAL 101  -2.671   9.469  -4.784
  754   1HG2  VAL 101          1HG2      VAL 101  -0.514  10.700  -5.657
  755   2HG2  VAL 101          2HG2      VAL 101  -0.747  11.060  -7.368
  756   3HG2  VAL 101          3HG2      VAL 101  -1.207   9.481  -6.727
  757    H    GLU 102           H        GLU 102  -3.940  13.807  -7.076
  758    HA   GLU 102           HA       GLU 102  -6.537  13.341  -5.915
  759   1HB   GLU 102          2HB       GLU 102  -4.806  15.583  -6.392
  760   2HB   GLU 102          1HB       GLU 102  -6.419  15.978  -6.988
  761   1HG   GLU 102          2HG       GLU 102  -7.418  15.613  -4.877
  762   2HG   GLU 102          1HG       GLU 102  -6.021  14.719  -4.275
  763    H    LYS 103           H        LYS 103  -5.457  14.298  -9.171
  764    HA   LYS 103           HA       LYS 103  -8.138  14.584 -10.218
  765   1HB   LYS 103          2HB       LYS 103  -5.438  14.212 -11.535
  766   2HB   LYS 103          1HB       LYS 103  -6.929  14.399 -12.459
  767   1HG   LYS 103          2HG       LYS 103  -7.187  16.486 -10.754
  768   2HG   LYS 103          1HG       LYS 103  -5.428  16.404 -10.863
  769   1HD   LYS 103          2HD       LYS 103  -5.978  16.160 -13.468
  770   2HD   LYS 103          1HD       LYS 103  -7.431  17.037 -12.984
  771   1HE   LYS 103          2HE       LYS 103  -5.648  18.604 -13.653
  772   2HE   LYS 103          1HE       LYS 103  -6.029  18.782 -11.940
  773   1HZ   LYS 103          1HZ       LYS 103  -3.572  18.569 -12.731
  774   2HZ   LYS 103          2HZ       LYS 103  -3.920  16.906 -12.739
  775   3HZ   LYS 103          3HZ       LYS 103  -4.081  17.803 -11.305
  776    H    LEU 104           H        LEU 104  -5.705  11.969 -10.437
  777    HA   LEU 104           HA       LEU 104  -7.356  10.192 -11.957
  778   1HB   LEU 104          2HB       LEU 104  -5.028   9.714 -10.084
  779   2HB   LEU 104          1HB       LEU 104  -5.818   8.406 -10.966
  780    HG   LEU 104           HG       LEU 104  -4.551  10.861 -12.217
  781   1HD1  LEU 104          1HD1      LEU 104  -2.748   9.492 -12.839
  782   2HD1  LEU 104          2HD1      LEU 104  -3.659   8.006 -12.568
  783   3HD1  LEU 104          3HD1      LEU 104  -3.090   8.955 -11.194
  784   1HD2  LEU 104          1HD2      LEU 104  -6.267   8.646 -13.239
  785   2HD2  LEU 104          2HD2      LEU 104  -4.906   9.130 -14.249
  786   3HD2  LEU 104          3HD2      LEU 104  -6.134  10.313 -13.799
  787    H    VAL 105           H        VAL 105  -7.067  10.789  -8.486
  788    HA   VAL 105           HA       VAL 105  -8.659   8.513  -7.685
  789    HB   VAL 105           HB       VAL 105  -7.776  11.061  -6.348
  790   1HG1  VAL 105          1HG1      VAL 105  -8.898  10.040  -4.265
  791   2HG1  VAL 105          2HG1      VAL 105  -9.852   9.082  -5.398
  792   3HG1  VAL 105          3HG1      VAL 105  -9.954  10.843  -5.428
  793   1HG2  VAL 105          1HG2      VAL 105  -6.298   9.687  -5.249
  794   2HG2  VAL 105          2HG2      VAL 105  -6.546   8.675  -6.672
  795   3HG2  VAL 105          3HG2      VAL 105  -7.437   8.342  -5.187
  796    H    ASN 106           H        ASN 106  -9.460  12.010  -7.818
  797    HA   ASN 106           HA       ASN 106 -12.222  11.748  -7.308
  798   1HB   ASN 106          2HB       ASN 106 -10.844  13.749  -9.128
  799   2HB   ASN 106          1HB       ASN 106 -12.467  13.924  -8.456
  800   1HD2  ASN 106          1HD2      ASN 106 -12.125  15.659  -6.994
  801   2HD2  ASN 106          2HD2      ASN 106 -11.012  15.602  -5.714
  802    H    LEU 107           H        LEU 107 -10.472  11.582 -10.406
  803    HA   LEU 107           HA       LEU 107 -12.823  11.253 -12.029
  804   1HB   LEU 107          2HB       LEU 107 -10.803  11.888 -13.142
  805   2HB   LEU 107          1HB       LEU 107  -9.915  10.527 -12.453
  806    HG   LEU 107           HG       LEU 107 -12.323   9.776 -13.989
  807   1HD1  LEU 107          1HD1      LEU 107  -9.875  10.867 -15.411
  808   2HD1  LEU 107          2HD1      LEU 107 -11.431  11.694 -15.320
  809   3HD1  LEU 107          3HD1      LEU 107 -11.300  10.155 -16.171
  810   1HD2  LEU 107          1HD2      LEU 107 -10.282   8.403 -12.963
  811   2HD2  LEU 107          2HD2      LEU 107  -9.542   8.799 -14.514
  812   3HD2  LEU 107          3HD2      LEU 107 -11.055   7.894 -14.464
  813    H    ALA 108           H        ALA 108 -10.625   8.947 -10.451
  814    HA   ALA 108           HA       ALA 108 -11.715   6.567 -11.541
  815   1HB   ALA 108          1HB       ALA 108  -9.994   7.299  -9.303
  816   2HB   ALA 108          2HB       ALA 108  -9.957   5.854 -10.314
  817   3HB   ALA 108          3HB       ALA 108 -11.029   5.925  -8.915
  818    H    GLU 109           H        GLU 109 -12.510   8.134  -8.417
  819    HA   GLU 109           HA       GLU 109 -14.733   6.404  -7.861
  820   1HB   GLU 109          2HB       GLU 109 -13.975   9.161  -6.868
  821   2HB   GLU 109          1HB       GLU 109 -15.407   8.308  -6.290
  822   1HG   GLU 109          2HG       GLU 109 -12.653   7.058  -6.243
  823   2HG   GLU 109          1HG       GLU 109 -13.285   8.004  -4.894
  824    H    LYS 110           H        LYS 110 -14.361   9.158  -9.932
  825    HA   LYS 110           HA       LYS 110 -17.160   9.905 -10.023
  826   1HB   LYS 110          2HB       LYS 110 -15.192  11.365 -10.715
  827   2HB   LYS 110          1HB       LYS 110 -15.084  10.381 -12.175
  828   1HG   LYS 110          2HG       LYS 110 -16.892  11.374 -13.108
  829   2HG   LYS 110          1HG       LYS 110 -17.813  11.294 -11.605
  830   1HD   LYS 110          2HD       LYS 110 -16.581  13.249 -10.740
  831   2HD   LYS 110          1HD       LYS 110 -15.661  13.335 -12.242
  832   1HE   LYS 110          2HE       LYS 110 -17.635  14.912 -12.132
  833   2HE   LYS 110          1HE       LYS 110 -17.643  13.825 -13.520
  834   1HZ   LYS 110          1HZ       LYS 110 -19.174  13.507 -10.998
  835   2HZ   LYS 110          2HZ       LYS 110 -19.087  12.325 -12.214
  836   3HZ   LYS 110          3HZ       LYS 110 -19.804  13.830 -12.540
  837    H    PHE 111           H        PHE 111 -15.183   7.519 -11.656
  838    HA   PHE 111           HA       PHE 111 -17.391   6.949 -13.561
  839   1HB   PHE 111          2HB       PHE 111 -14.481   6.238 -13.425
  840   2HB   PHE 111          1HB       PHE 111 -15.572   5.193 -14.336
  841    HD1  PHE 111           HD1      PHE 111 -15.745   5.667 -16.603
  842    HD2  PHE 111           HD2      PHE 111 -15.063   8.887 -13.842
  843    HE1  PHE 111           HE1      PHE 111 -15.718   7.279 -18.489
  844    HE2  PHE 111           HE2      PHE 111 -15.037  10.498 -15.728
  845    HZ   PHE 111           HZ       PHE 111 -15.365   9.694 -18.051
  846    H    ASP 112           H        ASP 112 -15.145   4.702 -11.931
  847    HA   ASP 112           HA       ASP 112 -16.835   3.518 -10.069
  848   1HB   ASP 112          2HB       ASP 112 -17.711   2.990 -12.797
  849   2HB   ASP 112          1HB       ASP 112 -17.343   1.495 -11.936
  850    H    ILE 113           H        ILE 113 -14.012   3.856 -10.799
  851    HA   ILE 113           HA       ILE 113 -13.159   0.987 -10.773
  852    HB   ILE 113           HB       ILE 113 -11.085   1.670 -11.806
  853   1HG1  ILE 113          2HG1      ILE 113 -12.138   4.441 -11.236
  854   2HG1  ILE 113          1HG1      ILE 113 -10.588   3.743 -10.769
  855   1HG2  ILE 113          1HG2      ILE 113 -13.409   1.627 -13.115
  856   2HG2  ILE 113          2HG2      ILE 113 -11.912   2.093 -13.925
  857   3HG2  ILE 113          3HG2      ILE 113 -13.030   3.333 -13.354
  858   1HD1  ILE 113          1HD1      ILE 113  -9.900   5.005 -12.579
  859   2HD1  ILE 113          2HD1      ILE 113 -11.449   4.848 -13.409
  860   3HD1  ILE 113          3HD1      ILE 113 -10.308   3.502 -13.409
  861    H    ILE 114           H        ILE 114 -10.816   0.914  -9.684
  862    HA   ILE 114           HA       ILE 114 -10.952   2.553  -7.184
  863    HB   ILE 114           HB       ILE 114 -11.547   0.410  -6.433
  864   1HG1  ILE 114          2HG1      ILE 114  -9.633  -0.410  -5.193
  865   2HG1  ILE 114          1HG1      ILE 114  -8.515   0.332  -6.338
  866   1HG2  ILE 114          1HG2      ILE 114 -10.054  -0.411  -8.807
  867   2HG2  ILE 114          2HG2      ILE 114 -11.377  -1.231  -7.977
  868   3HG2  ILE 114          3HG2      ILE 114  -9.718  -1.445  -7.418
  869   1HD1  ILE 114          1HD1      ILE 114  -9.226   1.525  -4.027
  870   2HD1  ILE 114          2HD1      ILE 114 -10.509   2.139  -5.070
  871   3HD1  ILE 114          3HD1      ILE 114  -8.821   2.439  -5.480
  872    H    TYR 115           H        TYR 115  -9.260   3.956  -7.339
  873    HA   TYR 115           HA       TYR 115  -6.776   3.123  -8.705
  874   1HB   TYR 115          2HB       TYR 115  -7.190   5.317  -9.304
  875   2HB   TYR 115          1HB       TYR 115  -7.952   5.704  -7.763
  876    HD1  TYR 115           HD1      TYR 115  -6.641   6.390  -5.840
  877    HD2  TYR 115           HD2      TYR 115  -4.732   5.284  -9.525
  878    HE1  TYR 115           HE1      TYR 115  -4.506   7.352  -5.022
  879    HE2  TYR 115           HE2      TYR 115  -2.597   6.245  -8.707
  880    HH   TYR 115           HH       TYR 115  -1.610   7.415  -7.093
  881    H    ASP 116           H        ASP 116  -5.243   2.088  -7.523
  882    HA   ASP 116           HA       ASP 116  -4.458   3.142  -4.904
  883   1HB   ASP 116          2HB       ASP 116  -6.437   1.533  -4.531
  884   2HB   ASP 116          1HB       ASP 116  -5.326   0.251  -5.015
  885    H    GLY 117           H        GLY 117  -2.596   3.373  -6.500
  886   1HA   GLY 117          2HA       GLY 117  -0.517   1.577  -5.934
  887   2HA   GLY 117          1HA       GLY 117  -1.221   1.028  -7.455
  888    H    TRP 118           H        TRP 118   0.681   3.514  -5.927
  889    HA   TRP 118           HA       TRP 118   1.143   4.707  -8.630
  890   1HB   TRP 118          2HB       TRP 118   0.934   6.834  -7.818
  891   2HB   TRP 118          1HB       TRP 118  -0.043   6.047  -6.582
  892    HD1  TRP 118           HD1      TRP 118   1.122   5.568  -4.210
  893    HE1  TRP 118           HE1      TRP 118   3.114   6.712  -3.039
  894    HE3  TRP 118           HE3      TRP 118   3.200   8.003  -8.187
  895    HZ2  TRP 118           HZ2      TRP 118   5.301   8.437  -3.704
  896    HZ3  TRP 118           HZ3      TRP 118   5.233   9.388  -7.892
  897    HH2  TRP 118           HH2      TRP 118   6.286   9.608  -5.659
  898    H    GLY 119           H        GLY 119   3.271   4.788  -9.253
  899   1HA   GLY 119          2HA       GLY 119   5.382   4.542  -7.182
  900   2HA   GLY 119          1HA       GLY 119   5.328   3.312  -8.445
  901    H    THR 120           H        THR 120   7.519   5.131  -8.038
  902    HA   THR 120           HA       THR 120   7.378   6.628 -10.622
  903    HB   THR 120           HB       THR 120   7.305   8.293  -8.876
  904    HG1  THR 120           HG1      THR 120   9.910   8.672  -9.142
  905   1HG2  THR 120          1HG2      THR 120   9.841   7.611  -7.580
  906   2HG2  THR 120          2HG2      THR 120   8.600   6.379  -7.353
  907   3HG2  THR 120          3HG2      THR 120   8.292   8.044  -6.858
  908    H    TYR 121           H        TYR 121   8.975   6.037 -12.013
  909    HA   TYR 121           HA       TYR 121  10.873   3.995 -11.350
  910   1HB   TYR 121          2HB       TYR 121  10.112   5.528 -13.693
  911   2HB   TYR 121          1HB       TYR 121  11.866   5.376 -13.595
  912    HD1  TYR 121           HD1      TYR 121   8.865   3.768 -14.595
  913    HD2  TYR 121           HD2      TYR 121  12.773   2.975 -12.998
  914    HE1  TYR 121           HE1      TYR 121   8.708   1.418 -15.375
  915    HE2  TYR 121           HE2      TYR 121  12.616   0.627 -13.777
  916    HH   TYR 121           HH       TYR 121  10.316  -0.426 -15.986
  917    H    TYR 122           H        TYR 122  13.313   4.361 -11.667
  918    HA   TYR 122           HA       TYR 122  14.151   7.011 -10.578
  919   1HB   TYR 122          2HB       TYR 122  14.275   5.713  -8.627
  920   2HB   TYR 122          1HB       TYR 122  14.755   4.263  -9.508
  921    HD1  TYR 122           HD1      TYR 122  16.826   3.707  -8.482
  922    HD2  TYR 122           HD2      TYR 122  16.128   7.706  -9.887
  923    HE1  TYR 122           HE1      TYR 122  19.213   4.258  -8.099
  924    HE2  TYR 122           HE2      TYR 122  18.515   8.257  -9.503
  925    HH   TYR 122           HH       TYR 122  20.879   5.981  -9.069
  926    H    GLU 123           H        GLU 123  15.009   7.630 -12.601
  927    HA   GLU 123           HA       GLU 123  16.746   5.881 -14.135
  928   1HB   GLU 123          2HB       GLU 123  16.796   8.868 -14.417
  929   2HB   GLU 123          1HB       GLU 123  16.879   7.628 -15.671
  930   1HG   GLU 123          2HG       GLU 123  14.493   7.028 -15.128
  931   2HG   GLU 123          1HG       GLU 123  14.441   8.429 -14.058
  932    H    GLY 124           H        GLY 124  18.994   5.819 -14.146
  933   1HA   GLY 124          2HA       GLY 124  21.138   6.997 -13.628
  934   2HA   GLY 124          1HA       GLY 124  20.372   7.563 -12.143
  935    H    LEU 125           H        LEU 125  21.007   4.444 -13.796
  936    HA   LEU 125           HA       LEU 125  21.323   3.181 -11.128
  937   1HB   LEU 125          2HB       LEU 125  21.117   2.058 -13.933
  938   2HB   LEU 125          1HB       LEU 125  21.483   1.061 -12.525
  939    HG   LEU 125           HG       LEU 125  19.284   2.585 -11.726
  940   1HD1  LEU 125          1HD1      LEU 125  18.773   3.315 -13.954
  941   2HD1  LEU 125          2HD1      LEU 125  17.642   2.013 -13.585
  942   3HD1  LEU 125          3HD1      LEU 125  19.042   1.702 -14.612
  943   1HD2  LEU 125          1HD2      LEU 125  18.089   0.408 -11.884
  944   2HD2  LEU 125          2HD2      LEU 125  19.696   0.227 -11.179
  945   3HD2  LEU 125          3HD2      LEU 125  19.413  -0.229 -12.860
  946    H    GLU 126           H        GLU 126  23.309   2.590 -10.350
  947    HA   GLU 126           HA       GLU 126  25.677   3.426 -11.875
  948   1HB   GLU 126          2HB       GLU 126  25.104   2.576  -9.072
  949   2HB   GLU 126          1HB       GLU 126  26.745   2.335  -9.675
  950   1HG   GLU 126          2HG       GLU 126  25.357   4.974 -10.081
  951   2HG   GLU 126          1HG       GLU 126  26.150   4.614  -8.546
  952    H    HIS 127           H        HIS 127  26.024   0.639  -9.855
  953    HA   HIS 127           HA       HIS 127  26.219  -1.105 -12.273
  954   1HB   HIS 127          2HB       HIS 127  28.169  -1.323  -9.983
  955   2HB   HIS 127          1HB       HIS 127  28.327  -1.940 -11.628
  956    HD2  HIS 127           HD2      HIS 127  28.871   1.413  -9.666
  957    HE1  HIS 127           HE1      HIS 127  30.086   2.034 -13.663
  958    HE2  HIS 127           HE2      HIS 127  30.037   3.043 -11.337
  959    H    HIS 128           H        HIS 128  25.847  -3.365 -11.835
  960    HA   HIS 128           HA       HIS 128  24.438  -3.835  -9.239
  961   1HB   HIS 128          2HB       HIS 128  23.181  -3.984 -11.525
  962   2HB   HIS 128          1HB       HIS 128  24.033  -5.519 -11.704
  963    HD2  HIS 128           HD2      HIS 128  23.228  -7.553  -9.860
  964    HE1  HIS 128           HE1      HIS 128  19.998  -5.376  -8.225
  965    HE2  HIS 128           HE2      HIS 128  21.115  -7.652  -8.332
  966    H    HIS 129           H        HIS 129  24.646  -6.745 -10.707
  967    HA   HIS 129           HA       HIS 129  26.469  -7.883  -8.887
  968   1HB   HIS 129          2HB       HIS 129  26.723  -9.680 -10.761
  969   2HB   HIS 129          1HB       HIS 129  25.131  -9.432 -10.047
  970    HD2  HIS 129           HD2      HIS 129  24.246 -10.352 -12.749
  971    HE1  HIS 129           HE1      HIS 129  24.948  -6.560 -14.469
  972    HE2  HIS 129           HE2      HIS 129  23.827  -8.810 -14.810
  973    H    HIS 130           H        HIS 130  28.477  -9.212 -10.185
  974    HA   HIS 130           HA       HIS 130  30.708  -8.889 -10.847
  975   1HB   HIS 130          2HB       HIS 130  29.483  -8.494 -13.015
  976   2HB   HIS 130          1HB       HIS 130  29.500  -6.770 -12.647
  977    HD2  HIS 130           HD2      HIS 130  32.784  -8.475 -11.595
  978    HE1  HIS 130           HE1      HIS 130  33.508  -6.721 -15.369
  979    HE2  HIS 130           HE2      HIS 130  34.592  -7.827 -13.360
  980    H    HIS 131           H        HIS 131  31.975  -7.961  -9.300
  981    HA   HIS 131           HA       HIS 131  33.074  -6.284  -8.081
  982   1HB   HIS 131          2HB       HIS 131  32.766  -5.255 -10.629
  983   2HB   HIS 131          1HB       HIS 131  32.024  -4.014  -9.621
  984    HD2  HIS 131           HD2      HIS 131  35.452  -6.059  -9.306
  985    HE1  HIS 131           HE1      HIS 131  36.111  -2.026  -8.240
  986    HE2  HIS 131           HE2      HIS 131  37.206  -4.297  -8.517
  987    H    HIS 132           HN       HIS 132  31.894  -6.344  -6.164
  988    HA   HIS 132           HA       HIS 132  29.449  -4.630  -6.041
  989   1HB   HIS 132          2HB       HIS 132  28.706  -5.963  -4.203
  990   2HB   HIS 132          1HB       HIS 132  29.307  -7.106  -5.406
  991    HD2  HIS 132           HD2      HIS 132  32.532  -6.944  -4.686
  992    HE1  HIS 132           HE1      HIS 132  31.330  -7.974  -0.771
  993    HE2  HIS 132           HE2      HIS 132  33.297  -7.864  -2.368
  Start of MODEL    2
    1   1H    MET   1          1H        MET   1 -23.318 -10.835  11.412
    2   2H    MET   1          2H        MET   1 -22.828  -9.707  12.585
    3   3H    MET   1          3H        MET   1 -21.712 -10.287  11.443
    4    HA   MET   1           HA       MET   1 -24.086  -9.028  10.346
    5   1HB   MET   1          2HB       MET   1 -22.848  -6.765  10.702
    6   2HB   MET   1          1HB       MET   1 -23.809  -7.409  12.034
    7   1HG   MET   1          2HG       MET   1 -21.782  -8.391  13.033
    8   2HG   MET   1          1HG       MET   1 -20.815  -7.762  11.699
    9   1HE   MET   1          1HE       MET   1 -23.155  -6.872  14.708
   10   2HE   MET   1          2HE       MET   1 -22.034  -5.768  15.501
   11   3HE   MET   1          3HE       MET   1 -21.520  -7.409  15.118
   12    H    SER   2           H        SER   2 -23.641  -9.091   8.200
   13    HA   SER   2           HA       SER   2 -20.767  -9.061   7.370
   14   1HB   SER   2          2HB       SER   2 -23.105 -10.143   5.779
   15   2HB   SER   2          1HB       SER   2 -21.390 -10.367   5.449
   16    HG   SER   2           HG       SER   2 -22.972 -11.434   7.534
   17    H    HIS   3           H        HIS   3 -23.262  -7.011   7.647
   18    HA   HIS   3           HA       HIS   3 -22.552  -5.583   5.116
   19   1HB   HIS   3          2HB       HIS   3 -24.939  -6.532   5.283
   20   2HB   HIS   3          1HB       HIS   3 -25.210  -5.309   6.525
   21    HD2  HIS   3           HD2      HIS   3 -26.497  -5.202   3.316
   22    HE1  HIS   3           HE1      HIS   3 -24.129  -1.711   3.143
   23    HE2  HIS   3           HE2      HIS   3 -26.038  -2.971   2.047
   24    H    GLN   4           H        GLN   4 -20.859  -4.582   6.514
   25    HA   GLN   4           HA       GLN   4 -21.693  -2.920   8.757
   26   1HB   GLN   4          2HB       GLN   4 -19.276  -1.960   8.304
   27   2HB   GLN   4          1HB       GLN   4 -19.470  -3.578   8.979
   28   1HG   GLN   4          2HG       GLN   4 -19.562  -3.514   6.041
   29   2HG   GLN   4          1HG       GLN   4 -18.019  -2.983   6.712
   30   1HE2  GLN   4          1HE2      GLN   4 -17.661  -4.572   8.929
   31   2HE2  GLN   4          2HE2      GLN   4 -17.654  -6.214   8.503
   32    H    ASP   5           H        ASP   5 -20.232  -0.549   8.220
   33    HA   ASP   5           HA       ASP   5 -21.486   0.592   5.784
   34   1HB   ASP   5          2HB       ASP   5 -21.850   1.751   8.566
   35   2HB   ASP   5          1HB       ASP   5 -22.406   2.490   7.063
   36    H    ASP   6           H        ASP   6 -19.324   0.812   4.988
   37    HA   ASP   6           HA       ASP   6 -17.610   2.728   6.515
   38   1HB   ASP   6          2HB       ASP   6 -16.799   0.828   4.291
   39   2HB   ASP   6          1HB       ASP   6 -15.718   1.814   5.277
   40    H    TYR   7           H        TYR   7 -19.117   4.411   5.551
   41    HA   TYR   7           HA       TYR   7 -19.483   4.962   2.851
   42   1HB   TYR   7          2HB       TYR   7 -18.942   7.473   3.835
   43   2HB   TYR   7          1HB       TYR   7 -20.495   6.649   3.987
   44    HD1  TYR   7           HD1      TYR   7 -21.310   5.941   6.098
   45    HD2  TYR   7           HD2      TYR   7 -17.224   7.202   5.690
   46    HE1  TYR   7           HE1      TYR   7 -21.050   5.897   8.563
   47    HE2  TYR   7           HE2      TYR   7 -16.964   7.159   8.157
   48    HH   TYR   7           HH       TYR   7 -18.978   7.395  10.218
   49    H    LEU   8           H        LEU   8 -18.204   5.736   1.186
   50    HA   LEU   8           HA       LEU   8 -15.385   5.362   1.297
   51   1HB   LEU   8          2HB       LEU   8 -15.618   7.024  -0.814
   52   2HB   LEU   8          1HB       LEU   8 -16.078   5.323  -0.892
   53    HG   LEU   8           HG       LEU   8 -18.072   7.376   0.029
   54   1HD1  LEU   8          1HD1      LEU   8 -17.437   8.336  -2.044
   55   2HD1  LEU   8          2HD1      LEU   8 -18.838   7.339  -2.436
   56   3HD1  LEU   8          3HD1      LEU   8 -17.214   6.757  -2.800
   57   1HD2  LEU   8          1HD2      LEU   8 -18.926   5.180  -1.700
   58   2HD2  LEU   8          2HD2      LEU   8 -19.498   5.622  -0.091
   59   3HD2  LEU   8          3HD2      LEU   8 -18.071   4.600  -0.269
   60    H    SER   9           H        SER   9 -13.676   6.866   1.473
   61    HA   SER   9           HA       SER   9 -14.355   9.684   2.085
   62   1HB   SER   9          2HB       SER   9 -13.093   7.735   4.002
   63   2HB   SER   9          1HB       SER   9 -12.694   9.448   4.090
   64    HG   SER   9           HG       SER   9 -14.505   8.824   5.403
   65    H    VAL  10           H        VAL  10 -13.257   9.584  -0.136
   66    HA   VAL  10           HA       VAL  10 -10.631   8.829  -0.642
   67    HB   VAL  10           HB       VAL  10 -10.550  10.841  -2.196
   68   1HG1  VAL  10          1HG1      VAL  10 -12.789   8.831  -2.147
   69   2HG1  VAL  10          2HG1      VAL  10 -11.374   8.889  -3.199
   70   3HG1  VAL  10          3HG1      VAL  10 -12.701  10.024  -3.442
   71   1HG2  VAL  10          1HG2      VAL  10 -13.403  11.382  -1.816
   72   2HG2  VAL  10          2HG2      VAL  10 -12.064  12.515  -1.998
   73   3HG2  VAL  10          3HG2      VAL  10 -12.438  11.838  -0.413
   74    H    GLU  11           H        GLU  11 -11.713  11.288   1.538
   75    HA   GLU  11           HA       GLU  11  -9.404  12.961   1.587
   76   1HB   GLU  11          2HB       GLU  11 -11.584  13.450   2.743
   77   2HB   GLU  11          1HB       GLU  11 -11.159  12.235   3.950
   78   1HG   GLU  11          2HG       GLU  11  -9.336  13.492   4.753
   79   2HG   GLU  11          1HG       GLU  11  -9.260  14.481   3.296
   80    H    GLU  12           H        GLU  12 -10.145   9.930   3.286
   81    HA   GLU  12           HA       GLU  12  -7.736   9.942   4.881
   82   1HB   GLU  12          2HB       GLU  12  -9.339   7.524   4.008
   83   2HB   GLU  12          1HB       GLU  12  -8.303   7.662   5.428
   84   1HG   GLU  12          2HG       GLU  12 -10.497   9.661   5.169
   85   2HG   GLU  12          1HG       GLU  12 -10.968   8.006   5.556
   86    H    LEU  13           H        LEU  13  -8.602   8.517   1.743
   87    HA   LEU  13           HA       LEU  13  -6.126   7.103   1.374
   88   1HB   LEU  13          2HB       LEU  13  -7.827   8.214  -0.861
   89   2HB   LEU  13          1HB       LEU  13  -6.848   6.747  -0.861
   90    HG   LEU  13           HG       LEU  13  -9.217   7.135   0.981
   91   1HD1  LEU  13          1HD1      LEU  13  -9.544   7.093  -1.676
   92   2HD1  LEU  13          2HD1      LEU  13 -10.646   6.241  -0.594
   93   3HD1  LEU  13          3HD1      LEU  13  -9.359   5.359  -1.414
   94   1HD2  LEU  13          1HD2      LEU  13  -9.055   4.602   0.991
   95   2HD2  LEU  13          2HD2      LEU  13  -7.694   5.432   1.747
   96   3HD2  LEU  13          3HD2      LEU  13  -7.530   4.769   0.120
   97    H    ILE  14           H        ILE  14  -7.229  10.335   0.352
   98    HA   ILE  14           HA       ILE  14  -4.885  11.019  -1.127
   99    HB   ILE  14           HB       ILE  14  -7.020  12.627   0.263
  100   1HG1  ILE  14          2HG1      ILE  14  -6.267  12.841  -2.624
  101   2HG1  ILE  14          1HG1      ILE  14  -7.071  11.363  -2.094
  102   1HG2  ILE  14          1HG2      ILE  14  -5.392  14.227   0.516
  103   2HG2  ILE  14          2HG2      ILE  14  -5.753  14.513  -1.186
  104   3HG2  ILE  14          3HG2      ILE  14  -4.363  13.527  -0.733
  105   1HD1  ILE  14          1HD1      ILE  14  -8.089  14.204  -1.856
  106   2HD1  ILE  14          2HD1      ILE  14  -8.824  12.848  -1.001
  107   3HD1  ILE  14          3HD1      ILE  14  -8.809  12.874  -2.764
  108    H    GLU  15           H        GLU  15  -5.778  12.041   2.196
  109    HA   GLU  15           HA       GLU  15  -3.452  13.313   2.961
  110   1HB   GLU  15          2HB       GLU  15  -5.653  12.306   4.302
  111   2HB   GLU  15          1HB       GLU  15  -4.317  11.391   5.003
  112   1HG   GLU  15          2HG       GLU  15  -3.131  13.450   5.544
  113   2HG   GLU  15          1HG       GLU  15  -4.372  14.410   4.738
  114    H    ILE  16           H        ILE  16  -3.973   9.786   3.388
  115    HA   ILE  16           HA       ILE  16  -1.410   9.080   4.233
  116    HB   ILE  16           HB       ILE  16  -3.167   7.545   2.290
  117   1HG1  ILE  16          2HG1      ILE  16  -2.953   7.170   5.281
  118   2HG1  ILE  16          1HG1      ILE  16  -4.112   8.299   4.578
  119   1HG2  ILE  16          1HG2      ILE  16  -1.344   6.192   2.218
  120   2HG2  ILE  16          2HG2      ILE  16  -1.815   5.728   3.852
  121   3HG2  ILE  16          3HG2      ILE  16  -0.595   6.977   3.608
  122   1HD1  ILE  16          1HD1      ILE  16  -5.355   6.615   3.572
  123   2HD1  ILE  16          2HD1      ILE  16  -4.804   5.785   5.028
  124   3HD1  ILE  16          3HD1      ILE  16  -3.982   5.509   3.492
  125    H    GLN  17           H        GLN  17  -2.527   9.433   0.856
  126    HA   GLN  17           HA       GLN  17  -0.134   8.728  -0.451
  127   1HB   GLN  17          2HB       GLN  17  -2.517  10.344  -1.097
  128   2HB   GLN  17          1HB       GLN  17  -1.071  10.789  -2.005
  129   1HG   GLN  17          2HG       GLN  17  -2.131   7.959  -1.754
  130   2HG   GLN  17          1HG       GLN  17  -2.423   9.014  -3.136
  131   1HE2  GLN  17          1HE2      GLN  17  -0.565   9.569  -4.512
  132   2HE2  GLN  17          2HE2      GLN  17   0.865   8.658  -4.452
  133    H    LYS  18           H        LYS  18  -1.162  12.109   0.143
  134    HA   LYS  18           HA       LYS  18   1.082  13.517  -0.452
  135   1HB   LYS  18          2HB       LYS  18  -0.462  13.817   2.143
  136   2HB   LYS  18          1HB       LYS  18   0.584  15.045   1.429
  137   1HG   LYS  18          2HG       LYS  18  -0.849  15.003  -0.623
  138   2HG   LYS  18          1HG       LYS  18  -1.940  13.892   0.208
  139   1HD   LYS  18          2HD       LYS  18  -2.378  15.549   1.941
  140   2HD   LYS  18          1HD       LYS  18  -1.202  16.652   1.224
  141   1HE   LYS  18          2HE       LYS  18  -2.895  16.000  -0.896
  142   2HE   LYS  18          1HE       LYS  18  -3.983  16.183   0.481
  143   1HZ   LYS  18          1HZ       LYS  18  -2.934  18.208  -0.998
  144   2HZ   LYS  18          2HZ       LYS  18  -1.953  18.202   0.389
  145   3HZ   LYS  18          3HZ       LYS  18  -3.638  18.366   0.536
  146    H    GLU  19           H        GLU  19   0.693  11.582   2.515
  147    HA   GLU  19           HA       GLU  19   3.333  12.224   3.521
  148   1HB   GLU  19          2HB       GLU  19   1.047  10.897   4.488
  149   2HB   GLU  19          1HB       GLU  19   2.321   9.677   4.468
  150   1HG   GLU  19          2HG       GLU  19   3.809  11.408   5.616
  151   2HG   GLU  19          1HG       GLU  19   2.344  12.357   5.869
  152    H    GLU  20           H        GLU  20   2.080   9.050   2.421
  153    HA   GLU  20           HA       GLU  20   4.360   7.594   2.162
  154   1HB   GLU  20          2HB       GLU  20   1.867   7.727   0.621
  155   2HB   GLU  20          1HB       GLU  20   3.223   7.086  -0.307
  156   1HG   GLU  20          2HG       GLU  20   2.733   6.099   2.489
  157   2HG   GLU  20          1HG       GLU  20   1.785   5.447   1.151
  158    H    THR  21           H        THR  21   3.336  10.052  -0.221
  159    HA   THR  21           HA       THR  21   5.574   9.760  -1.961
  160    HB   THR  21           HB       THR  21   4.038  12.306  -1.360
  161    HG1  THR  21           HG1      THR  21   3.553  10.303  -3.305
  162   1HG2  THR  21          1HG2      THR  21   5.846  12.945  -2.691
  163   2HG2  THR  21          2HG2      THR  21   4.621  12.570  -3.902
  164   3HG2  THR  21          3HG2      THR  21   5.891  11.402  -3.543
  165    H    ARG  22           H        ARG  22   5.052  12.263   0.554
  166    HA   ARG  22           HA       ARG  22   7.471  13.554   0.558
  167   1HB   ARG  22          2HB       ARG  22   5.514  12.851   2.638
  168   2HB   ARG  22          1HB       ARG  22   7.138  13.130   3.266
  169   1HG   ARG  22          2HG       ARG  22   7.232  15.314   2.233
  170   2HG   ARG  22          1HG       ARG  22   5.706  15.030   1.392
  171   1HD   ARG  22          2HD       ARG  22   5.106  14.540   4.071
  172   2HD   ARG  22          1HD       ARG  22   6.169  15.944   4.126
  173    HE   ARG  22           HE       ARG  22   3.477  16.112   3.464
  174   1HH1  ARG  22          1HH2      ARG  22   6.471  16.734   1.855
  175   2HH1  ARG  22          2HH2      ARG  22   5.795  17.914   0.784
  176   1HH2  ARG  22          2HH1      ARG  22   2.593  17.650   2.080
  177   2HH2  ARG  22          1HH1      ARG  22   3.605  18.433   0.913
  178    H    ASP  23           H        ASP  23   6.873  10.477   2.289
  179    HA   ASP  23           HA       ASP  23   9.526  10.065   3.182
  180   1HB   ASP  23          2HB       ASP  23   7.309   8.727   3.644
  181   2HB   ASP  23          1HB       ASP  23   7.840   7.752   2.274
  182    H    ILE  24           H        ILE  24   7.989   9.182   0.095
  183    HA   ILE  24           HA       ILE  24  10.301   7.784  -0.925
  184    HB   ILE  24           HB       ILE  24   7.885   9.014  -2.269
  185   1HG1  ILE  24          2HG1      ILE  24   8.734   6.125  -1.906
  186   2HG1  ILE  24          1HG1      ILE  24   7.629   6.964  -0.818
  187   1HG2  ILE  24          1HG2      ILE  24   9.314   9.061  -4.078
  188   2HG2  ILE  24          2HG2      ILE  24   8.842   7.363  -4.152
  189   3HG2  ILE  24          3HG2      ILE  24  10.373   7.822  -3.405
  190   1HD1  ILE  24          1HD1      ILE  24   5.926   6.506  -2.213
  191   2HD1  ILE  24          2HD1      ILE  24   7.037   5.707  -3.325
  192   3HD1  ILE  24          3HD1      ILE  24   6.725   7.435  -3.480
  193    H    ILE  25           H        ILE  25   8.943  10.904  -2.074
  194    HA   ILE  25           HA       ILE  25  11.115  11.776  -3.563
  195    HB   ILE  25           HB       ILE  25   9.041  13.195  -1.943
  196   1HG1  ILE  25          2HG1      ILE  25   8.380  14.028  -4.084
  197   2HG1  ILE  25          1HG1      ILE  25   9.931  13.600  -4.807
  198   1HG2  ILE  25          1HG2      ILE  25  10.935  14.581  -1.426
  199   2HG2  ILE  25          2HG2      ILE  25  10.062  15.386  -2.731
  200   3HG2  ILE  25          3HG2      ILE  25  11.535  14.481  -3.082
  201   1HD1  ILE  25          1HD1      ILE  25   7.826  12.042  -5.160
  202   2HD1  ILE  25          2HD1      ILE  25   8.270  11.436  -3.564
  203   3HD1  ILE  25          3HD1      ILE  25   9.421  11.336  -4.898
  204    H    GLN  26           H        GLN  26  10.924  11.412  -0.117
  205    HA   GLN  26           HA       GLN  26  13.142  13.152   0.544
  206   1HB   GLN  26          2HB       GLN  26  11.592  11.013   1.956
  207   2HB   GLN  26          1HB       GLN  26  13.145  11.511   2.629
  208   1HG   GLN  26          2HG       GLN  26  11.336  13.709   1.792
  209   2HG   GLN  26          1HG       GLN  26  10.815  12.775   3.196
  210   1HE2  GLN  26          1HE2      GLN  26  11.483  13.863   5.050
  211   2HE2  GLN  26          2HE2      GLN  26  13.005  14.584   5.263
  212    H    ALA  27           H        ALA  27  12.898   9.576   0.385
  213    HA   ALA  27           HA       ALA  27  15.663   9.054   0.692
  214   1HB   ALA  27          1HB       ALA  27  13.355   7.542   0.188
  215   2HB   ALA  27          2HB       ALA  27  14.981   6.917   0.469
  216   3HB   ALA  27          3HB       ALA  27  14.421   7.208  -1.177
  217    H    LEU  28           H        LEU  28  13.773   9.718  -2.253
  218    HA   LEU  28           HA       LEU  28  15.860   9.255  -4.133
  219   1HB   LEU  28          2HB       LEU  28  13.681  11.350  -4.356
  220   2HB   LEU  28          1HB       LEU  28  14.540  10.563  -5.681
  221    HG   LEU  28           HG       LEU  28  12.678   9.223  -3.698
  222   1HD1  LEU  28          1HD1      LEU  28  12.482   9.710  -6.687
  223   2HD1  LEU  28          2HD1      LEU  28  11.523  10.512  -5.443
  224   3HD1  LEU  28          3HD1      LEU  28  11.326   8.783  -5.731
  225   1HD2  LEU  28          1HD2      LEU  28  14.568   8.165  -5.790
  226   2HD2  LEU  28          2HD2      LEU  28  13.084   7.286  -5.417
  227   3HD2  LEU  28          3HD2      LEU  28  14.282   7.572  -4.154
  228    H    LEU  29           H        LEU  29  14.858  12.290  -2.525
  229    HA   LEU  29           HA       LEU  29  16.876  13.936  -3.680
  230   1HB   LEU  29          2HB       LEU  29  15.007  14.098  -1.409
  231   2HB   LEU  29          1HB       LEU  29  16.490  15.027  -1.186
  232    HG   LEU  29           HG       LEU  29  14.739  16.382  -2.289
  233   1HD1  LEU  29          1HD1      LEU  29  17.400  16.062  -3.075
  234   2HD1  LEU  29          2HD1      LEU  29  16.354  17.426  -3.466
  235   3HD1  LEU  29          3HD1      LEU  29  16.500  16.077  -4.591
  236   1HD2  LEU  29          1HD2      LEU  29  13.724  14.316  -3.433
  237   2HD2  LEU  29          2HD2      LEU  29  14.994  14.495  -4.643
  238   3HD2  LEU  29          3HD2      LEU  29  13.815  15.785  -4.404
  239    H    GLU  30           H        GLU  30  16.898  11.869  -0.796
  240    HA   GLU  30           HA       GLU  30  19.414  12.709   0.247
  241   1HB   GLU  30          2HB       GLU  30  17.964  11.294   1.578
  242   2HB   GLU  30          1HB       GLU  30  18.027  10.014   0.365
  243   1HG   GLU  30          2HG       GLU  30  19.558   9.592   2.296
  244   2HG   GLU  30          1HG       GLU  30  20.412   9.701   0.756
  245    H    ASP  31           H        ASP  31  18.572  10.507  -2.371
  246    HA   ASP  31           HA       ASP  31  21.274   9.453  -2.651
  247   1HB   ASP  31          2HB       ASP  31  19.088   8.337  -3.428
  248   2HB   ASP  31          1HB       ASP  31  19.145   9.451  -4.794
  249    H    GLY  32           H        GLY  32  19.373  12.033  -4.170
  250   1HA   GLY  32          2HA       GLY  32  20.854  14.026  -4.784
  251   2HA   GLY  32          1HA       GLY  32  21.844  12.849  -5.648
  252    H    SER  33           H        SER  33  18.462  12.256  -5.711
  253    HA   SER  33           HA       SER  33  18.042  12.029  -8.382
  254   1HB   SER  33          2HB       SER  33  16.360  12.298  -6.236
  255   2HB   SER  33          1HB       SER  33  15.970  13.743  -7.165
  256    HG   SER  33           HG       SER  33  15.618  11.051  -7.774
  257    H    ASP  34           H        ASP  34  17.337  13.487 -10.109
  258    HA   ASP  34           HA       ASP  34  18.258  16.306  -9.705
  259   1HB   ASP  34          2HB       ASP  34  19.051  14.290 -11.709
  260   2HB   ASP  34          1HB       ASP  34  18.640  15.868 -12.383
  261    HA   PRO  35           HA       PRO  35  13.771  16.365 -10.834
  262   1HB   PRO  35          2HB       PRO  35  14.235  19.143  -9.858
  263   2HB   PRO  35          1HB       PRO  35  12.935  18.005  -9.453
  264   1HG   PRO  35          2HG       PRO  35  14.930  18.537  -7.755
  265   2HG   PRO  35          1HG       PRO  35  14.182  16.935  -7.861
  266   1HD   PRO  35          2HD       PRO  35  16.851  17.834  -8.844
  267   2HD   PRO  35          1HD       PRO  35  16.333  16.228  -8.286
  268    H    ASP  36           H        ASP  36  16.444  18.490 -11.687
  269    HA   ASP  36           HA       ASP  36  15.074  20.048 -13.671
  270   1HB   ASP  36          2HB       ASP  36  17.388  20.480 -12.638
  271   2HB   ASP  36          1HB       ASP  36  17.998  19.291 -13.788
  272    H    ALA  37           H        ALA  37  16.276  16.792 -13.655
  273    HA   ALA  37           HA       ALA  37  16.262  16.595 -16.598
  274   1HB   ALA  37          1HB       ALA  37  16.618  14.075 -15.933
  275   2HB   ALA  37          2HB       ALA  37  16.945  14.742 -14.333
  276   3HB   ALA  37          3HB       ALA  37  17.935  15.226 -15.710
  277    H    LEU  38           H        LEU  38  13.798  17.078 -14.762
  278    HA   LEU  38           HA       LEU  38  11.544  16.423 -14.766
  279   1HB   LEU  38          2HB       LEU  38  12.611  15.899 -17.440
  280   2HB   LEU  38          1HB       LEU  38  11.253  14.848 -17.039
  281    HG   LEU  38           HG       LEU  38  11.058  17.778 -16.425
  282   1HD1  LEU  38          1HD1      LEU  38  10.578  16.501 -19.136
  283   2HD1  LEU  38          2HD1      LEU  38  11.818  17.697 -18.759
  284   3HD1  LEU  38          3HD1      LEU  38  10.113  18.143 -18.692
  285   1HD2  LEU  38          1HD2      LEU  38   9.345  16.084 -15.688
  286   2HD2  LEU  38          2HD2      LEU  38   9.025  15.742 -17.389
  287   3HD2  LEU  38          3HD2      LEU  38   8.688  17.344 -16.733
  288    H    TYR  39           H        TYR  39  10.207  14.613 -14.220
  289    HA   TYR  39           HA       TYR  39  11.662  12.012 -13.964
  290   1HB   TYR  39          2HB       TYR  39  10.662  13.713 -11.866
  291   2HB   TYR  39          1HB       TYR  39   9.744  12.208 -11.872
  292    HD1  TYR  39           HD1      TYR  39  13.163  13.649 -11.708
  293    HD2  TYR  39           HD2      TYR  39  10.747  10.131 -11.226
  294    HE1  TYR  39           HE1      TYR  39  15.080  12.477 -10.659
  295    HE2  TYR  39           HE2      TYR  39  12.663   8.958 -10.175
  296    HH   TYR  39           HH       TYR  39  14.950  10.029  -8.812
  297    H    GLU  40           H        GLU  40  10.275  10.133 -14.083
  298    HA   GLU  40           HA       GLU  40   7.676  10.724 -15.430
  299   1HB   GLU  40          2HB       GLU  40   7.887   8.404 -16.342
  300   2HB   GLU  40          1HB       GLU  40   9.218   9.455 -16.828
  301   1HG   GLU  40          2HG       GLU  40   9.642   8.014 -14.283
  302   2HG   GLU  40          1HG       GLU  40   9.560   6.986 -15.715
  303    H    ILE  41           H        ILE  41   5.796   9.633 -14.730
  304    HA   ILE  41           HA       ILE  41   6.081   8.155 -12.143
  305    HB   ILE  41           HB       ILE  41   3.544   9.601 -12.776
  306   1HG1  ILE  41          2HG1      ILE  41   5.396  11.219 -13.320
  307   2HG1  ILE  41          1HG1      ILE  41   4.403  11.719 -11.952
  308   1HG2  ILE  41          1HG2      ILE  41   3.715   8.266 -10.746
  309   2HG2  ILE  41          2HG2      ILE  41   3.654   9.972 -10.304
  310   3HG2  ILE  41          3HG2      ILE  41   5.191   9.109 -10.279
  311   1HD1  ILE  41          1HD1      ILE  41   6.832  10.063 -11.396
  312   2HD1  ILE  41          2HD1      ILE  41   6.074  11.307 -10.405
  313   3HD1  ILE  41          3HD1      ILE  41   7.055  11.764 -11.796
  314    H    GLU  42           H        GLU  42   4.761   6.309 -11.909
  315    HA   GLU  42           HA       GLU  42   3.274   5.505 -14.378
  316   1HB   GLU  42          2HB       GLU  42   3.824   3.114 -13.409
  317   2HB   GLU  42          1HB       GLU  42   5.042   3.985 -14.342
  318   1HG   GLU  42          2HG       GLU  42   6.022   4.848 -12.237
  319   2HG   GLU  42          1HG       GLU  42   4.827   3.932 -11.317
  320    H    HIS  43           H        HIS  43   1.133   5.647 -13.905
  321    HA   HIS  43           HA       HIS  43   0.231   4.989 -11.147
  322   1HB   HIS  43          2HB       HIS  43  -1.443   6.142 -13.388
  323   2HB   HIS  43          1HB       HIS  43  -1.779   6.179 -11.657
  324    HD2  HIS  43           HD2      HIS  43   0.252   8.192 -14.303
  325    HE1  HIS  43           HE1      HIS  43   1.025   9.930 -10.533
  326    HE2  HIS  43           HE2      HIS  43   1.331  10.200 -13.036
  327    H    HIS  44           H        HIS  44  -1.212   3.294 -10.774
  328    HA   HIS  44           HA       HIS  44  -1.856   1.584 -13.145
  329   1HB   HIS  44          2HB       HIS  44  -1.625   0.399 -10.406
  330   2HB   HIS  44          1HB       HIS  44  -1.287  -0.333 -11.975
  331    HD2  HIS  44           HD2      HIS  44   0.949   1.859 -13.062
  332    HE1  HIS  44           HE1      HIS  44   3.026   0.926  -9.504
  333    HE2  HIS  44           HE2      HIS  44   3.237   1.957 -11.812
  334    H    LEU  45           H        LEU  45  -4.016   1.357 -13.459
  335    HA   LEU  45           HA       LEU  45  -5.807   1.588 -11.077
  336   1HB   LEU  45          2HB       LEU  45  -6.462   2.705 -13.816
  337   2HB   LEU  45          1HB       LEU  45  -7.359   2.942 -12.315
  338    HG   LEU  45           HG       LEU  45  -4.941   3.856 -11.534
  339   1HD1  LEU  45          1HD1      LEU  45  -3.831   3.555 -13.652
  340   2HD1  LEU  45          2HD1      LEU  45  -4.100   5.286 -13.445
  341   3HD1  LEU  45          3HD1      LEU  45  -5.146   4.352 -14.515
  342   1HD2  LEU  45          1HD2      LEU  45  -5.851   6.073 -11.801
  343   2HD2  LEU  45          2HD2      LEU  45  -7.209   4.992 -11.495
  344   3HD2  LEU  45          3HD2      LEU  45  -6.880   5.549 -13.135
  345    H    PHE  46           H        PHE  46  -7.683   0.261 -11.173
  346    HA   PHE  46           HA       PHE  46  -7.832  -1.589 -13.509
  347   1HB   PHE  46          2HB       PHE  46  -8.620  -3.048 -11.216
  348   2HB   PHE  46          1HB       PHE  46  -7.179  -3.303 -12.202
  349    HD1  PHE  46           HD1      PHE  46  -8.401  -2.350  -8.984
  350    HD2  PHE  46           HD2      PHE  46  -5.135  -1.768 -11.713
  351    HE1  PHE  46           HE1      PHE  46  -6.976  -1.565  -7.112
  352    HE2  PHE  46           HE2      PHE  46  -3.710  -0.984  -9.841
  353    HZ   PHE  46           HZ       PHE  46  -4.631  -0.883  -7.541
  354    H    ALA  47           H        ALA  47  -9.958  -2.534 -13.822
  355    HA   ALA  47           HA       ALA  47 -12.138  -1.105 -12.354
  356   1HB   ALA  47          1HB       ALA  47 -13.164  -0.430 -14.301
  357   2HB   ALA  47          2HB       ALA  47 -12.563  -1.812 -15.218
  358   3HB   ALA  47          3HB       ALA  47 -11.499  -0.445 -14.884
  359    H    GLU  48           H        GLU  48 -14.337  -2.298 -13.074
  360    HA   GLU  48           HA       GLU  48 -13.800  -5.232 -12.819
  361   1HB   GLU  48          2HB       GLU  48 -16.310  -3.837 -11.874
  362   2HB   GLU  48          1HB       GLU  48 -15.717  -5.438 -11.428
  363   1HG   GLU  48          2HG       GLU  48 -13.915  -4.517 -10.150
  364   2HG   GLU  48          1HG       GLU  48 -14.188  -2.902 -10.804
  365    H    ASP  49           H        ASP  49 -15.405  -2.728 -14.583
  366    HA   ASP  49           HA       ASP  49 -16.664  -4.820 -16.310
  367   1HB   ASP  49          2HB       ASP  49 -18.091  -3.029 -14.811
  368   2HB   ASP  49          1HB       ASP  49 -17.913  -2.141 -16.325
  369    H    PHE  50           H        PHE  50 -15.417  -4.827 -18.125
  370    HA   PHE  50           HA       PHE  50 -13.623  -2.971 -19.065
  371   1HB   PHE  50          2HB       PHE  50 -13.746  -4.960 -20.314
  372   2HB   PHE  50          1HB       PHE  50 -15.487  -4.810 -20.553
  373    HD1  PHE  50           HD1      PHE  50 -12.191  -3.368 -21.496
  374    HD2  PHE  50           HD2      PHE  50 -16.388  -3.574 -22.385
  375    HE1  PHE  50           HE1      PHE  50 -11.795  -2.183 -23.638
  376    HE2  PHE  50           HE2      PHE  50 -15.992  -2.389 -24.528
  377    HZ   PHE  50           HZ       PHE  50 -13.696  -1.693 -25.153
  378    H    ASP  51           H        ASP  51 -17.035  -2.543 -18.873
  379    HA   ASP  51           HA       ASP  51 -17.374  -0.601 -20.959
  380   1HB   ASP  51          2HB       ASP  51 -19.147  -1.857 -19.484
  381   2HB   ASP  51          1HB       ASP  51 -18.940  -0.484 -18.397
  382    H    LYS  52           H        LYS  52 -17.622   0.224 -17.500
  383    HA   LYS  52           HA       LYS  52 -16.943   2.937 -17.804
  384   1HB   LYS  52          2HB       LYS  52 -16.544   2.976 -15.425
  385   2HB   LYS  52          1HB       LYS  52 -17.858   1.835 -15.718
  386   1HG   LYS  52          2HG       LYS  52 -16.206  -0.029 -15.687
  387   2HG   LYS  52          1HG       LYS  52 -14.938   1.133 -15.292
  388   1HD   LYS  52          2HD       LYS  52 -15.906   1.641 -13.185
  389   2HD   LYS  52          1HD       LYS  52 -17.439   0.882 -13.618
  390   1HE   LYS  52          2HE       LYS  52 -15.964  -1.278 -13.896
  391   2HE   LYS  52          1HE       LYS  52 -14.837  -0.409 -12.854
  392   1HZ   LYS  52          1HZ       LYS  52 -16.498  -1.851 -11.687
  393   2HZ   LYS  52          2HZ       LYS  52 -17.703  -0.764 -12.192
  394   3HZ   LYS  52          3HZ       LYS  52 -16.455  -0.237 -11.166
  395    H    LEU  53           H        LEU  53 -14.857   0.113 -17.529
  396    HA   LEU  53           HA       LEU  53 -12.390   1.307 -16.940
  397   1HB   LEU  53          2HB       LEU  53 -12.904  -1.173 -17.321
  398   2HB   LEU  53          1HB       LEU  53 -12.720  -0.841 -19.044
  399    HG   LEU  53           HG       LEU  53 -10.605  -0.118 -17.005
  400   1HD1  LEU  53          1HD1      LEU  53 -11.262  -2.656 -17.313
  401   2HD1  LEU  53          2HD1      LEU  53  -9.564  -2.179 -17.301
  402   3HD1  LEU  53          3HD1      LEU  53 -10.383  -2.487 -18.833
  403   1HD2  LEU  53          1HD2      LEU  53  -9.372  -0.541 -19.402
  404   2HD2  LEU  53          2HD2      LEU  53  -9.944   1.038 -18.864
  405   3HD2  LEU  53          3HD2      LEU  53 -10.937   0.061 -19.946
  406    H    GLU  54           H        GLU  54 -13.719   0.743 -20.225
  407    HA   GLU  54           HA       GLU  54 -11.682   2.241 -21.564
  408   1HB   GLU  54          2HB       GLU  54 -13.460   0.591 -22.525
  409   2HB   GLU  54          1HB       GLU  54 -14.496   2.016 -22.611
  410   1HG   GLU  54          2HG       GLU  54 -13.049   3.123 -24.119
  411   2HG   GLU  54          1HG       GLU  54 -11.705   2.040 -23.756
  412    H    LYS  55           H        LYS  55 -15.034   3.167 -20.709
  413    HA   LYS  55           HA       LYS  55 -15.086   5.786 -21.598
  414   1HB   LYS  55          2HB       LYS  55 -16.092   4.802 -18.910
  415   2HB   LYS  55          1HB       LYS  55 -16.612   6.280 -19.719
  416   1HG   LYS  55          2HG       LYS  55 -17.154   4.679 -21.723
  417   2HG   LYS  55          1HG       LYS  55 -17.139   3.422 -20.486
  418   1HD   LYS  55          2HD       LYS  55 -19.346   4.025 -20.293
  419   2HD   LYS  55          1HD       LYS  55 -18.663   5.247 -19.219
  420   1HE   LYS  55          2HE       LYS  55 -19.815   6.676 -20.588
  421   2HE   LYS  55          1HE       LYS  55 -18.375   6.514 -21.593
  422   1HZ   LYS  55          1HZ       LYS  55 -19.597   4.492 -22.556
  423   2HZ   LYS  55          2HZ       LYS  55 -20.092   6.041 -23.044
  424   3HZ   LYS  55          3HZ       LYS  55 -20.992   5.185 -21.884
  425    H    ALA  56           H        ALA  56 -13.702   4.680 -18.490
  426    HA   ALA  56           HA       ALA  56 -12.755   7.320 -17.769
  427   1HB   ALA  56          1HB       ALA  56 -13.187   5.308 -16.213
  428   2HB   ALA  56          2HB       ALA  56 -11.741   6.267 -15.902
  429   3HB   ALA  56          3HB       ALA  56 -11.611   4.721 -16.741
  430    H    ALA  57           H        ALA  57 -10.917   4.376 -18.686
  431    HA   ALA  57           HA       ALA  57  -8.382   5.324 -18.963
  432   1HB   ALA  57          1HB       ALA  57  -8.349   3.226 -19.831
  433   2HB   ALA  57          2HB       ALA  57  -8.616   4.025 -21.379
  434   3HB   ALA  57          3HB       ALA  57  -9.983   3.372 -20.476
  435    H    VAL  58           H        VAL  58 -10.872   5.768 -21.503
  436    HA   VAL  58           HA       VAL  58  -9.295   7.409 -23.202
  437    HB   VAL  58           HB       VAL  58 -12.284   7.676 -22.798
  438   1HG1  VAL  58          1HG1      VAL  58 -11.387   9.355 -24.271
  439   2HG1  VAL  58          2HG1      VAL  58 -12.140   8.127 -25.288
  440   3HG1  VAL  58          3HG1      VAL  58 -10.386   8.167 -25.106
  441   1HG2  VAL  58          1HG2      VAL  58 -12.624   5.640 -23.733
  442   2HG2  VAL  58          2HG2      VAL  58 -10.938   5.306 -23.336
  443   3HG2  VAL  58          3HG2      VAL  58 -11.365   5.900 -24.940
  444    H    GLU  59           H        GLU  59 -11.709   8.412 -20.747
  445    HA   GLU  59           HA       GLU  59 -11.370  11.180 -20.913
  446   1HB   GLU  59          2HB       GLU  59 -12.760   9.548 -19.248
  447   2HB   GLU  59          1HB       GLU  59 -11.487  10.091 -18.155
  448   1HG   GLU  59          2HG       GLU  59 -13.139  11.981 -19.849
  449   2HG   GLU  59          1HG       GLU  59 -13.548  11.564 -18.184
  450    H    ALA  60           H        ALA  60  -9.355   8.831 -19.155
  451    HA   ALA  60           HA       ALA  60  -7.600  10.818 -18.011
  452   1HB   ALA  60          1HB       ALA  60  -7.753   7.898 -18.150
  453   2HB   ALA  60          2HB       ALA  60  -7.107   8.926 -16.870
  454   3HB   ALA  60          3HB       ALA  60  -6.095   8.492 -18.248
  455    H    PHE  61           H        PHE  61  -7.606   8.973 -21.029
  456    HA   PHE  61           HA       PHE  61  -4.966   9.637 -21.888
  457   1HB   PHE  61          2HB       PHE  61  -6.596   7.945 -22.927
  458   2HB   PHE  61          1HB       PHE  61  -7.339   9.324 -23.736
  459    HD1  PHE  61           HD1      PHE  61  -3.854   8.106 -23.025
  460    HD2  PHE  61           HD2      PHE  61  -6.607   9.708 -25.907
  461    HE1  PHE  61           HE1      PHE  61  -2.076   8.051 -24.753
  462    HE2  PHE  61           HE2      PHE  61  -4.829   9.653 -27.635
  463    HZ   PHE  61           HZ       PHE  61  -2.564   8.825 -27.058
  464    H    LYS  62           H        LYS  62  -8.093  11.214 -22.656
  465    HA   LYS  62           HA       LYS  62  -7.046  13.357 -24.173
  466   1HB   LYS  62          2HB       LYS  62  -9.445  12.967 -24.053
  467   2HB   LYS  62          1HB       LYS  62  -9.445  13.291 -22.318
  468   1HG   LYS  62          2HG       LYS  62  -8.664  15.605 -22.768
  469   2HG   LYS  62          1HG       LYS  62  -8.740  15.277 -24.500
  470   1HD   LYS  62          2HD       LYS  62 -11.184  14.681 -22.902
  471   2HD   LYS  62          1HD       LYS  62 -10.795  16.381 -23.168
  472   1HE   LYS  62          2HE       LYS  62 -11.049  14.279 -25.341
  473   2HE   LYS  62          1HE       LYS  62 -12.257  15.507 -24.961
  474   1HZ   LYS  62          1HZ       LYS  62  -9.796  16.785 -25.271
  475   2HZ   LYS  62          2HZ       LYS  62 -11.173  16.912 -26.257
  476   3HZ   LYS  62          3HZ       LYS  62  -9.990  15.741 -26.594
  477    H    MET  63           H        MET  63  -7.396  12.997 -20.658
  478    HA   MET  63           HA       MET  63  -6.759  15.603 -19.831
  479   1HB   MET  63          2HB       MET  63  -7.278  13.418 -18.453
  480   2HB   MET  63          1HB       MET  63  -5.521  13.256 -18.425
  481   1HG   MET  63          2HG       MET  63  -5.363  15.585 -17.532
  482   2HG   MET  63          1HG       MET  63  -7.124  15.639 -17.455
  483   1HE   MET  63          1HE       MET  63  -8.490  13.936 -16.522
  484   2HE   MET  63          2HE       MET  63  -8.228  13.177 -14.954
  485   3HE   MET  63          3HE       MET  63  -7.681  12.366 -16.419
  486    H    GLY  64           H        GLY  64  -4.421  12.920 -20.280
  487   1HA   GLY  64          2HA       GLY  64  -2.493  13.964 -21.835
  488   2HA   GLY  64          1HA       GLY  64  -2.222  14.892 -20.359
  489    H    PHE  65           H        PHE  65  -3.334  11.553 -20.352
  490    HA   PHE  65           HA       PHE  65  -0.689  10.779 -19.183
  491   1HB   PHE  65          2HB       PHE  65  -3.500   9.882 -18.518
  492   2HB   PHE  65          1HB       PHE  65  -2.082   8.956 -18.028
  493    HD1  PHE  65           HD1      PHE  65  -3.158  12.559 -18.078
  494    HD2  PHE  65           HD2      PHE  65  -1.294   9.371 -15.884
  495    HE1  PHE  65           HE1      PHE  65  -2.827  14.081 -16.148
  496    HE2  PHE  65           HE2      PHE  65  -0.964  10.892 -13.954
  497    HZ   PHE  65           HZ       PHE  65  -1.731  13.247 -14.086
  498    H    GLU  66           H        GLU  66   0.313   8.983 -20.066
  499    HA   GLU  66           HA       GLU  66  -0.794   7.945 -22.575
  500   1HB   GLU  66          2HB       GLU  66   1.766   8.350 -21.660
  501   2HB   GLU  66          1HB       GLU  66   1.582   6.608 -21.459
  502   1HG   GLU  66          2HG       GLU  66   1.163   8.200 -24.003
  503   2HG   GLU  66          1HG       GLU  66   2.427   7.011 -23.691
  504    H    VAL  67           H        VAL  67  -2.689   6.858 -21.691
  505    HA   VAL  67           HA       VAL  67  -2.675   4.897 -19.664
  506    HB   VAL  67           HB       VAL  67  -4.727   5.791 -20.765
  507   1HG1  VAL  67          1HG1      VAL  67  -4.914   3.955 -22.943
  508   2HG1  VAL  67          2HG1      VAL  67  -3.382   4.815 -23.100
  509   3HG1  VAL  67          3HG1      VAL  67  -4.895   5.718 -23.008
  510   1HG2  VAL  67          1HG2      VAL  67  -4.584   3.552 -19.495
  511   2HG2  VAL  67          2HG2      VAL  67  -4.625   2.786 -21.083
  512   3HG2  VAL  67          3HG2      VAL  67  -5.980   3.781 -20.548
  513    H    LEU  68           H        LEU  68  -2.854   2.483 -20.004
  514    HA   LEU  68           HA       LEU  68  -1.353   1.488 -22.361
  515   1HB   LEU  68          2HB       LEU  68  -0.163   1.842 -19.804
  516   2HB   LEU  68          1HB       LEU  68  -0.396   0.107 -20.026
  517    HG   LEU  68           HG       LEU  68   0.832   1.866 -22.157
  518   1HD1  LEU  68          1HD1      LEU  68   3.022   0.990 -21.367
  519   2HD1  LEU  68          2HD1      LEU  68   2.206   0.246 -19.991
  520   3HD1  LEU  68          3HD1      LEU  68   2.238   2.002 -20.153
  521   1HD2  LEU  68          1HD2      LEU  68   1.833  -0.549 -22.609
  522   2HD2  LEU  68          2HD2      LEU  68   0.220  -0.128 -23.183
  523   3HD2  LEU  68          3HD2      LEU  68   0.411  -1.069 -21.703
  524    H    GLU  69           H        GLU  69  -2.205  -0.421 -23.064
  525    HA   GLU  69           HA       GLU  69  -4.622  -1.471 -22.330
  526   1HB   GLU  69          2HB       GLU  69  -3.528  -3.788 -22.992
  527   2HB   GLU  69          1HB       GLU  69  -3.727  -2.521 -24.202
  528   1HG   GLU  69          2HG       GLU  69  -1.402  -1.751 -23.724
  529   2HG   GLU  69          1HG       GLU  69  -1.211  -3.111 -22.616
  530    H    ALA  70           H        ALA  70  -5.151  -3.522 -21.119
  531    HA   ALA  70           HA       ALA  70  -3.528  -3.677 -18.610
  532   1HB   ALA  70          1HB       ALA  70  -6.508  -3.969 -19.061
  533   2HB   ALA  70          2HB       ALA  70  -5.685  -2.756 -18.082
  534   3HB   ALA  70          3HB       ALA  70  -5.713  -4.441 -17.560
  535    H    GLU  71           H        GLU  71  -3.491  -5.833 -17.587
  536    HA   GLU  71           HA       GLU  71  -3.839  -8.020 -19.602
  537   1HB   GLU  71          2HB       GLU  71  -2.005  -9.157 -18.173
  538   2HB   GLU  71          1HB       GLU  71  -1.507  -7.843 -19.239
  539   1HG   GLU  71          2HG       GLU  71  -2.310  -7.292 -16.386
  540   2HG   GLU  71          1HG       GLU  71  -0.667  -7.798 -16.782
  541    H    GLU  72           H        GLU  72  -4.727  -9.989 -18.832
  542    HA   GLU  72           HA       GLU  72  -6.622  -9.772 -16.695
  543   1HB   GLU  72          2HB       GLU  72  -5.490 -12.264 -18.005
  544   2HB   GLU  72          1HB       GLU  72  -6.954 -12.195 -17.024
  545   1HG   GLU  72          2HG       GLU  72  -7.518 -10.237 -18.796
  546   2HG   GLU  72          1HG       GLU  72  -6.496 -11.258 -19.807
  547    H    THR  73           H        THR  73  -6.072  -9.655 -14.574
  548    HA   THR  73           HA       THR  73  -3.756 -11.305 -13.641
  549    HB   THR  73           HB       THR  73  -3.281  -8.921 -13.405
  550    HG1  THR  73           HG1      THR  73  -2.919 -10.532 -11.626
  551   1HG2  THR  73          1HG2      THR  73  -5.341  -7.823 -13.402
  552   2HG2  THR  73          2HG2      THR  73  -4.858  -7.693 -11.710
  553   3HG2  THR  73          3HG2      THR  73  -6.033  -8.915 -12.201
  554    H    GLU  74           H        GLU  74  -4.724 -10.380 -10.851
  555    HA   GLU  74           HA       GLU  74  -7.316 -11.428 -10.355
  556   1HB   GLU  74          2HB       GLU  74  -6.621 -13.650  -9.355
  557   2HB   GLU  74          1HB       GLU  74  -6.524 -13.574 -11.115
  558   1HG   GLU  74          2HG       GLU  74  -4.049 -12.772 -10.629
  559   2HG   GLU  74          1HG       GLU  74  -4.309 -13.602  -9.094
  560    H    ASP  75           H        ASP  75  -7.817 -10.701  -8.338
  561    HA   ASP  75           HA       ASP  75  -5.870  -9.429  -6.672
  562   1HB   ASP  75          2HB       ASP  75  -8.706  -9.738  -6.713
  563   2HB   ASP  75          1HB       ASP  75  -8.145 -10.225  -5.114
  564    H    GLU  76           H        GLU  76  -5.957 -10.202  -4.152
  565    HA   GLU  76           HA       GLU  76  -4.511 -12.718  -4.130
  566   1HB   GLU  76          2HB       GLU  76  -5.559 -11.095  -1.789
  567   2HB   GLU  76          1HB       GLU  76  -4.315 -12.344  -1.722
  568   1HG   GLU  76          2HG       GLU  76  -4.052  -9.884  -3.461
  569   2HG   GLU  76          1HG       GLU  76  -3.467  -9.936  -1.797
  570    H    ASP  77           H        ASP  77  -7.343 -12.807  -5.020
  571    HA   ASP  77           HA       ASP  77  -8.195 -14.997  -3.213
  572   1HB   ASP  77          2HB       ASP  77  -9.902 -12.599  -3.935
  573   2HB   ASP  77          1HB       ASP  77 -10.556 -14.093  -3.264
  574    H    GLY  78           H        GLY  78  -8.574 -13.247  -6.264
  575   1HA   GLY  78          2HA       GLY  78  -8.512 -14.618  -8.336
  576   2HA   GLY  78          1HA       GLY  78  -9.492 -15.816  -7.491
  577    H    ASN  79           H        ASN  79  -9.638 -12.338  -8.337
  578    HA   ASN  79           HA       ASN  79 -12.576 -12.690  -8.749
  579   1HB   ASN  79          2HB       ASN  79 -10.863 -10.368  -7.923
  580   2HB   ASN  79          1HB       ASN  79 -12.394 -10.058  -8.742
  581   1HD2  ASN  79          1HD2      ASN  79 -10.969 -10.874  -5.705
  582   2HD2  ASN  79          2HD2      ASN  79 -12.411 -11.187  -4.865
  583    H    LYS  80           H        LYS  80  -9.633 -12.326 -10.386
  584    HA   LYS  80           HA       LYS  80  -9.110 -11.863 -12.627
  585   1HB   LYS  80          2HB       LYS  80 -12.038 -12.479 -13.106
  586   2HB   LYS  80          1HB       LYS  80 -10.709 -12.643 -14.255
  587   1HG   LYS  80          2HG       LYS  80  -9.671 -14.327 -12.688
  588   2HG   LYS  80          1HG       LYS  80 -11.152 -14.261 -11.732
  589   1HD   LYS  80          2HD       LYS  80 -12.356 -15.438 -13.271
  590   2HD   LYS  80          1HD       LYS  80 -11.541 -14.675 -14.638
  591   1HE   LYS  80          2HE       LYS  80  -9.803 -16.204 -14.636
  592   2HE   LYS  80          1HE       LYS  80  -9.960 -16.537 -12.911
  593   1HZ   LYS  80          1HZ       LYS  80 -11.975 -17.755 -13.335
  594   2HZ   LYS  80          2HZ       LYS  80 -10.729 -18.383 -14.305
  595   3HZ   LYS  80          3HZ       LYS  80 -11.913 -17.373 -14.986
  596    H    LEU  81           H        LEU  81  -8.702  -9.659 -12.700
  597    HA   LEU  81           HA       LEU  81 -10.961  -7.963 -13.627
  598   1HB   LEU  81          2HB       LEU  81  -9.974  -6.108 -12.133
  599   2HB   LEU  81          1HB       LEU  81 -10.920  -7.363 -11.331
  600    HG   LEU  81           HG       LEU  81  -8.079  -8.050 -11.606
  601   1HD1  LEU  81          1HD1      LEU  81  -7.222  -6.471 -10.006
  602   2HD1  LEU  81          2HD1      LEU  81  -8.826  -5.797  -9.724
  603   3HD1  LEU  81          3HD1      LEU  81  -8.018  -5.535 -11.270
  604   1HD2  LEU  81          1HD2      LEU  81  -8.410  -8.909  -9.425
  605   2HD2  LEU  81          2HD2      LEU  81  -9.978  -9.123 -10.203
  606   3HD2  LEU  81          3HD2      LEU  81  -9.722  -7.782  -9.087
  607    H    LEU  82           H        LEU  82 -10.239  -6.113 -14.867
  608    HA   LEU  82           HA       LEU  82  -7.638  -6.605 -16.177
  609   1HB   LEU  82          2HB       LEU  82  -9.715  -4.493 -16.816
  610   2HB   LEU  82          1HB       LEU  82  -8.397  -5.034 -17.855
  611    HG   LEU  82           HG       LEU  82  -9.879  -7.342 -17.055
  612   1HD1  LEU  82          1HD1      LEU  82 -12.103  -6.866 -17.725
  613   2HD1  LEU  82          2HD1      LEU  82 -11.648  -5.312 -18.423
  614   3HD1  LEU  82          3HD1      LEU  82 -11.664  -5.521 -16.671
  615   1HD2  LEU  82          1HD2      LEU  82  -9.521  -5.828 -19.654
  616   2HD2  LEU  82          2HD2      LEU  82 -10.347  -7.383 -19.559
  617   3HD2  LEU  82          3HD2      LEU  82  -8.645  -7.260 -19.115
  618    H    CYS  83           H        CYS  83  -5.865  -5.280 -15.945
  619    HA   CYS  83           HA       CYS  83  -6.220  -2.792 -14.328
  620   1HB   CYS  83          2HB       CYS  83  -3.983  -3.287 -13.312
  621   2HB   CYS  83          1HB       CYS  83  -5.216  -4.472 -12.884
  622    HG   CYS  83           HG       CYS  83  -4.173  -5.964 -14.911
  623    H    PHE  84           H        PHE  84  -5.862  -1.191 -15.817
  624    HA   PHE  84           HA       PHE  84  -3.773  -1.595 -17.884
  625   1HB   PHE  84          2HB       PHE  84  -4.649   0.689 -18.673
  626   2HB   PHE  84          1HB       PHE  84  -5.766  -0.670 -18.795
  627    HD1  PHE  84           HD1      PHE  84  -7.326  -1.082 -16.735
  628    HD2  PHE  84           HD2      PHE  84  -5.297   2.621 -17.522
  629    HE1  PHE  84           HE1      PHE  84  -8.939   0.111 -15.278
  630    HE2  PHE  84           HE2      PHE  84  -6.910   3.814 -16.064
  631    HZ   PHE  84           HZ       PHE  84  -8.731   2.559 -14.942
  632    H    ASP  85           H        ASP  85  -2.257   0.300 -18.267
  633    HA   ASP  85           HA       ASP  85  -1.495   1.541 -15.650
  634   1HB   ASP  85          2HB       ASP  85   0.167   0.223 -17.776
  635   2HB   ASP  85          1HB       ASP  85   0.874   1.509 -16.795
  636    H    ALA  86           H        ALA  86  -0.451   3.650 -15.824
  637    HA   ALA  86           HA       ALA  86  -0.763   5.029 -18.437
  638   1HB   ALA  86          1HB       ALA  86  -2.689   5.974 -17.689
  639   2HB   ALA  86          2HB       ALA  86  -1.638   6.948 -16.659
  640   3HB   ALA  86          3HB       ALA  86  -2.383   5.481 -16.023
  641    H    THR  87           H        THR  87   0.859   6.535 -18.775
  642    HA   THR  87           HA       THR  87   2.769   6.924 -16.510
  643    HB   THR  87           HB       THR  87   4.183   7.700 -18.686
  644    HG1  THR  87           HG1      THR  87   2.055   6.780 -19.746
  645   1HG2  THR  87          1HG2      THR  87   3.760   4.868 -17.694
  646   2HG2  THR  87          2HG2      THR  87   4.919   6.038 -17.062
  647   3HG2  THR  87          3HG2      THR  87   5.120   5.390 -18.689
  648    H    MET  88           H        MET  88   3.770   9.069 -16.339
  649    HA   MET  88           HA       MET  88   2.532  11.285 -17.821
  650   1HB   MET  88          2HB       MET  88   1.003  10.657 -15.833
  651   2HB   MET  88          1HB       MET  88   2.287  11.309 -14.812
  652   1HG   MET  88          2HG       MET  88   0.873  13.163 -15.171
  653   2HG   MET  88          1HG       MET  88   2.165  13.393 -16.350
  654   1HE   MET  88          1HE       MET  88  -0.507  14.731 -16.247
  655   2HE   MET  88          2HE       MET  88  -1.347  14.587 -17.791
  656   3HE   MET  88          3HE       MET  88   0.343  15.087 -17.757
  657    H    GLN  89           H        GLN  89   4.301  12.487 -18.307
  658    HA   GLN  89           HA       GLN  89   6.716  12.370 -16.671
  659   1HB   GLN  89          2HB       GLN  89   5.938  13.964 -19.124
  660   2HB   GLN  89          1HB       GLN  89   7.501  14.149 -18.326
  661   1HG   GLN  89          2HG       GLN  89   8.286  12.264 -19.275
  662   2HG   GLN  89          1HG       GLN  89   6.884  11.343 -18.728
  663   1HE2  GLN  89          1HE2      GLN  89   5.228  10.903 -20.260
  664   2HE2  GLN  89          2HE2      GLN  89   5.277  11.438 -21.871
  665    H    SER  90           H        SER  90   7.399  13.890 -15.185
  666    HA   SER  90           HA       SER  90   6.337  16.577 -15.070
  667   1HB   SER  90          2HB       SER  90   4.659  16.392 -13.558
  668   2HB   SER  90          1HB       SER  90   4.656  14.678 -13.962
  669    HG   SER  90           HG       SER  90   4.898  14.993 -11.724
  670    H    ALA  91           H        ALA  91   7.358  17.810 -13.335
  671    HA   ALA  91           HA       ALA  91  10.047  17.014 -12.791
  672   1HB   ALA  91          1HB       ALA  91  10.007  19.263 -12.500
  673   2HB   ALA  91          2HB       ALA  91   9.479  18.902 -10.857
  674   3HB   ALA  91          3HB       ALA  91   8.289  19.266 -12.106
  675    H    LEU  92           H        LEU  92  10.898  16.908 -10.434
  676    HA   LEU  92           HA       LEU  92   9.309  14.842  -9.031
  677   1HB   LEU  92          2HB       LEU  92  11.719  14.436  -9.440
  678   2HB   LEU  92          1HB       LEU  92  12.111  15.870  -8.488
  679    HG   LEU  92           HG       LEU  92  10.958  14.852  -6.531
  680   1HD1  LEU  92          1HD1      LEU  92   9.439  13.258  -7.095
  681   2HD1  LEU  92          2HD1      LEU  92  10.824  12.167  -7.092
  682   3HD1  LEU  92          3HD1      LEU  92  10.265  12.876  -8.606
  683   1HD2  LEU  92          1HD2      LEU  92  13.442  14.538  -7.059
  684   2HD2  LEU  92          2HD2      LEU  92  13.012  12.937  -7.662
  685   3HD2  LEU  92          3HD2      LEU  92  12.731  13.347  -5.970
  686    H    ASP  93           H        ASP  93   7.677  16.102  -8.030
  687    HA   ASP  93           HA       ASP  93   8.575  17.518  -5.610
  688   1HB   ASP  93          2HB       ASP  93   7.222  18.866  -7.932
  689   2HB   ASP  93          1HB       ASP  93   6.902  19.427  -6.291
  690    H    ALA  94           H        ALA  94   7.225  16.902  -3.993
  691    HA   ALA  94           HA       ALA  94   5.078  15.140  -4.269
  692   1HB   ALA  94          1HB       ALA  94   4.306  16.470  -2.042
  693   2HB   ALA  94          2HB       ALA  94   5.974  17.030  -2.162
  694   3HB   ALA  94          3HB       ALA  94   5.628  15.304  -2.053
  695    H    LYS  95           H        LYS  95   4.692  18.647  -3.615
  696    HA   LYS  95           HA       LYS  95   2.013  19.012  -3.881
  697   1HB   LYS  95          2HB       LYS  95   4.324  20.603  -4.909
  698   2HB   LYS  95          1HB       LYS  95   2.705  21.075  -5.427
  699   1HG   LYS  95          2HG       LYS  95   2.006  21.094  -3.016
  700   2HG   LYS  95          1HG       LYS  95   3.690  20.805  -2.574
  701   1HD   LYS  95          2HD       LYS  95   3.591  23.130  -2.464
  702   2HD   LYS  95          1HD       LYS  95   4.146  22.889  -4.121
  703   1HE   LYS  95          2HE       LYS  95   1.451  22.753  -4.476
  704   2HE   LYS  95          1HE       LYS  95   1.543  23.890  -3.131
  705   1HZ   LYS  95          1HZ       LYS  95   1.664  24.899  -5.403
  706   2HZ   LYS  95          2HZ       LYS  95   3.181  24.156  -5.585
  707   3HZ   LYS  95          3HZ       LYS  95   2.940  25.313  -4.365
  708    H    LEU  96           H        LEU  96   4.199  18.605  -6.682
  709    HA   LEU  96           HA       LEU  96   2.137  18.707  -8.663
  710   1HB   LEU  96          2HB       LEU  96   4.943  17.658  -8.569
  711   2HB   LEU  96          1HB       LEU  96   3.921  17.224  -9.940
  712    HG   LEU  96           HG       LEU  96   3.535  19.546 -10.476
  713   1HD1  LEU  96          1HD1      LEU  96   3.350  20.504  -8.271
  714   2HD1  LEU  96          2HD1      LEU  96   4.680  21.326  -9.086
  715   3HD1  LEU  96          3HD1      LEU  96   5.017  20.077  -7.887
  716   1HD2  LEU  96          1HD2      LEU  96   6.306  18.553 -10.088
  717   2HD2  LEU  96          2HD2      LEU  96   6.147  20.284 -10.386
  718   3HD2  LEU  96          3HD2      LEU  96   5.512  19.127 -11.555
  719    H    ILE  97           H        ILE  97   3.942  15.758  -7.724
  720    HA   ILE  97           HA       ILE  97   2.267  13.839  -8.772
  721    HB   ILE  97           HB       ILE  97   3.635  13.808  -6.067
  722   1HG1  ILE  97          2HG1      ILE  97   4.504  12.282  -8.500
  723   2HG1  ILE  97          1HG1      ILE  97   4.863  14.006  -8.407
  724   1HG2  ILE  97          1HG2      ILE  97   1.860  12.134  -6.086
  725   2HG2  ILE  97          2HG2      ILE  97   3.419  11.326  -6.256
  726   3HG2  ILE  97          3HG2      ILE  97   2.385  11.554  -7.667
  727   1HD1  ILE  97          1HD1      ILE  97   5.532  12.072  -6.178
  728   2HD1  ILE  97          2HD1      ILE  97   6.101  13.729  -6.374
  729   3HD1  ILE  97          3HD1      ILE  97   6.663  12.469  -7.471
  730    H    ASP  98           H        ASP  98   1.558  16.008  -6.163
  731    HA   ASP  98           HA       ASP  98  -0.673  14.490  -5.080
  732   1HB   ASP  98          2HB       ASP  98   0.738  16.894  -4.433
  733   2HB   ASP  98          1HB       ASP  98  -0.976  17.287  -4.564
  734    H    GLU  99           H        GLU  99  -0.371  17.277  -7.291
  735    HA   GLU  99           HA       GLU  99  -3.190  17.584  -7.732
  736   1HB   GLU  99          2HB       GLU  99  -0.688  18.505  -9.069
  737   2HB   GLU  99          1HB       GLU  99  -2.168  18.547 -10.026
  738   1HG   GLU  99          2HG       GLU  99  -2.452  19.593  -7.278
  739   2HG   GLU  99          1HG       GLU  99  -1.392  20.539  -8.322
  740    H    GLN 100           H        GLN 100  -0.673  15.805  -9.531
  741    HA   GLN 100           HA       GLN 100  -2.356  14.854 -11.619
  742   1HB   GLN 100          2HB       GLN 100   0.015  13.429 -10.373
  743   2HB   GLN 100          1HB       GLN 100  -0.650  13.147 -11.982
  744   1HG   GLN 100          2HG       GLN 100  -0.218  15.879 -11.973
  745   2HG   GLN 100          1HG       GLN 100   1.160  15.263 -11.060
  746   1HE2  GLN 100          1HE2      GLN 100   0.481  16.145 -14.104
  747   2HE2  GLN 100          2HE2      GLN 100   1.378  15.000 -14.981
  748    H    VAL 101           H        VAL 101  -1.264  13.020  -8.732
  749    HA   VAL 101           HA       VAL 101  -3.033  10.844  -9.058
  750    HB   VAL 101           HB       VAL 101  -2.004  12.066  -6.478
  751   1HG1  VAL 101          1HG1      VAL 101  -3.309   9.413  -7.121
  752   2HG1  VAL 101          2HG1      VAL 101  -3.826  10.610  -5.935
  753   3HG1  VAL 101          3HG1      VAL 101  -2.355   9.676  -5.661
  754   1HG2  VAL 101          1HG2      VAL 101  -0.863   9.562  -7.558
  755   2HG2  VAL 101          2HG2      VAL 101  -0.046  10.952  -6.842
  756   3HG2  VAL 101          3HG2      VAL 101  -0.543  10.996  -8.534
  757    H    GLU 102           H        GLU 102  -3.524  13.862  -7.198
  758    HA   GLU 102           HA       GLU 102  -6.069  13.340  -6.152
  759   1HB   GLU 102          2HB       GLU 102  -4.698  15.425  -5.772
  760   2HB   GLU 102          1HB       GLU 102  -5.222  15.988  -7.360
  761   1HG   GLU 102          2HG       GLU 102  -7.388  15.049  -5.574
  762   2HG   GLU 102          1HG       GLU 102  -6.569  16.523  -5.057
  763    H    LYS 103           H        LYS 103  -5.161  14.243  -9.443
  764    HA   LYS 103           HA       LYS 103  -7.858  14.666 -10.386
  765   1HB   LYS 103          2HB       LYS 103  -5.176  14.634 -11.499
  766   2HB   LYS 103          1HB       LYS 103  -6.303  13.787 -12.558
  767   1HG   LYS 103          2HG       LYS 103  -6.173  16.230 -13.050
  768   2HG   LYS 103          1HG       LYS 103  -7.795  15.715 -12.585
  769   1HD   LYS 103          2HD       LYS 103  -7.763  16.928 -10.662
  770   2HD   LYS 103          1HD       LYS 103  -6.082  16.514 -10.322
  771   1HE   LYS 103          2HE       LYS 103  -6.607  18.335 -12.629
  772   2HE   LYS 103          1HE       LYS 103  -6.804  18.998 -11.007
  773   1HZ   LYS 103          1HZ       LYS 103  -4.617  18.899 -10.609
  774   2HZ   LYS 103          2HZ       LYS 103  -4.464  18.833 -12.299
  775   3HZ   LYS 103          3HZ       LYS 103  -4.424  17.403 -11.384
  776    H    LEU 104           H        LEU 104  -5.596  11.925 -10.852
  777    HA   LEU 104           HA       LEU 104  -7.427  10.157 -12.074
  778   1HB   LEU 104          2HB       LEU 104  -5.133   9.527 -10.189
  779   2HB   LEU 104          1HB       LEU 104  -5.946   8.343 -11.215
  780    HG   LEU 104           HG       LEU 104  -4.524  10.828 -12.218
  781   1HD1  LEU 104          1HD1      LEU 104  -3.689   7.943 -12.569
  782   2HD1  LEU 104          2HD1      LEU 104  -3.096   8.938 -11.239
  783   3HD1  LEU 104          3HD1      LEU 104  -2.747   9.396 -12.906
  784   1HD2  LEU 104          1HD2      LEU 104  -6.222   8.721 -13.463
  785   2HD2  LEU 104          2HD2      LEU 104  -4.789   9.216 -14.363
  786   3HD2  LEU 104          3HD2      LEU 104  -6.011  10.410 -13.924
  787    H    VAL 105           H        VAL 105  -7.199  11.210  -8.775
  788    HA   VAL 105           HA       VAL 105  -8.673   8.991  -7.620
  789    HB   VAL 105           HB       VAL 105  -7.862  11.734  -6.696
  790   1HG1  VAL 105          1HG1      VAL 105  -9.871   9.883  -5.390
  791   2HG1  VAL 105          2HG1      VAL 105 -10.093  11.579  -5.821
  792   3HG1  VAL 105          3HG1      VAL 105  -9.005  11.138  -4.505
  793   1HG2  VAL 105          1HG2      VAL 105  -6.205  10.013  -6.451
  794   2HG2  VAL 105          2HG2      VAL 105  -7.389   8.880  -5.797
  795   3HG2  VAL 105          3HG2      VAL 105  -6.889  10.280  -4.847
  796    H    ASN 106           H        ASN 106  -9.573  12.368  -8.417
  797    HA   ASN 106           HA       ASN 106 -12.352  12.045  -7.833
  798   1HB   ASN 106          2HB       ASN 106 -10.724  13.993  -9.425
  799   2HB   ASN 106          1HB       ASN 106 -12.478  14.010  -9.611
  800   1HD2  ASN 106          1HD2      ASN 106  -9.841  14.706  -7.387
  801   2HD2  ASN 106          2HD2      ASN 106 -10.803  15.395  -6.168
  802    H    LEU 107           H        LEU 107 -10.492  11.595 -10.828
  803    HA   LEU 107           HA       LEU 107 -12.758  11.091 -12.517
  804   1HB   LEU 107          2HB       LEU 107 -10.505  11.616 -13.400
  805   2HB   LEU 107          1HB       LEU 107  -9.911  10.076 -12.779
  806    HG   LEU 107           HG       LEU 107 -11.835   9.023 -14.176
  807   1HD1  LEU 107          1HD1      LEU 107 -12.335  11.736 -14.671
  808   2HD1  LEU 107          2HD1      LEU 107 -13.051  10.365 -15.519
  809   3HD1  LEU 107          3HD1      LEU 107 -11.599  11.138 -16.158
  810   1HD2  LEU 107          1HD2      LEU 107  -9.337   8.951 -14.643
  811   2HD2  LEU 107          2HD2      LEU 107  -9.574  10.344 -15.699
  812   3HD2  LEU 107          3HD2      LEU 107 -10.365   8.812 -16.069
  813    H    ALA 108           H        ALA 108 -10.451   8.795 -11.015
  814    HA   ALA 108           HA       ALA 108 -11.598   6.388 -11.739
  815   1HB   ALA 108          1HB       ALA 108  -9.777   5.984 -10.406
  816   2HB   ALA 108          2HB       ALA 108 -11.014   5.809  -9.162
  817   3HB   ALA 108          3HB       ALA 108 -10.141   7.332  -9.327
  818    H    GLU 109           H        GLU 109 -12.541   8.248  -8.821
  819    HA   GLU 109           HA       GLU 109 -14.801   6.567  -8.240
  820   1HB   GLU 109          2HB       GLU 109 -14.331   9.455  -7.440
  821   2HB   GLU 109          1HB       GLU 109 -15.456   8.333  -6.674
  822   1HG   GLU 109          2HG       GLU 109 -12.435   8.124  -6.752
  823   2HG   GLU 109          1HG       GLU 109 -13.453   8.366  -5.331
  824    H    LYS 110           H        LYS 110 -14.351   9.355 -10.321
  825    HA   LYS 110           HA       LYS 110 -17.053  10.158 -10.636
  826   1HB   LYS 110          2HB       LYS 110 -14.970  11.293 -11.581
  827   2HB   LYS 110          1HB       LYS 110 -15.015  10.091 -12.873
  828   1HG   LYS 110          2HG       LYS 110 -17.535  10.839 -13.078
  829   2HG   LYS 110          1HG       LYS 110 -16.957  12.300 -12.276
  830   1HD   LYS 110          2HD       LYS 110 -15.329  12.697 -14.013
  831   2HD   LYS 110          1HD       LYS 110 -15.670  11.135 -14.758
  832   1HE   LYS 110          2HE       LYS 110 -18.171  12.333 -14.623
  833   2HE   LYS 110          1HE       LYS 110 -17.100  13.674 -15.030
  834   1HZ   LYS 110          1HZ       LYS 110 -17.916  11.455 -16.632
  835   2HZ   LYS 110          2HZ       LYS 110 -16.225  11.609 -16.584
  836   3HZ   LYS 110          3HZ       LYS 110 -17.185  12.911 -17.100
  837    H    PHE 111           H        PHE 111 -15.271   7.454 -12.033
  838    HA   PHE 111           HA       PHE 111 -17.673   6.716 -13.631
  839   1HB   PHE 111          2HB       PHE 111 -14.764   6.015 -13.758
  840   2HB   PHE 111          1HB       PHE 111 -15.937   4.860 -14.390
  841    HD1  PHE 111           HD1      PHE 111 -17.697   5.732 -16.060
  842    HD2  PHE 111           HD2      PHE 111 -14.129   7.894 -15.036
  843    HE1  PHE 111           HE1      PHE 111 -17.927   7.089 -18.123
  844    HE2  PHE 111           HE2      PHE 111 -14.360   9.251 -17.100
  845    HZ   PHE 111           HZ       PHE 111 -16.260   8.848 -18.643
  846    H    ASP 112           H        ASP 112 -15.241   4.689 -11.971
  847    HA   ASP 112           HA       ASP 112 -16.750   3.729  -9.841
  848   1HB   ASP 112          2HB       ASP 112 -17.742   2.760 -12.433
  849   2HB   ASP 112          1HB       ASP 112 -17.385   1.467 -11.287
  850    H    ILE 113           H        ILE 113 -13.998   4.017 -10.849
  851    HA   ILE 113           HA       ILE 113 -13.070   1.193 -10.495
  852    HB   ILE 113           HB       ILE 113 -10.997   1.916 -11.677
  853   1HG1  ILE 113          2HG1      ILE 113 -12.571   4.465 -12.169
  854   2HG1  ILE 113          1HG1      ILE 113 -11.192   4.330 -11.079
  855   1HG2  ILE 113          1HG2      ILE 113 -12.969   2.750 -13.662
  856   2HG2  ILE 113          2HG2      ILE 113 -13.508   1.341 -12.749
  857   3HG2  ILE 113          3HG2      ILE 113 -11.973   1.296 -13.617
  858   1HD1  ILE 113          1HD1      ILE 113 -10.471   3.202 -13.619
  859   2HD1  ILE 113          2HD1      ILE 113  -9.773   4.601 -12.803
  860   3HD1  ILE 113          3HD1      ILE 113 -11.152   4.807 -13.883
  861    H    ILE 114           H        ILE 114 -10.885   1.077  -9.364
  862    HA   ILE 114           HA       ILE 114 -10.790   3.151  -7.211
  863    HB   ILE 114           HB       ILE 114 -11.246   1.151  -6.092
  864   1HG1  ILE 114          2HG1      ILE 114  -8.222   1.042  -6.302
  865   2HG1  ILE 114          1HG1      ILE 114  -9.082   2.243  -5.338
  866   1HG2  ILE 114          1HG2      ILE 114 -11.257  -0.592  -7.582
  867   2HG2  ILE 114          2HG2      ILE 114  -9.675  -0.910  -6.871
  868   3HG2  ILE 114          3HG2      ILE 114  -9.795  -0.036  -8.398
  869   1HD1  ILE 114          1HD1      ILE 114  -8.486  -0.520  -4.702
  870   2HD1  ILE 114          2HD1      ILE 114 -10.225  -0.228  -4.635
  871   3HD1  ILE 114          3HD1      ILE 114  -9.128   0.748  -3.656
  872    H    TYR 115           H        TYR 115  -8.867   4.212  -6.865
  873    HA   TYR 115           HA       TYR 115  -6.619   3.521  -8.698
  874   1HB   TYR 115          2HB       TYR 115  -6.918   5.764  -9.095
  875   2HB   TYR 115          1HB       TYR 115  -7.661   6.047  -7.521
  876    HD1  TYR 115           HD1      TYR 115  -6.397   6.912  -5.720
  877    HD2  TYR 115           HD2      TYR 115  -4.386   5.363  -9.186
  878    HE1  TYR 115           HE1      TYR 115  -4.238   7.769  -4.850
  879    HE2  TYR 115           HE2      TYR 115  -2.227   6.219  -8.316
  880    HH   TYR 115           HH       TYR 115  -1.223   7.390  -6.718
  881    H    ASP 116           H        ASP 116  -5.226   2.149  -7.658
  882    HA   ASP 116           HA       ASP 116  -4.117   3.031  -5.064
  883   1HB   ASP 116          2HB       ASP 116  -5.747   1.635  -4.136
  884   2HB   ASP 116          1HB       ASP 116  -5.684   0.501  -5.486
  885    H    GLY 117           H        GLY 117  -2.236   3.354  -6.496
  886   1HA   GLY 117          2HA       GLY 117  -0.235   1.471  -6.343
  887   2HA   GLY 117          1HA       GLY 117  -1.072   1.030  -7.831
  888    H    TRP 118           H        TRP 118   0.837   3.541  -6.262
  889    HA   TRP 118           HA       TRP 118   1.369   4.673  -8.977
  890   1HB   TRP 118          2HB       TRP 118   1.020   6.832  -8.279
  891   2HB   TRP 118          1HB       TRP 118  -0.053   6.040  -7.129
  892    HD1  TRP 118           HD1      TRP 118   0.849   5.703  -4.626
  893    HE1  TRP 118           HE1      TRP 118   2.654   6.967  -3.287
  894    HE3  TRP 118           HE3      TRP 118   3.277   8.080  -8.441
  895    HZ2  TRP 118           HZ2      TRP 118   4.840   8.748  -3.770
  896    HZ3  TRP 118           HZ3      TRP 118   5.215   9.552  -7.972
  897    HH2  TRP 118           HH2      TRP 118   5.998   9.889  -5.644
  898    H    GLY 119           H        GLY 119   3.544   5.007  -9.426
  899   1HA   GLY 119          2HA       GLY 119   5.506   5.014  -7.227
  900   2HA   GLY 119          1HA       GLY 119   5.599   3.630  -8.317
  901    H    THR 120           H        THR 120   7.751   5.378  -8.122
  902    HA   THR 120           HA       THR 120   7.608   6.833 -10.733
  903    HB   THR 120           HB       THR 120   7.864   8.385  -8.829
  904    HG1  THR 120           HG1      THR 120  10.421   8.474  -9.768
  905   1HG2  THR 120          1HG2      THR 120   9.675   6.313  -7.940
  906   2HG2  THR 120          2HG2      THR 120   9.027   7.682  -7.037
  907   3HG2  THR 120          3HG2      THR 120  10.502   7.870  -7.984
  908    H    TYR 121           H        TYR 121   9.660   6.842 -11.947
  909    HA   TYR 121           HA       TYR 121  11.089   4.270 -11.604
  910   1HB   TYR 121          2HB       TYR 121  10.225   5.746 -13.837
  911   2HB   TYR 121          1HB       TYR 121  11.982   5.894 -13.841
  912    HD1  TYR 121           HD1      TYR 121   9.154   3.672 -14.350
  913    HD2  TYR 121           HD2      TYR 121  13.408   3.822 -13.781
  914    HE1  TYR 121           HE1      TYR 121   9.350   1.356 -15.214
  915    HE2  TYR 121           HE2      TYR 121  13.604   1.505 -14.644
  916    HH   TYR 121           HH       TYR 121  12.437  -0.082 -15.927
  917    H    TYR 122           H        TYR 122  13.137   4.181 -10.790
  918    HA   TYR 122           HA       TYR 122  14.393   6.549  -9.719
  919   1HB   TYR 122          2HB       TYR 122  14.631   3.872  -9.227
  920   2HB   TYR 122          1HB       TYR 122  16.096   4.171 -10.161
  921    HD1  TYR 122           HD1      TYR 122  14.704   4.239  -6.928
  922    HD2  TYR 122           HD2      TYR 122  17.393   6.405  -9.483
  923    HE1  TYR 122           HE1      TYR 122  15.764   5.270  -4.938
  924    HE2  TYR 122           HE2      TYR 122  18.454   7.437  -7.493
  925    HH   TYR 122           HH       TYR 122  18.679   7.196  -5.201
  926    H    GLU 123           H        GLU 123  15.556   8.012 -10.867
  927    HA   GLU 123           HA       GLU 123  16.371   7.423 -13.615
  928   1HB   GLU 123          2HB       GLU 123  16.696   9.847 -11.827
  929   2HB   GLU 123          1HB       GLU 123  17.331   9.777 -13.472
  930   1HG   GLU 123          2HG       GLU 123  14.527   8.916 -13.243
  931   2HG   GLU 123          1HG       GLU 123  14.794  10.606 -12.814
  932    H    GLY 124           H        GLY 124  17.803   5.582 -12.766
  933   1HA   GLY 124          2HA       GLY 124  20.535   6.243 -13.027
  934   2HA   GLY 124          1HA       GLY 124  20.198   6.154 -11.297
  935    H    LEU 125           H        LEU 125  19.562   4.263 -14.272
  936    HA   LEU 125           HA       LEU 125  20.280   1.821 -12.710
  937   1HB   LEU 125          2HB       LEU 125  18.014   1.977 -14.719
  938   2HB   LEU 125          1HB       LEU 125  18.445   0.595 -13.710
  939    HG   LEU 125           HG       LEU 125  17.681   3.274 -12.537
  940   1HD1  LEU 125          1HD1      LEU 125  15.960   0.953 -13.402
  941   2HD1  LEU 125          2HD1      LEU 125  15.710   2.676 -13.688
  942   3HD1  LEU 125          3HD1      LEU 125  15.465   2.004 -12.075
  943   1HD2  LEU 125          1HD2      LEU 125  17.097   1.672 -10.607
  944   2HD2  LEU 125          2HD2      LEU 125  18.811   1.914 -10.946
  945   3HD2  LEU 125          3HD2      LEU 125  17.999   0.451 -11.504
  946    H    GLU 126           H        GLU 126  22.368   2.232 -13.864
  947    HA   GLU 126           HA       GLU 126  22.231   1.231 -16.681
  948   1HB   GLU 126          2HB       GLU 126  23.980   3.344 -15.425
  949   2HB   GLU 126          1HB       GLU 126  24.493   2.493 -16.883
  950   1HG   GLU 126          2HG       GLU 126  21.845   3.943 -16.600
  951   2HG   GLU 126          1HG       GLU 126  23.277   4.632 -17.367
  952    H    HIS 127           H        HIS 127  24.492   0.239 -17.288
  953    HA   HIS 127           HA       HIS 127  24.976  -1.944 -15.480
  954   1HB   HIS 127          2HB       HIS 127  27.083  -2.190 -17.037
  955   2HB   HIS 127          1HB       HIS 127  25.473  -2.488 -17.692
  956    HD2  HIS 127           HD2      HIS 127  26.119  -1.504 -20.277
  957    HE1  HIS 127           HE1      HIS 127  26.973   2.448 -19.053
  958    HE2  HIS 127           HE2      HIS 127  26.619   0.934 -21.059
  959    H    HIS 128           H        HIS 128  25.557  -0.980 -13.460
  960    HA   HIS 128           HA       HIS 128  27.003   0.027 -11.897
  961   1HB   HIS 128          2HB       HIS 128  28.875  -1.380 -13.809
  962   2HB   HIS 128          1HB       HIS 128  29.454  -0.578 -12.349
  963    HD2  HIS 128           HD2      HIS 128  28.936  -4.052 -13.025
  964    HE1  HIS 128           HE1      HIS 128  26.796  -3.621  -9.409
  965    HE2  HIS 128           HE2      HIS 128  27.838  -5.291 -11.009
  966    H    HIS 129           H        HIS 129  29.197   1.449 -11.867
  967    HA   HIS 129           HA       HIS 129  28.573   3.772 -13.550
  968   1HB   HIS 129          2HB       HIS 129  29.212   3.977 -11.128
  969   2HB   HIS 129          1HB       HIS 129  30.828   3.413 -11.555
  970    HD2  HIS 129           HD2      HIS 129  28.929   5.999 -13.851
  971    HE1  HIS 129           HE1      HIS 129  32.232   7.954 -12.090
  972    HE2  HIS 129           HE2      HIS 129  30.360   8.179 -13.785
  973    H    HIS 130           H        HIS 130  31.842   2.645 -12.767
  974    HA   HIS 130           HA       HIS 130  32.534   1.687 -15.364
  975   1HB   HIS 130          2HB       HIS 130  32.077   4.318 -15.590
  976   2HB   HIS 130          1HB       HIS 130  33.743   4.394 -15.014
  977    HD2  HIS 130           HD2      HIS 130  34.278   1.378 -16.814
  978    HE1  HIS 130           HE1      HIS 130  34.024   4.129 -20.007
  979    HE2  HIS 130           HE2      HIS 130  34.763   1.796 -19.343
  980    H    HIS 131           H        HIS 131  33.131   0.769 -12.856
  981    HA   HIS 131           HA       HIS 131  36.064   0.872 -12.882
  982   1HB   HIS 131          2HB       HIS 131  35.011   2.777 -11.352
  983   2HB   HIS 131          1HB       HIS 131  34.822   1.440 -10.217
  984    HD2  HIS 131           HD2      HIS 131  37.768  -0.027 -11.172
  985    HE1  HIS 131           HE1      HIS 131  39.400   3.530  -9.581
  986    HE2  HIS 131           HE2      HIS 131  39.921   1.149 -10.284
  987    H    HIS 132           HN       HIS 132  33.163  -0.216 -11.105
  988    HA   HIS 132           HA       HIS 132  34.590  -2.763 -10.499
  989   1HB   HIS 132          2HB       HIS 132  32.215  -1.362  -9.296
  990   2HB   HIS 132          1HB       HIS 132  32.429  -3.097  -9.062
  991    HD2  HIS 132           HD2      HIS 132  34.517   0.208  -8.307
  992    HE1  HIS 132           HE1      HIS 132  35.801  -2.862  -5.707
  993    HE2  HIS 132           HE2      HIS 132  36.064  -0.410  -6.299
  Start of MODEL    3
    1   1H    MET   1          1H        MET   1 -18.574 -13.728   9.561
    2   2H    MET   1          2H        MET   1 -19.801 -14.483  10.462
    3   3H    MET   1          3H        MET   1 -18.528 -13.686  11.257
    4    HA   MET   1           HA       MET   1 -20.983 -12.632  10.571
    5   1HB   MET   1          2HB       MET   1 -18.414 -11.214  11.344
    6   2HB   MET   1          1HB       MET   1 -20.051 -10.594  11.560
    7   1HG   MET   1          2HG       MET   1 -20.551 -12.128  13.255
    8   2HG   MET   1          1HG       MET   1 -19.293 -13.253  12.743
    9   1HE   MET   1          1HE       MET   1 -19.787  -9.512  14.138
   10   2HE   MET   1          2HE       MET   1 -19.137  -9.910  15.726
   11   3HE   MET   1          3HE       MET   1 -20.477 -10.847  15.071
   12    H    SER   2           H        SER   2 -21.643 -12.081   8.540
   13    HA   SER   2           HA       SER   2 -19.671 -10.671   6.783
   14   1HB   SER   2          2HB       SER   2 -22.120 -12.209   5.884
   15   2HB   SER   2          1HB       SER   2 -20.832 -11.566   4.868
   16    HG   SER   2           HG       SER   2 -20.398 -13.450   6.942
   17    H    HIS   3           H        HIS   3 -20.417  -8.701   7.998
   18    HA   HIS   3           HA       HIS   3 -23.139  -7.804   7.176
   19   1HB   HIS   3          2HB       HIS   3 -21.239  -6.590   9.207
   20   2HB   HIS   3          1HB       HIS   3 -22.900  -6.081   8.904
   21    HD2  HIS   3           HD2      HIS   3 -24.242  -7.041  11.135
   22    HE1  HIS   3           HE1      HIS   3 -22.694 -10.969  11.095
   23    HE2  HIS   3           HE2      HIS   3 -24.341  -9.407  12.226
   24    H    GLN   4           H        GLN   4 -23.068  -6.736   5.253
   25    HA   GLN   4           HA       GLN   4 -20.887  -5.659   3.922
   26   1HB   GLN   4          2HB       GLN   4 -23.048  -5.748   2.840
   27   2HB   GLN   4          1HB       GLN   4 -23.734  -4.622   4.013
   28   1HG   GLN   4          2HG       GLN   4 -22.264  -2.841   3.221
   29   2HG   GLN   4          1HG       GLN   4 -21.468  -3.958   2.110
   30   1HE2  GLN   4          1HE2      GLN   4 -24.516  -5.065   1.962
   31   2HE2  GLN   4          2HE2      GLN   4 -25.151  -4.092   0.723
   32    H    ASP   5           H        ASP   5 -19.686  -3.768   4.057
   33    HA   ASP   5           HA       ASP   5 -20.563  -1.648   5.929
   34   1HB   ASP   5          2HB       ASP   5 -18.674  -3.614   6.682
   35   2HB   ASP   5          1HB       ASP   5 -17.748  -2.152   6.343
   36    H    ASP   6           H        ASP   6 -19.662   0.391   5.403
   37    HA   ASP   6           HA       ASP   6 -17.940   0.415   2.956
   38   1HB   ASP   6          2HB       ASP   6 -20.199   2.304   3.690
   39   2HB   ASP   6          1HB       ASP   6 -19.122   2.513   2.309
   40    H    TYR   7           H        TYR   7 -15.958   1.077   3.665
   41    HA   TYR   7           HA       TYR   7 -15.880   3.492   5.423
   42   1HB   TYR   7          2HB       TYR   7 -14.765   0.830   5.904
   43   2HB   TYR   7          1HB       TYR   7 -13.537   2.092   5.991
   44    HD1  TYR   7           HD1      TYR   7 -13.609   3.814   7.698
   45    HD2  TYR   7           HD2      TYR   7 -16.717   0.864   7.413
   46    HE1  TYR   7           HE1      TYR   7 -14.453   4.489   9.930
   47    HE2  TYR   7           HE2      TYR   7 -17.561   1.539   9.646
   48    HH   TYR   7           HH       TYR   7 -16.748   2.637  11.664
   49    H    LEU   8           H        LEU   8 -15.774   4.120   2.907
   50    HA   LEU   8           HA       LEU   8 -12.872   4.248   2.184
   51   1HB   LEU   8          2HB       LEU   8 -14.137   2.965   0.527
   52   2HB   LEU   8          1HB       LEU   8 -15.303   4.281   0.370
   53    HG   LEU   8           HG       LEU   8 -12.564   5.216   0.009
   54   1HD1  LEU   8          1HD1      LEU   8 -12.526   4.102  -2.358
   55   2HD1  LEU   8          2HD1      LEU   8 -13.572   2.891  -1.616
   56   3HD1  LEU   8          3HD1      LEU   8 -11.954   3.175  -0.972
   57   1HD2  LEU   8          1HD2      LEU   8 -15.057   5.206  -1.724
   58   2HD2  LEU   8          2HD2      LEU   8 -13.597   6.132  -2.072
   59   3HD2  LEU   8          3HD2      LEU   8 -14.551   6.497  -0.635
   60    H    SER   9           H        SER   9 -12.200   6.249   2.834
   61    HA   SER   9           HA       SER   9 -14.037   8.556   2.371
   62   1HB   SER   9          2HB       SER   9 -11.523   8.591   4.043
   63   2HB   SER   9          1HB       SER   9 -12.879   9.713   4.093
   64    HG   SER   9           HG       SER   9 -12.617   7.139   5.140
   65    H    VAL  10           H        VAL  10 -13.359  10.275   1.093
   66    HA   VAL  10           HA       VAL  10 -11.117   9.735  -0.718
   67    HB   VAL  10           HB       VAL  10 -12.787  12.255  -0.582
   68   1HG1  VAL  10          1HG1      VAL  10 -12.334  11.928  -3.156
   69   2HG1  VAL  10          2HG1      VAL  10 -11.008  10.910  -2.593
   70   3HG1  VAL  10          3HG1      VAL  10 -11.075  12.609  -2.126
   71   1HG2  VAL  10          1HG2      VAL  10 -14.217  11.068  -2.317
   72   2HG2  VAL  10          2HG2      VAL  10 -14.379  10.453  -0.672
   73   3HG2  VAL  10          3HG2      VAL  10 -13.406   9.573  -1.849
   74    H    GLU  11           H        GLU  11 -11.659  11.528   2.187
   75    HA   GLU  11           HA       GLU  11  -9.426  13.377   1.764
   76   1HB   GLU  11          2HB       GLU  11 -11.551  13.751   3.218
   77   2HB   GLU  11          1HB       GLU  11 -10.706  12.790   4.431
   78   1HG   GLU  11          2HG       GLU  11  -9.298  15.097   3.109
   79   2HG   GLU  11          1HG       GLU  11 -10.416  15.395   4.440
   80    H    GLU  12           H        GLU  12 -10.043  10.573   3.908
   81    HA   GLU  12           HA       GLU  12  -7.525  10.475   5.159
   82   1HB   GLU  12          2HB       GLU  12  -8.082   8.312   5.831
   83   2HB   GLU  12          1HB       GLU  12  -9.673   8.969   5.445
   84   1HG   GLU  12          2HG       GLU  12  -9.430   8.012   3.131
   85   2HG   GLU  12          1HG       GLU  12  -7.947   7.221   3.668
   86    H    LEU  13           H        LEU  13  -8.516   8.957   2.075
   87    HA   LEU  13           HA       LEU  13  -6.036   7.713   1.483
   88   1HB   LEU  13          2HB       LEU  13  -8.082   8.917  -0.408
   89   2HB   LEU  13          1HB       LEU  13  -6.780   7.831  -0.893
   90    HG   LEU  13           HG       LEU  13  -8.852   7.111   1.193
   91   1HD1  LEU  13          1HD1      LEU  13  -8.777   6.173  -1.683
   92   2HD1  LEU  13          2HD1      LEU  13  -9.765   7.538  -1.161
   93   3HD1  LEU  13          3HD1      LEU  13 -10.061   5.931  -0.497
   94   1HD2  LEU  13          1HD2      LEU  13  -7.896   4.800   0.082
   95   2HD2  LEU  13          2HD2      LEU  13  -7.247   5.530   1.551
   96   3HD2  LEU  13          3HD2      LEU  13  -6.468   5.832  -0.002
   97    H    ILE  14           H        ILE  14  -7.200  10.990   0.701
   98    HA   ILE  14           HA       ILE  14  -4.874  11.796  -0.755
   99    HB   ILE  14           HB       ILE  14  -6.960  13.348   0.791
  100   1HG1  ILE  14          2HG1      ILE  14  -6.399  13.241  -2.182
  101   2HG1  ILE  14          1HG1      ILE  14  -7.500  12.118  -1.384
  102   1HG2  ILE  14          1HG2      ILE  14  -4.393  14.227  -0.392
  103   2HG2  ILE  14          2HG2      ILE  14  -5.385  14.998   0.846
  104   3HG2  ILE  14          3HG2      ILE  14  -5.800  15.182  -0.858
  105   1HD1  ILE  14          1HD1      ILE  14  -9.111  13.675  -1.638
  106   2HD1  ILE  14          2HD1      ILE  14  -7.940  14.892  -2.144
  107   3HD1  ILE  14          3HD1      ILE  14  -8.260  14.635  -0.429
  108    H    GLU  15           H        GLU  15  -5.686  11.927   2.698
  109    HA   GLU  15           HA       GLU  15  -3.403  13.452   3.512
  110   1HB   GLU  15          2HB       GLU  15  -5.569  12.705   4.829
  111   2HB   GLU  15          1HB       GLU  15  -4.564  11.328   5.283
  112   1HG   GLU  15          2HG       GLU  15  -3.736  14.225   5.623
  113   2HG   GLU  15          1HG       GLU  15  -4.423  13.232   6.909
  114    H    ILE  16           H        ILE  16  -3.907   9.940   4.050
  115    HA   ILE  16           HA       ILE  16  -1.349   9.199   4.745
  116    HB   ILE  16           HB       ILE  16  -3.294   7.775   2.917
  117   1HG1  ILE  16          2HG1      ILE  16  -2.524   6.823   5.634
  118   2HG1  ILE  16          1HG1      ILE  16  -3.509   8.285   5.554
  119   1HG2  ILE  16          1HG2      ILE  16  -1.877   5.736   3.474
  120   2HG2  ILE  16          2HG2      ILE  16  -0.638   6.854   4.044
  121   3HG2  ILE  16          3HG2      ILE  16  -1.138   6.878   2.353
  122   1HD1  ILE  16          1HD1      ILE  16  -5.201   7.137   4.244
  123   2HD1  ILE  16          2HD1      ILE  16  -4.870   6.184   5.690
  124   3HD1  ILE  16          3HD1      ILE  16  -4.192   5.694   4.136
  125    H    GLN  17           H        GLN  17  -2.419   8.963   1.327
  126    HA   GLN  17           HA       GLN  17   0.058   8.628   0.129
  127   1HB   GLN  17          2HB       GLN  17  -2.526   9.737  -0.706
  128   2HB   GLN  17          1HB       GLN  17  -1.165  10.426  -1.592
  129   1HG   GLN  17          2HG       GLN  17  -0.356   8.156  -2.125
  130   2HG   GLN  17          1HG       GLN  17  -1.720   7.465  -1.245
  131   1HE2  GLN  17          1HE2      GLN  17  -3.849   9.073  -2.082
  132   2HE2  GLN  17          2HE2      GLN  17  -4.058   8.926  -3.760
  133    H    LYS  18           H        LYS  18  -1.275  11.570   1.517
  134    HA   LYS  18           HA       LYS  18   0.539  13.465   0.434
  135   1HB   LYS  18          2HB       LYS  18  -1.545  13.714   2.067
  136   2HB   LYS  18          1HB       LYS  18  -0.292  13.672   3.308
  137   1HG   LYS  18          2HG       LYS  18   0.848  15.560   2.312
  138   2HG   LYS  18          1HG       LYS  18  -0.234  15.536   0.919
  139   1HD   LYS  18          2HD       LYS  18  -1.750  15.667   3.388
  140   2HD   LYS  18          1HD       LYS  18  -0.589  16.992   3.299
  141   1HE   LYS  18          2HE       LYS  18  -2.365  16.285   0.960
  142   2HE   LYS  18          1HE       LYS  18  -2.897  17.392   2.227
  143   1HZ   LYS  18          1HZ       LYS  18  -0.286  18.068   1.400
  144   2HZ   LYS  18          2HZ       LYS  18  -1.703  19.003   1.327
  145   3HZ   LYS  18          3HZ       LYS  18  -1.294  17.971   0.040
  146    H    GLU  19           H        GLU  19   0.769  11.659   3.518
  147    HA   GLU  19           HA       GLU  19   3.505  12.517   3.981
  148   1HB   GLU  19          2HB       GLU  19   2.348  10.050   5.243
  149   2HB   GLU  19          1HB       GLU  19   3.389  11.283   5.956
  150   1HG   GLU  19          2HG       GLU  19   0.482  11.668   5.179
  151   2HG   GLU  19          1HG       GLU  19   1.087  11.473   6.823
  152    H    GLU  20           H        GLU  20   2.156   9.260   3.314
  153    HA   GLU  20           HA       GLU  20   4.410   7.787   2.863
  154   1HB   GLU  20          2HB       GLU  20   1.708   7.672   1.938
  155   2HB   GLU  20          1HB       GLU  20   2.762   7.313   0.569
  156   1HG   GLU  20          2HG       GLU  20   3.931   5.605   1.902
  157   2HG   GLU  20          1HG       GLU  20   2.898   5.971   3.285
  158    H    THR  21           H        THR  21   2.936   9.833   0.311
  159    HA   THR  21           HA       THR  21   4.949   9.517  -1.630
  160    HB   THR  21           HB       THR  21   3.536  12.139  -1.089
  161    HG1  THR  21           HG1      THR  21   1.746  11.185  -1.563
  162   1HG2  THR  21          1HG2      THR  21   5.293  11.217  -3.112
  163   2HG2  THR  21          2HG2      THR  21   4.381  12.726  -3.086
  164   3HG2  THR  21          3HG2      THR  21   3.684  11.289  -3.834
  165    H    ARG  22           H        ARG  22   4.700  12.250   0.686
  166    HA   ARG  22           HA       ARG  22   7.132  13.488   0.200
  167   1HB   ARG  22          2HB       ARG  22   5.412  14.184   1.913
  168   2HB   ARG  22          1HB       ARG  22   6.067  12.945   2.985
  169   1HG   ARG  22          2HG       ARG  22   8.348  14.256   2.194
  170   2HG   ARG  22          1HG       ARG  22   7.179  15.576   2.258
  171   1HD   ARG  22          2HD       ARG  22   8.213  15.339   4.451
  172   2HD   ARG  22          1HD       ARG  22   6.529  14.827   4.556
  173    HE   ARG  22           HE       ARG  22   7.888  12.479   4.024
  174   1HH1  ARG  22          1HH2      ARG  22   8.148  15.043   6.315
  175   2HH1  ARG  22          2HH2      ARG  22   8.769  14.031   7.576
  176   1HH2  ARG  22          2HH1      ARG  22   8.700  11.143   5.656
  177   2HH2  ARG  22          1HH1      ARG  22   9.083  11.823   7.203
  178    H    ASP  23           H        ASP  23   6.584  10.561   2.146
  179    HA   ASP  23           HA       ASP  23   9.196  10.230   3.171
  180   1HB   ASP  23          2HB       ASP  23   6.890   8.785   3.307
  181   2HB   ASP  23          1HB       ASP  23   7.854   7.759   2.243
  182    H    ILE  24           H        ILE  24   7.843   9.004   0.092
  183    HA   ILE  24           HA       ILE  24  10.292   7.810  -0.806
  184    HB   ILE  24           HB       ILE  24   7.997   8.917  -2.454
  185   1HG1  ILE  24          2HG1      ILE  24   8.480   6.084  -1.487
  186   2HG1  ILE  24          1HG1      ILE  24   7.388   7.216  -0.687
  187   1HG2  ILE  24          1HG2      ILE  24  10.519   7.792  -3.192
  188   2HG2  ILE  24          2HG2      ILE  24   9.180   8.244  -4.245
  189   3HG2  ILE  24          3HG2      ILE  24   9.267   6.613  -3.581
  190   1HD1  ILE  24          1HD1      ILE  24   6.620   5.517  -2.682
  191   2HD1  ILE  24          2HD1      ILE  24   7.001   6.970  -3.608
  192   3HD1  ILE  24          3HD1      ILE  24   5.803   7.037  -2.314
  193    H    ILE  25           H        ILE  25   8.757  10.745  -2.171
  194    HA   ILE  25           HA       ILE  25  10.794  11.783  -3.656
  195    HB   ILE  25           HB       ILE  25   9.424  13.591  -1.670
  196   1HG1  ILE  25          2HG1      ILE  25   7.645  12.148  -2.373
  197   2HG1  ILE  25          1HG1      ILE  25   7.515  13.601  -3.365
  198   1HG2  ILE  25          1HG2      ILE  25   9.251  14.928  -3.893
  199   2HG2  ILE  25          2HG2      ILE  25  10.449  13.785  -4.499
  200   3HG2  ILE  25          3HG2      ILE  25  10.830  14.810  -3.116
  201   1HD1  ILE  25          1HD1      ILE  25   7.288  11.674  -4.818
  202   2HD1  ILE  25          2HD1      ILE  25   8.763  10.958  -4.169
  203   3HD1  ILE  25          3HD1      ILE  25   8.850  12.427  -5.142
  204    H    GLN  26           H        GLN  26  10.722  11.617  -0.141
  205    HA   GLN  26           HA       GLN  26  13.035  13.315   0.263
  206   1HB   GLN  26          2HB       GLN  26  11.651  11.259   2.001
  207   2HB   GLN  26          1HB       GLN  26  13.042  12.195   2.550
  208   1HG   GLN  26          2HG       GLN  26  10.978  13.857   1.300
  209   2HG   GLN  26          1HG       GLN  26  10.396  12.998   2.727
  210   1HE2  GLN  26          1HE2      GLN  26  10.378  15.403   3.536
  211   2HE2  GLN  26          2HE2      GLN  26  11.805  15.960   4.267
  212    H    ALA  27           H        ALA  27  12.562   9.777   0.142
  213    HA   ALA  27           HA       ALA  27  15.361   9.186   0.557
  214   1HB   ALA  27          1HB       ALA  27  13.137   7.516  -0.655
  215   2HB   ALA  27          2HB       ALA  27  13.646   7.510   1.034
  216   3HB   ALA  27          3HB       ALA  27  14.731   6.901  -0.216
  217    H    LEU  28           H        LEU  28  13.351   9.739  -2.296
  218    HA   LEU  28           HA       LEU  28  15.319   8.840  -4.208
  219   1HB   LEU  28          2HB       LEU  28  12.665   9.697  -4.313
  220   2HB   LEU  28          1HB       LEU  28  13.553  10.945  -5.189
  221    HG   LEU  28           HG       LEU  28  13.892   7.978  -5.702
  222   1HD1  LEU  28          1HD1      LEU  28  12.179   8.019  -7.201
  223   2HD1  LEU  28          2HD1      LEU  28  12.550   9.662  -7.724
  224   3HD1  LEU  28          3HD1      LEU  28  11.612   9.395  -6.254
  225   1HD2  LEU  28          1HD2      LEU  28  14.644  10.405  -7.363
  226   2HD2  LEU  28          2HD2      LEU  28  15.046   8.723  -7.710
  227   3HD2  LEU  28          3HD2      LEU  28  15.769   9.534  -6.320
  228    H    LEU  29           H        LEU  29  14.301  12.145  -3.261
  229    HA   LEU  29           HA       LEU  29  16.278  13.550  -4.690
  230   1HB   LEU  29          2HB       LEU  29  14.345  14.151  -2.682
  231   2HB   LEU  29          1HB       LEU  29  15.884  14.830  -2.149
  232    HG   LEU  29           HG       LEU  29  14.666  15.254  -4.894
  233   1HD1  LEU  29          1HD1      LEU  29  14.119  17.483  -4.144
  234   2HD1  LEU  29          2HD1      LEU  29  14.934  17.220  -2.602
  235   3HD1  LEU  29          3HD1      LEU  29  13.444  16.351  -2.973
  236   1HD2  LEU  29          1HD2      LEU  29  17.308  15.414  -4.120
  237   2HD2  LEU  29          2HD2      LEU  29  16.750  17.070  -3.882
  238   3HD2  LEU  29          3HD2      LEU  29  16.598  16.307  -5.465
  239    H    GLU  30           H        GLU  30  16.422  12.536  -1.251
  240    HA   GLU  30           HA       GLU  30  19.024  13.315  -0.654
  241   1HB   GLU  30          2HB       GLU  30  17.452  12.180   0.936
  242   2HB   GLU  30          1HB       GLU  30  17.797  10.651   0.125
  243   1HG   GLU  30          2HG       GLU  30  20.261  11.101   0.606
  244   2HG   GLU  30          1HG       GLU  30  19.719  12.402   1.669
  245    H    ASP  31           H        ASP  31  17.998  10.353  -2.351
  246    HA   ASP  31           HA       ASP  31  20.498   9.110  -2.651
  247   1HB   ASP  31          2HB       ASP  31  17.908   8.842  -3.789
  248   2HB   ASP  31          1HB       ASP  31  19.050   8.910  -5.130
  249    H    GLY  32           H        GLY  32  19.240  11.982  -4.200
  250   1HA   GLY  32          2HA       GLY  32  20.849  13.614  -5.096
  251   2HA   GLY  32          1HA       GLY  32  21.860  12.262  -5.608
  252    H    SER  33           H        SER  33  18.410  12.112  -6.068
  253    HA   SER  33           HA       SER  33  18.537  11.484  -8.806
  254   1HB   SER  33          2HB       SER  33  16.233  11.553  -8.769
  255   2HB   SER  33          1HB       SER  33  16.531  11.541  -7.033
  256    HG   SER  33           HG       SER  33  15.819  13.518  -6.924
  257    H    ASP  34           H        ASP  34  17.141  13.115 -10.391
  258    HA   ASP  34           HA       ASP  34  18.367  15.826 -10.171
  259   1HB   ASP  34          2HB       ASP  34  18.348  14.114 -12.678
  260   2HB   ASP  34          1HB       ASP  34  18.966  15.763 -12.553
  261    HA   PRO  35           HA       PRO  35  13.843  16.174 -10.924
  262   1HB   PRO  35          2HB       PRO  35  14.337  18.890  -9.875
  263   2HB   PRO  35          1HB       PRO  35  13.193  17.658  -9.316
  264   1HG   PRO  35          2HG       PRO  35  15.410  18.325  -7.942
  265   2HG   PRO  35          1HG       PRO  35  14.703  16.702  -7.905
  266   1HD   PRO  35          2HD       PRO  35  17.141  17.665  -9.341
  267   2HD   PRO  35          1HD       PRO  35  16.805  16.071  -8.628
  268    H    ASP  36           H        ASP  36  16.470  18.374 -11.799
  269    HA   ASP  36           HA       ASP  36  14.970  20.011 -13.614
  270   1HB   ASP  36          2HB       ASP  36  17.596  19.935 -12.687
  271   2HB   ASP  36          1HB       ASP  36  17.747  19.596 -14.411
  272    H    ALA  37           H        ALA  37  15.460  16.759 -13.771
  273    HA   ALA  37           HA       ALA  37  15.599  16.760 -16.758
  274   1HB   ALA  37          1HB       ALA  37  15.843  14.121 -15.925
  275   2HB   ALA  37          2HB       ALA  37  16.723  15.021 -14.689
  276   3HB   ALA  37          3HB       ALA  37  17.175  15.179 -16.387
  277    H    LEU  38           H        LEU  38  13.227  17.201 -14.882
  278    HA   LEU  38           HA       LEU  38  10.977  16.537 -14.782
  279   1HB   LEU  38          2HB       LEU  38  11.900  15.650 -17.498
  280   2HB   LEU  38          1HB       LEU  38  10.292  15.186 -16.942
  281    HG   LEU  38           HG       LEU  38  10.375  17.361 -18.237
  282   1HD1  LEU  38          1HD1      LEU  38   8.897  16.632 -16.001
  283   2HD1  LEU  38          2HD1      LEU  38   8.531  17.977 -17.081
  284   3HD1  LEU  38          3HD1      LEU  38   9.456  18.258 -15.607
  285   1HD2  LEU  38          1HD2      LEU  38  11.659  18.416 -15.703
  286   2HD2  LEU  38          2HD2      LEU  38  11.332  19.306 -17.190
  287   3HD2  LEU  38          3HD2      LEU  38  12.575  18.055 -17.166
  288    H    TYR  39           H        TYR  39   9.547  14.521 -14.709
  289    HA   TYR  39           HA       TYR  39  11.114  12.032 -14.271
  290   1HB   TYR  39          2HB       TYR  39   9.917  13.674 -12.195
  291   2HB   TYR  39          1HB       TYR  39   9.193  12.066 -12.217
  292    HD1  TYR  39           HD1      TYR  39  10.380  10.175 -11.419
  293    HD2  TYR  39           HD2      TYR  39  12.456  13.869 -12.121
  294    HE1  TYR  39           HE1      TYR  39  12.406   9.242 -10.334
  295    HE2  TYR  39           HE2      TYR  39  14.482  12.937 -11.035
  296    HH   TYR  39           HH       TYR  39  14.442  10.132  -9.170
  297    H    GLU  40           H        GLU  40   9.829  10.114 -14.462
  298    HA   GLU  40           HA       GLU  40   7.249  10.579 -15.882
  299   1HB   GLU  40          2HB       GLU  40   7.573   8.352 -16.843
  300   2HB   GLU  40          1HB       GLU  40   9.021   9.325 -17.109
  301   1HG   GLU  40          2HG       GLU  40   9.655   8.235 -14.721
  302   2HG   GLU  40          1HG       GLU  40   8.632   6.950 -15.365
  303    H    ILE  41           H        ILE  41   5.414  10.083 -14.785
  304    HA   ILE  41           HA       ILE  41   5.658   8.465 -12.306
  305    HB   ILE  41           HB       ILE  41   3.081   9.738 -13.126
  306   1HG1  ILE  41          2HG1      ILE  41   4.858  11.418 -13.682
  307   2HG1  ILE  41          1HG1      ILE  41   3.792  11.939 -12.379
  308   1HG2  ILE  41          1HG2      ILE  41   4.586   9.183 -10.576
  309   2HG2  ILE  41          2HG2      ILE  41   2.950   8.706 -11.027
  310   3HG2  ILE  41          3HG2      ILE  41   3.294  10.382 -10.603
  311   1HD1  ILE  41          1HD1      ILE  41   6.527  11.964 -12.235
  312   2HD1  ILE  41          2HD1      ILE  41   6.154  10.418 -11.478
  313   3HD1  ILE  41          3HD1      ILE  41   5.458  11.904 -10.834
  314    H    GLU  42           H        GLU  42   4.596   6.505 -12.070
  315    HA   GLU  42           HA       GLU  42   3.156   5.500 -14.494
  316   1HB   GLU  42          2HB       GLU  42   5.417   4.439 -13.807
  317   2HB   GLU  42          1HB       GLU  42   4.521   3.738 -12.459
  318   1HG   GLU  42          2HG       GLU  42   2.926   3.301 -14.745
  319   2HG   GLU  42          1HG       GLU  42   4.575   2.904 -15.230
  320    H    HIS  43           H        HIS  43   1.000   5.432 -14.062
  321    HA   HIS  43           HA       HIS  43   0.135   4.849 -11.268
  322   1HB   HIS  43          2HB       HIS  43  -1.420   6.002 -13.605
  323   2HB   HIS  43          1HB       HIS  43  -2.050   5.766 -11.973
  324    HD2  HIS  43           HD2      HIS  43  -0.278   8.497 -13.939
  325    HE1  HIS  43           HE1      HIS  43   0.456   9.374  -9.874
  326    HE2  HIS  43           HE2      HIS  43   0.594  10.275 -12.242
  327    H    HIS  44           H        HIS  44  -1.155   3.068 -10.833
  328    HA   HIS  44           HA       HIS  44  -1.732   1.256 -13.146
  329   1HB   HIS  44          2HB       HIS  44  -0.184   0.776 -10.814
  330   2HB   HIS  44          1HB       HIS  44  -1.677  -0.141 -10.621
  331    HD2  HIS  44           HD2      HIS  44  -1.934  -0.795 -13.975
  332    HE1  HIS  44           HE1      HIS  44   1.657  -2.904 -13.265
  333    HE2  HIS  44           HE2      HIS  44  -0.280  -2.601 -14.876
  334    H    LEU  45           H        LEU  45  -3.908   1.327 -13.514
  335    HA   LEU  45           HA       LEU  45  -5.705   1.326 -11.119
  336   1HB   LEU  45          2HB       LEU  45  -6.142   2.668 -13.806
  337   2HB   LEU  45          1HB       LEU  45  -7.343   2.581 -12.517
  338    HG   LEU  45           HG       LEU  45  -5.147   3.551 -11.177
  339   1HD1  LEU  45          1HD1      LEU  45  -5.219   4.907 -13.889
  340   2HD1  LEU  45          2HD1      LEU  45  -3.968   3.770 -13.384
  341   3HD1  LEU  45          3HD1      LEU  45  -4.160   5.304 -12.536
  342   1HD2  LEU  45          1HD2      LEU  45  -7.497   4.368 -11.077
  343   2HD2  LEU  45          2HD2      LEU  45  -7.260   5.178 -12.626
  344   3HD2  LEU  45          3HD2      LEU  45  -6.342   5.694 -11.211
  345    H    PHE  46           H        PHE  46  -7.522  -0.057 -11.244
  346    HA   PHE  46           HA       PHE  46  -7.678  -1.782 -13.677
  347   1HB   PHE  46          2HB       PHE  46  -8.397  -3.500 -11.663
  348   2HB   PHE  46          1HB       PHE  46  -6.790  -3.431 -12.387
  349    HD1  PHE  46           HD1      PHE  46  -8.574  -1.095 -10.063
  350    HD2  PHE  46           HD2      PHE  46  -5.211  -3.694 -10.682
  351    HE1  PHE  46           HE1      PHE  46  -7.623  -0.384  -7.887
  352    HE2  PHE  46           HE2      PHE  46  -4.261  -2.985  -8.506
  353    HZ   PHE  46           HZ       PHE  46  -5.466  -1.328  -7.107
  354    H    ALA  47           H        ALA  47  -9.806  -3.017 -13.713
  355    HA   ALA  47           HA       ALA  47 -11.995  -1.820 -12.152
  356   1HB   ALA  47          1HB       ALA  47 -13.092  -0.726 -13.875
  357   2HB   ALA  47          2HB       ALA  47 -12.345  -1.722 -15.124
  358   3HB   ALA  47          3HB       ALA  47 -11.419  -0.436 -14.348
  359    H    GLU  48           H        GLU  48 -14.151  -2.880 -12.936
  360    HA   GLU  48           HA       GLU  48 -13.549  -5.740 -13.561
  361   1HB   GLU  48          2HB       GLU  48 -15.404  -4.402 -11.695
  362   2HB   GLU  48          1HB       GLU  48 -16.116  -5.735 -12.603
  363   1HG   GLU  48          2HG       GLU  48 -14.652  -7.310 -11.709
  364   2HG   GLU  48          1HG       GLU  48 -13.417  -6.104 -11.347
  365    H    ASP  49           H        ASP  49 -15.411  -2.932 -14.508
  366    HA   ASP  49           HA       ASP  49 -16.755  -4.558 -16.620
  367   1HB   ASP  49          2HB       ASP  49 -17.390  -1.886 -15.362
  368   2HB   ASP  49          1HB       ASP  49 -18.122  -2.383 -16.888
  369    H    PHE  50           H        PHE  50 -15.258  -4.625 -18.290
  370    HA   PHE  50           HA       PHE  50 -13.345  -2.740 -19.009
  371   1HB   PHE  50          2HB       PHE  50 -13.147  -3.881 -21.008
  372   2HB   PHE  50          1HB       PHE  50 -14.083  -5.065 -20.098
  373    HD1  PHE  50           HD1      PHE  50 -16.774  -4.070 -20.059
  374    HD2  PHE  50           HD2      PHE  50 -13.876  -3.841 -23.221
  375    HE1  PHE  50           HE1      PHE  50 -18.603  -3.896 -21.723
  376    HE2  PHE  50           HE2      PHE  50 -15.705  -3.668 -24.886
  377    HZ   PHE  50           HZ       PHE  50 -18.070  -3.695 -24.137
  378    H    ASP  51           H        ASP  51 -16.744  -2.363 -19.094
  379    HA   ASP  51           HA       ASP  51 -16.937  -0.421 -21.215
  380   1HB   ASP  51          2HB       ASP  51 -18.660  -1.419 -19.030
  381   2HB   ASP  51          1HB       ASP  51 -18.976   0.245 -19.519
  382    H    LYS  52           H        LYS  52 -17.114   0.094 -17.670
  383    HA   LYS  52           HA       LYS  52 -16.631   2.917 -17.862
  384   1HB   LYS  52          2HB       LYS  52 -16.463   2.888 -15.481
  385   2HB   LYS  52          1HB       LYS  52 -17.632   1.631 -15.884
  386   1HG   LYS  52          2HG       LYS  52 -15.790  -0.054 -15.788
  387   2HG   LYS  52          1HG       LYS  52 -14.695   1.222 -15.249
  388   1HD   LYS  52          2HD       LYS  52 -15.874   1.533 -13.217
  389   2HD   LYS  52          1HD       LYS  52 -17.283   0.650 -13.801
  390   1HE   LYS  52          2HE       LYS  52 -15.272  -1.229 -14.034
  391   2HE   LYS  52          1HE       LYS  52 -14.820  -0.366 -12.564
  392   1HZ   LYS  52          1HZ       LYS  52 -16.313  -2.186 -12.067
  393   2HZ   LYS  52          2HZ       LYS  52 -17.478  -1.561 -13.134
  394   3HZ   LYS  52          3HZ       LYS  52 -17.066  -0.705 -11.726
  395    H    LEU  53           H        LEU  53 -14.523   0.119 -17.682
  396    HA   LEU  53           HA       LEU  53 -12.108   1.426 -16.916
  397   1HB   LEU  53          2HB       LEU  53 -12.623  -1.113 -17.241
  398   2HB   LEU  53          1HB       LEU  53 -12.165  -0.823 -18.920
  399    HG   LEU  53           HG       LEU  53 -10.403   0.054 -16.631
  400   1HD1  LEU  53          1HD1      LEU  53  -9.300  -2.017 -16.597
  401   2HD1  LEU  53          2HD1      LEU  53  -9.974  -2.509 -18.152
  402   3HD1  LEU  53          3HD1      LEU  53 -10.994  -2.494 -16.712
  403   1HD2  LEU  53          1HD2      LEU  53 -10.081  -0.415 -19.601
  404   2HD2  LEU  53          2HD2      LEU  53  -8.688  -0.316 -18.524
  405   3HD2  LEU  53          3HD2      LEU  53  -9.775   1.064 -18.689
  406    H    GLU  54           H        GLU  54 -13.395   0.707 -20.177
  407    HA   GLU  54           HA       GLU  54 -11.322   2.042 -21.615
  408   1HB   GLU  54          2HB       GLU  54 -13.903   0.852 -22.198
  409   2HB   GLU  54          1HB       GLU  54 -13.697   2.353 -23.100
  410   1HG   GLU  54          2HG       GLU  54 -11.750   1.581 -24.180
  411   2HG   GLU  54          1HG       GLU  54 -11.491   0.302 -22.992
  412    H    LYS  55           H        LYS  55 -14.549   3.206 -20.596
  413    HA   LYS  55           HA       LYS  55 -14.404   5.816 -21.610
  414   1HB   LYS  55          2HB       LYS  55 -16.029   4.409 -19.743
  415   2HB   LYS  55          1HB       LYS  55 -15.554   5.926 -18.979
  416   1HG   LYS  55          2HG       LYS  55 -17.587   6.326 -20.233
  417   2HG   LYS  55          1HG       LYS  55 -16.258   7.121 -21.079
  418   1HD   LYS  55          2HD       LYS  55 -17.050   6.010 -22.901
  419   2HD   LYS  55          1HD       LYS  55 -16.195   4.629 -22.211
  420   1HE   LYS  55          2HE       LYS  55 -19.126   5.321 -21.931
  421   2HE   LYS  55          1HE       LYS  55 -18.420   3.869 -22.640
  422   1HZ   LYS  55          1HZ       LYS  55 -17.973   4.610 -19.812
  423   2HZ   LYS  55          2HZ       LYS  55 -17.733   3.102 -20.557
  424   3HZ   LYS  55          3HZ       LYS  55 -19.309   3.681 -20.294
  425    H    ALA  56           H        ALA  56 -13.459   4.823 -18.291
  426    HA   ALA  56           HA       ALA  56 -12.312   7.286 -17.522
  427   1HB   ALA  56          1HB       ALA  56 -12.405   5.867 -15.715
  428   2HB   ALA  56          2HB       ALA  56 -10.729   5.572 -16.177
  429   3HB   ALA  56          3HB       ALA  56 -11.993   4.447 -16.676
  430    H    ALA  57           H        ALA  57 -10.706   4.460 -19.013
  431    HA   ALA  57           HA       ALA  57  -8.099   5.484 -19.170
  432   1HB   ALA  57          1HB       ALA  57  -8.184   3.300 -19.913
  433   2HB   ALA  57          2HB       ALA  57  -8.164   4.125 -21.472
  434   3HB   ALA  57          3HB       ALA  57  -9.689   3.551 -20.797
  435    H    VAL  58           H        VAL  58 -10.533   5.654 -21.801
  436    HA   VAL  58           HA       VAL  58  -9.216   7.296 -23.587
  437    HB   VAL  58           HB       VAL  58 -12.122   7.478 -22.739
  438   1HG1  VAL  58          1HG1      VAL  58 -12.215   8.337 -25.237
  439   2HG1  VAL  58          2HG1      VAL  58 -10.544   8.803 -24.920
  440   3HG1  VAL  58          3HG1      VAL  58 -11.845   9.461 -23.929
  441   1HG2  VAL  58          1HG2      VAL  58 -12.552   5.814 -24.292
  442   2HG2  VAL  58          2HG2      VAL  58 -10.935   5.328 -23.780
  443   3HG2  VAL  58          3HG2      VAL  58 -11.151   6.232 -25.279
  444    H    GLU  59           H        GLU  59 -11.329   8.586 -20.983
  445    HA   GLU  59           HA       GLU  59 -10.699  11.295 -21.271
  446   1HB   GLU  59          2HB       GLU  59 -11.547   9.579 -18.988
  447   2HB   GLU  59          1HB       GLU  59 -10.889  11.165 -18.584
  448   1HG   GLU  59          2HG       GLU  59 -13.239  11.490 -18.855
  449   2HG   GLU  59          1HG       GLU  59 -12.496  12.125 -20.322
  450    H    ALA  60           H        ALA  60  -8.855   8.774 -19.586
  451    HA   ALA  60           HA       ALA  60  -6.867  10.557 -18.503
  452   1HB   ALA  60          1HB       ALA  60  -6.517   8.600 -17.421
  453   2HB   ALA  60          2HB       ALA  60  -5.595   8.113 -18.843
  454   3HB   ALA  60          3HB       ALA  60  -7.295   7.666 -18.699
  455    H    PHE  61           H        PHE  61  -7.199   8.856 -21.581
  456    HA   PHE  61           HA       PHE  61  -4.503   9.363 -22.483
  457   1HB   PHE  61          2HB       PHE  61  -6.029   7.628 -23.467
  458   2HB   PHE  61          1HB       PHE  61  -6.987   8.933 -24.170
  459    HD1  PHE  61           HD1      PHE  61  -6.525   9.445 -26.389
  460    HD2  PHE  61           HD2      PHE  61  -3.355   8.008 -23.871
  461    HE1  PHE  61           HE1      PHE  61  -4.949   9.576 -28.299
  462    HE2  PHE  61           HE2      PHE  61  -1.778   8.140 -25.782
  463    HZ   PHE  61           HZ       PHE  61  -2.576   8.923 -27.996
  464    H    LYS  62           H        LYS  62  -7.622  10.954 -23.235
  465    HA   LYS  62           HA       LYS  62  -6.441  13.065 -24.783
  466   1HB   LYS  62          2HB       LYS  62  -8.899  12.362 -24.727
  467   2HB   LYS  62          1HB       LYS  62  -9.021  13.267 -23.218
  468   1HG   LYS  62          2HG       LYS  62  -7.888  15.189 -24.617
  469   2HG   LYS  62          1HG       LYS  62  -8.511  14.281 -25.996
  470   1HD   LYS  62          2HD       LYS  62 -10.757  14.269 -24.677
  471   2HD   LYS  62          1HD       LYS  62 -10.041  15.596 -23.762
  472   1HE   LYS  62          2HE       LYS  62 -11.301  16.548 -25.598
  473   2HE   LYS  62          1HE       LYS  62  -9.584  16.764 -25.941
  474   1HZ   LYS  62          1HZ       LYS  62 -10.782  15.939 -27.873
  475   2HZ   LYS  62          2HZ       LYS  62 -11.294  14.576 -26.998
  476   3HZ   LYS  62          3HZ       LYS  62  -9.644  14.800 -27.337
  477    H    MET  63           H        MET  63  -7.349  12.820 -21.346
  478    HA   MET  63           HA       MET  63  -6.881  15.470 -20.550
  479   1HB   MET  63          2HB       MET  63  -7.733  13.747 -19.010
  480   2HB   MET  63          1HB       MET  63  -6.165  12.937 -19.039
  481   1HG   MET  63          2HG       MET  63  -5.316  14.361 -17.510
  482   2HG   MET  63          1HG       MET  63  -5.879  15.764 -18.417
  483   1HE   MET  63          1HE       MET  63  -8.689  13.051 -16.292
  484   2HE   MET  63          2HE       MET  63  -7.282  13.238 -15.249
  485   3HE   MET  63          3HE       MET  63  -7.069  12.711 -16.916
  486    H    GLY  64           H        GLY  64  -4.452  12.855 -20.199
  487   1HA   GLY  64          2HA       GLY  64  -2.323  13.987 -21.571
  488   2HA   GLY  64          1HA       GLY  64  -2.287  14.783 -19.997
  489    H    PHE  65           H        PHE  65  -3.449  11.500 -20.309
  490    HA   PHE  65           HA       PHE  65  -0.968  10.578 -18.910
  491   1HB   PHE  65          2HB       PHE  65  -3.857   9.732 -18.636
  492   2HB   PHE  65          1HB       PHE  65  -2.532   8.725 -18.052
  493    HD1  PHE  65           HD1      PHE  65  -1.049   9.517 -16.237
  494    HD2  PHE  65           HD2      PHE  65  -4.437  11.810 -17.544
  495    HE1  PHE  65           HE1      PHE  65  -0.909  10.895 -14.179
  496    HE2  PHE  65           HE2      PHE  65  -4.297  13.189 -15.488
  497    HZ   PHE  65           HZ       PHE  65  -2.534  12.732 -13.805
  498    H    GLU  66           H        GLU  66   0.129   8.873 -19.824
  499    HA   GLU  66           HA       GLU  66  -0.765   7.950 -22.468
  500   1HB   GLU  66          2HB       GLU  66   1.695   7.246 -20.836
  501   2HB   GLU  66          1HB       GLU  66   1.412   6.765 -22.509
  502   1HG   GLU  66          2HG       GLU  66   0.976   9.470 -22.637
  503   2HG   GLU  66          1HG       GLU  66   2.250   9.374 -21.421
  504    H    VAL  67           H        VAL  67  -2.719   6.851 -21.505
  505    HA   VAL  67           HA       VAL  67  -2.776   4.776 -19.678
  506    HB   VAL  67           HB       VAL  67  -4.659   5.704 -21.228
  507   1HG1  VAL  67          1HG1      VAL  67  -5.111   4.473 -23.216
  508   2HG1  VAL  67          2HG1      VAL  67  -3.925   3.234 -22.809
  509   3HG1  VAL  67          3HG1      VAL  67  -3.388   4.843 -23.289
  510   1HG2  VAL  67          1HG2      VAL  67  -4.298   3.168 -19.833
  511   2HG2  VAL  67          2HG2      VAL  67  -5.479   3.030 -21.136
  512   3HG2  VAL  67          3HG2      VAL  67  -5.704   4.233 -19.865
  513    H    LEU  68           H        LEU  68  -2.382   2.514 -19.760
  514    HA   LEU  68           HA       LEU  68  -0.723   1.606 -22.078
  515   1HB   LEU  68          2HB       LEU  68   0.520   2.083 -19.860
  516   2HB   LEU  68          1HB       LEU  68  -0.301   0.647 -19.246
  517    HG   LEU  68           HG       LEU  68   0.611  -0.351 -21.574
  518   1HD1  LEU  68          1HD1      LEU  68   1.691   1.870 -22.103
  519   2HD1  LEU  68          2HD1      LEU  68   2.810   0.507 -22.092
  520   3HD1  LEU  68          3HD1      LEU  68   2.755   1.613 -20.720
  521   1HD2  LEU  68          1HD2      LEU  68   2.098  -0.066 -18.948
  522   2HD2  LEU  68          2HD2      LEU  68   2.599  -1.167 -20.231
  523   3HD2  LEU  68          3HD2      LEU  68   1.040  -1.390 -19.437
  524    H    GLU  69           H        GLU  69  -1.282  -0.397 -22.894
  525    HA   GLU  69           HA       GLU  69  -3.766  -1.538 -22.597
  526   1HB   GLU  69          2HB       GLU  69  -2.874  -3.593 -23.494
  527   2HB   GLU  69          1HB       GLU  69  -1.969  -2.264 -24.220
  528   1HG   GLU  69          2HG       GLU  69  -0.296  -2.587 -22.280
  529   2HG   GLU  69          1HG       GLU  69  -1.097  -4.137 -22.021
  530    H    ALA  70           H        ALA  70  -4.543  -3.445 -21.403
  531    HA   ALA  70           HA       ALA  70  -3.296  -3.605 -18.692
  532   1HB   ALA  70          1HB       ALA  70  -6.116  -3.652 -19.672
  533   2HB   ALA  70          2HB       ALA  70  -5.440  -2.881 -18.239
  534   3HB   ALA  70          3HB       ALA  70  -5.728  -4.620 -18.251
  535    H    GLU  71           H        GLU  71  -3.860  -5.803 -17.603
  536    HA   GLU  71           HA       GLU  71  -3.711  -8.035 -19.572
  537   1HB   GLU  71          2HB       GLU  71  -2.056  -9.003 -17.695
  538   2HB   GLU  71          1HB       GLU  71  -1.462  -8.042 -19.049
  539   1HG   GLU  71          2HG       GLU  71  -1.662  -5.995 -17.633
  540   2HG   GLU  71          1HG       GLU  71  -2.134  -7.018 -16.276
  541    H    GLU  72           H        GLU  72  -4.461 -10.078 -18.673
  542    HA   GLU  72           HA       GLU  72  -6.621  -9.741 -16.773
  543   1HB   GLU  72          2HB       GLU  72  -5.378 -12.308 -17.807
  544   2HB   GLU  72          1HB       GLU  72  -6.961 -12.146 -17.047
  545   1HG   GLU  72          2HG       GLU  72  -6.462 -10.365 -19.366
  546   2HG   GLU  72          1HG       GLU  72  -6.592 -12.085 -19.736
  547    H    THR  73           H        THR  73  -6.507  -9.890 -14.582
  548    HA   THR  73           HA       THR  73  -4.071 -11.178 -13.410
  549    HB   THR  73           HB       THR  73  -3.704  -9.060 -12.637
  550    HG1  THR  73           HG1      THR  73  -5.929  -9.535 -10.969
  551   1HG2  THR  73          1HG2      THR  73  -6.587  -8.686 -13.343
  552   2HG2  THR  73          2HG2      THR  73  -5.177  -7.767 -13.869
  553   3HG2  THR  73          3HG2      THR  73  -5.833  -7.525 -12.249
  554    H    GLU  74           H        GLU  74  -4.753 -11.398 -10.816
  555    HA   GLU  74           HA       GLU  74  -7.466 -12.278 -10.354
  556   1HB   GLU  74          2HB       GLU  74  -6.696 -14.734  -9.975
  557   2HB   GLU  74          1HB       GLU  74  -7.023 -14.211 -11.628
  558   1HG   GLU  74          2HG       GLU  74  -4.587 -13.702 -11.897
  559   2HG   GLU  74          1HG       GLU  74  -4.307 -14.384 -10.294
  560    H    ASP  75           H        ASP  75  -7.799 -12.478  -8.137
  561    HA   ASP  75           HA       ASP  75  -5.341 -12.312  -6.440
  562   1HB   ASP  75          2HB       ASP  75  -8.101 -11.219  -5.820
  563   2HB   ASP  75          1HB       ASP  75  -6.643 -10.998  -4.852
  564    H    GLU  76           H        GLU  76  -8.798 -13.107  -5.946
  565    HA   GLU  76           HA       GLU  76  -8.415 -14.876  -3.794
  566   1HB   GLU  76          2HB       GLU  76 -10.533 -15.255  -5.918
  567   2HB   GLU  76          1HB       GLU  76 -10.634 -15.658  -4.203
  568   1HG   GLU  76          2HG       GLU  76 -10.039 -13.005  -4.055
  569   2HG   GLU  76          1HG       GLU  76 -10.977 -13.044  -5.549
  570    H    ASP  77           H        ASP  77  -8.646 -15.695  -7.268
  571    HA   ASP  77           HA       ASP  77  -6.632 -17.649  -7.279
  572   1HB   ASP  77          2HB       ASP  77  -9.115 -18.555  -6.014
  573   2HB   ASP  77          1HB       ASP  77  -8.639 -19.568  -7.378
  574    H    GLY  78           H        GLY  78  -9.440 -16.197  -8.553
  575   1HA   GLY  78          2HA       GLY  78  -8.620 -16.821 -11.271
  576   2HA   GLY  78          1HA       GLY  78 -10.102 -17.663 -10.819
  577    H    ASN  79           H        ASN  79  -9.515 -14.587  -9.336
  578    HA   ASN  79           HA       ASN  79 -11.945 -13.493 -10.451
  579   1HB   ASN  79          2HB       ASN  79  -9.962 -12.726  -8.465
  580   2HB   ASN  79          1HB       ASN  79 -10.425 -11.349  -9.468
  581   1HD2  ASN  79          1HD2      ASN  79 -12.686 -10.662  -9.417
  582   2HD2  ASN  79          2HD2      ASN  79 -13.751 -11.211  -8.214
  583    H    LYS  80           H        LYS  80 -11.620 -13.601 -12.742
  584    HA   LYS  80           HA       LYS  80  -9.384 -12.532 -14.131
  585   1HB   LYS  80          2HB       LYS  80 -12.278 -12.664 -15.030
  586   2HB   LYS  80          1HB       LYS  80 -10.884 -12.448 -16.089
  587   1HG   LYS  80          2HG       LYS  80 -10.438 -14.723 -14.377
  588   2HG   LYS  80          1HG       LYS  80 -11.996 -14.895 -15.184
  589   1HD   LYS  80          2HD       LYS  80 -10.790 -14.278 -17.351
  590   2HD   LYS  80          1HD       LYS  80  -9.283 -14.500 -16.461
  591   1HE   LYS  80          2HE       LYS  80 -10.478 -16.794 -15.770
  592   2HE   LYS  80          1HE       LYS  80 -11.301 -16.528 -17.307
  593   1HZ   LYS  80          1HZ       LYS  80  -8.626 -15.967 -17.737
  594   2HZ   LYS  80          2HZ       LYS  80  -9.504 -17.306 -18.308
  595   3HZ   LYS  80          3HZ       LYS  80  -8.656 -17.406 -16.839
  596    H    LEU  81           H        LEU  81  -8.752 -10.497 -13.360
  597    HA   LEU  81           HA       LEU  81 -10.755  -8.297 -13.688
  598   1HB   LEU  81          2HB       LEU  81  -8.263  -8.340 -11.956
  599   2HB   LEU  81          1HB       LEU  81  -9.442  -7.031 -12.047
  600    HG   LEU  81           HG       LEU  81 -10.431  -9.776 -11.392
  601   1HD1  LEU  81          1HD1      LEU  81  -8.747  -9.803  -9.783
  602   2HD1  LEU  81          2HD1      LEU  81 -10.029  -8.960  -8.912
  603   3HD1  LEU  81          3HD1      LEU  81  -8.711  -8.044  -9.645
  604   1HD2  LEU  81          1HD2      LEU  81 -12.107  -8.538 -10.189
  605   2HD2  LEU  81          2HD2      LEU  81 -11.886  -7.718 -11.734
  606   3HD2  LEU  81          3HD2      LEU  81 -11.155  -7.055 -10.272
  607    H    LEU  82           H        LEU  82  -9.765  -6.203 -14.431
  608    HA   LEU  82           HA       LEU  82  -7.503  -6.733 -16.319
  609   1HB   LEU  82          2HB       LEU  82  -9.795  -4.755 -16.558
  610   2HB   LEU  82          1HB       LEU  82  -8.471  -4.917 -17.714
  611    HG   LEU  82           HG       LEU  82  -9.248  -7.487 -17.624
  612   1HD1  LEU  82          1HD1      LEU  82 -11.032  -7.133 -16.006
  613   2HD1  LEU  82          2HD1      LEU  82 -11.750  -7.526 -17.567
  614   3HD1  LEU  82          3HD1      LEU  82 -11.728  -5.856 -17.003
  615   1HD2  LEU  82          1HD2      LEU  82  -9.097  -5.958 -19.615
  616   2HD2  LEU  82          2HD2      LEU  82 -10.719  -5.379 -19.236
  617   3HD2  LEU  82          3HD2      LEU  82 -10.468  -7.065 -19.685
  618    H    CYS  83           H        CYS  83  -5.734  -5.357 -16.188
  619    HA   CYS  83           HA       CYS  83  -6.001  -2.989 -14.388
  620   1HB   CYS  83          2HB       CYS  83  -3.631  -3.557 -13.612
  621   2HB   CYS  83          1HB       CYS  83  -4.916  -4.609 -13.018
  622    HG   CYS  83           HG       CYS  83  -2.607  -5.534 -14.674
  623    H    PHE  84           H        PHE  84  -5.774  -1.343 -15.860
  624    HA   PHE  84           HA       PHE  84  -3.674  -1.580 -17.950
  625   1HB   PHE  84          2HB       PHE  84  -4.681   0.546 -18.817
  626   2HB   PHE  84          1HB       PHE  84  -5.836  -0.783 -18.738
  627    HD1  PHE  84           HD1      PHE  84  -5.085   2.563 -17.657
  628    HD2  PHE  84           HD2      PHE  84  -7.326  -0.961 -16.654
  629    HE1  PHE  84           HE1      PHE  84  -6.548   3.914 -16.180
  630    HE2  PHE  84           HE2      PHE  84  -8.788   0.389 -15.176
  631    HZ   PHE  84           HZ       PHE  84  -8.399   2.827 -14.939
  632    H    ASP  85           H        ASP  85  -2.140   0.242 -18.206
  633    HA   ASP  85           HA       ASP  85  -1.525   1.485 -15.556
  634   1HB   ASP  85          2HB       ASP  85   0.085  -0.094 -17.211
  635   2HB   ASP  85          1HB       ASP  85   0.652   1.553 -17.488
  636    H    ALA  86           H        ALA  86  -0.230   3.620 -15.861
  637    HA   ALA  86           HA       ALA  86  -1.008   5.129 -18.279
  638   1HB   ALA  86          1HB       ALA  86  -1.665   6.509 -15.733
  639   2HB   ALA  86          2HB       ALA  86  -2.752   5.202 -16.204
  640   3HB   ALA  86          3HB       ALA  86  -2.491   6.567 -17.290
  641    H    THR  87           H        THR  87   0.820   6.204 -18.846
  642    HA   THR  87           HA       THR  87   2.775   6.884 -16.704
  643    HB   THR  87           HB       THR  87   3.785   7.478 -19.314
  644    HG1  THR  87           HG1      THR  87   3.222   5.803 -20.465
  645   1HG2  THR  87          1HG2      THR  87   5.237   6.835 -17.531
  646   2HG2  THR  87          2HG2      THR  87   5.297   5.518 -18.703
  647   3HG2  THR  87          3HG2      THR  87   4.330   5.351 -17.237
  648    H    MET  88           H        MET  88   3.570   9.017 -16.500
  649    HA   MET  88           HA       MET  88   2.377  11.124 -18.200
  650   1HB   MET  88          2HB       MET  88   0.720  11.083 -16.497
  651   2HB   MET  88          1HB       MET  88   1.918  10.840 -15.226
  652   1HG   MET  88          2HG       MET  88   2.804  13.094 -15.586
  653   2HG   MET  88          1HG       MET  88   1.686  13.342 -16.926
  654   1HE   MET  88          1HE       MET  88  -0.218  15.069 -16.351
  655   2HE   MET  88          2HE       MET  88  -1.558  14.215 -15.590
  656   3HE   MET  88          3HE       MET  88  -0.647  13.437 -16.882
  657    H    GLN  89           H        GLN  89   3.561  13.136 -18.033
  658    HA   GLN  89           HA       GLN  89   6.287  12.754 -16.871
  659   1HB   GLN  89          2HB       GLN  89   5.222  14.223 -19.255
  660   2HB   GLN  89          1HB       GLN  89   6.653  14.869 -18.450
  661   1HG   GLN  89          2HG       GLN  89   6.365  12.010 -19.416
  662   2HG   GLN  89          1HG       GLN  89   7.229  13.279 -20.283
  663   1HE2  GLN  89          1HE2      GLN  89   8.764  11.112 -19.565
  664   2HE2  GLN  89          2HE2      GLN  89   9.772  11.491 -18.253
  665    H    SER  90           H        SER  90   6.916  14.092 -15.223
  666    HA   SER  90           HA       SER  90   5.829  16.759 -14.877
  667   1HB   SER  90          2HB       SER  90   4.691  16.335 -12.724
  668   2HB   SER  90          1HB       SER  90   3.918  15.449 -14.036
  669    HG   SER  90           HG       SER  90   5.098  14.521 -11.799
  670    H    ALA  91           H        ALA  91   7.020  17.929 -13.296
  671    HA   ALA  91           HA       ALA  91   9.677  17.041 -12.801
  672   1HB   ALA  91          1HB       ALA  91   8.349  19.431 -12.552
  673   2HB   ALA  91          2HB       ALA  91   9.980  19.130 -11.951
  674   3HB   ALA  91          3HB       ALA  91   8.599  18.988 -10.862
  675    H    LEU  92           H        LEU  92  10.665  16.394 -10.779
  676    HA   LEU  92           HA       LEU  92   8.979  14.583  -9.229
  677   1HB   LEU  92          2HB       LEU  92  11.490  14.303  -9.873
  678   2HB   LEU  92          1HB       LEU  92  11.797  15.347  -8.484
  679    HG   LEU  92           HG       LEU  92  10.483  13.788  -7.056
  680   1HD1  LEU  92          1HD1      LEU  92  10.354  11.427  -8.404
  681   2HD1  LEU  92          2HD1      LEU  92  10.013  12.560  -9.711
  682   3HD1  LEU  92          3HD1      LEU  92   8.998  12.547  -8.268
  683   1HD2  LEU  92          1HD2      LEU  92  12.802  12.642  -8.638
  684   2HD2  LEU  92          2HD2      LEU  92  12.144  11.873  -7.193
  685   3HD2  LEU  92          3HD2      LEU  92  12.873  13.476  -7.085
  686    H    ASP  93           H        ASP  93   7.488  16.014  -8.183
  687    HA   ASP  93           HA       ASP  93   8.661  17.374  -5.817
  688   1HB   ASP  93          2HB       ASP  93   7.374  18.690  -8.096
  689   2HB   ASP  93          1HB       ASP  93   6.604  19.084  -6.559
  690    H    ALA  94           H        ALA  94   7.613  16.518  -4.094
  691    HA   ALA  94           HA       ALA  94   5.387  14.840  -4.147
  692   1HB   ALA  94          1HB       ALA  94   6.934  16.143  -2.139
  693   2HB   ALA  94          2HB       ALA  94   5.857  14.760  -1.950
  694   3HB   ALA  94          3HB       ALA  94   5.234  16.397  -1.744
  695    H    LYS  95           H        LYS  95   5.357  18.370  -3.538
  696    HA   LYS  95           HA       LYS  95   2.612  18.755  -3.206
  697   1HB   LYS  95          2HB       LYS  95   4.461  20.534  -4.827
  698   2HB   LYS  95          1HB       LYS  95   2.946  21.022  -4.067
  699   1HG   LYS  95          2HG       LYS  95   4.247  19.929  -1.936
  700   2HG   LYS  95          1HG       LYS  95   5.607  20.579  -2.853
  701   1HD   LYS  95          2HD       LYS  95   4.902  22.357  -1.431
  702   2HD   LYS  95          1HD       LYS  95   4.260  22.750  -3.027
  703   1HE   LYS  95          2HE       LYS  95   2.376  21.079  -1.635
  704   2HE   LYS  95          1HE       LYS  95   2.809  22.447  -0.610
  705   1HZ   LYS  95          1HZ       LYS  95   2.485  23.368  -3.235
  706   2HZ   LYS  95          2HZ       LYS  95   1.553  23.745  -1.864
  707   3HZ   LYS  95          3HZ       LYS  95   1.130  22.425  -2.846
  708    H    LEU  96           H        LEU  96   4.409  18.511  -6.280
  709    HA   LEU  96           HA       LEU  96   2.093  18.880  -7.952
  710   1HB   LEU  96          2HB       LEU  96   4.897  18.432  -8.307
  711   2HB   LEU  96          1HB       LEU  96   4.028  17.244  -9.278
  712    HG   LEU  96           HG       LEU  96   3.267  20.166  -9.307
  713   1HD1  LEU  96          1HD1      LEU  96   4.601  19.989 -11.590
  714   2HD1  LEU  96          2HD1      LEU  96   5.494  18.741 -10.720
  715   3HD1  LEU  96          3HD1      LEU  96   5.443  20.388 -10.091
  716   1HD2  LEU  96          1HD2      LEU  96   2.805  17.770 -11.100
  717   2HD2  LEU  96          2HD2      LEU  96   2.471  19.422 -11.618
  718   3HD2  LEU  96          3HD2      LEU  96   1.596  18.732 -10.251
  719    H    ILE  97           H        ILE  97   3.790  15.965  -6.785
  720    HA   ILE  97           HA       ILE  97   2.206  14.042  -8.136
  721    HB   ILE  97           HB       ILE  97   3.607  13.937  -5.454
  722   1HG1  ILE  97          2HG1      ILE  97   4.373  12.422  -7.930
  723   2HG1  ILE  97          1HG1      ILE  97   4.773  14.136  -7.821
  724   1HG2  ILE  97          1HG2      ILE  97   3.375  11.361  -6.048
  725   2HG2  ILE  97          2HG2      ILE  97   1.938  11.916  -6.906
  726   3HG2  ILE  97          3HG2      ILE  97   2.095  12.200  -5.172
  727   1HD1  ILE  97          1HD1      ILE  97   6.399  13.771  -6.287
  728   2HD1  ILE  97          2HD1      ILE  97   6.293  12.079  -6.774
  729   3HD1  ILE  97          3HD1      ILE  97   5.394  12.651  -5.369
  730    H    ASP  98           H        ASP  98   1.544  15.952  -5.267
  731    HA   ASP  98           HA       ASP  98  -0.729  14.379  -4.397
  732   1HB   ASP  98          2HB       ASP  98   0.385  15.822  -2.800
  733   2HB   ASP  98          1HB       ASP  98   0.103  17.236  -3.817
  734    H    GLU  99           H        GLU  99  -0.397  17.423  -6.240
  735    HA   GLU  99           HA       GLU  99  -3.194  17.829  -6.653
  736   1HB   GLU  99          2HB       GLU  99  -0.839  18.647  -8.384
  737   2HB   GLU  99          1HB       GLU  99  -2.480  19.274  -8.548
  738   1HG   GLU  99          2HG       GLU  99  -1.820  19.530  -5.811
  739   2HG   GLU  99          1HG       GLU  99  -0.410  20.091  -6.707
  740    H    GLN 100           H        GLN 100  -0.745  16.163  -8.653
  741    HA   GLN 100           HA       GLN 100  -2.515  15.464 -10.782
  742   1HB   GLN 100          2HB       GLN 100   0.192  14.855  -9.989
  743   2HB   GLN 100          1HB       GLN 100  -0.622  13.374 -10.495
  744   1HG   GLN 100          2HG       GLN 100   0.420  14.470 -12.431
  745   2HG   GLN 100          1HG       GLN 100  -1.338  14.497 -12.587
  746   1HE2  GLN 100          1HE2      GLN 100  -0.862  16.432 -14.062
  747   2HE2  GLN 100          2HE2      GLN 100  -0.668  17.953 -13.336
  748    H    VAL 101           H        VAL 101  -1.363  13.396  -8.080
  749    HA   VAL 101           HA       VAL 101  -3.061  11.207  -8.538
  750    HB   VAL 101           HB       VAL 101  -2.209  12.356  -5.861
  751   1HG1  VAL 101          1HG1      VAL 101  -2.672  10.165  -4.959
  752   2HG1  VAL 101          2HG1      VAL 101  -3.025   9.524  -6.563
  753   3HG1  VAL 101          3HG1      VAL 101  -4.115  10.696  -5.824
  754   1HG2  VAL 101          1HG2      VAL 101  -0.205  11.255  -6.115
  755   2HG2  VAL 101          2HG2      VAL 101  -0.546  11.539  -7.822
  756   3HG2  VAL 101          3HG2      VAL 101  -0.915   9.974  -7.099
  757    H    GLU 102           H        GLU 102  -3.743  14.250  -6.846
  758    HA   GLU 102           HA       GLU 102  -6.279  13.634  -5.784
  759   1HB   GLU 102          2HB       GLU 102  -4.997  15.782  -5.443
  760   2HB   GLU 102          1HB       GLU 102  -5.512  16.277  -7.057
  761   1HG   GLU 102          2HG       GLU 102  -7.828  16.235  -6.421
  762   2HG   GLU 102          1HG       GLU 102  -7.454  15.449  -4.888
  763    H    LYS 103           H        LYS 103  -5.432  14.787  -9.053
  764    HA   LYS 103           HA       LYS 103  -8.128  14.907 -10.021
  765   1HB   LYS 103          2HB       LYS 103  -5.567  14.390 -11.565
  766   2HB   LYS 103          1HB       LYS 103  -7.106  14.895 -12.263
  767   1HG   LYS 103          2HG       LYS 103  -6.976  16.904 -10.656
  768   2HG   LYS 103          1HG       LYS 103  -5.285  16.458 -10.429
  769   1HD   LYS 103          2HD       LYS 103  -4.860  16.676 -12.819
  770   2HD   LYS 103          1HD       LYS 103  -6.569  16.997 -13.122
  771   1HE   LYS 103          2HE       LYS 103  -6.239  19.185 -12.725
  772   2HE   LYS 103          1HE       LYS 103  -5.665  18.811 -11.100
  773   1HZ   LYS 103          1HZ       LYS 103  -3.463  18.399 -12.025
  774   2HZ   LYS 103          2HZ       LYS 103  -3.983  19.982 -12.359
  775   3HZ   LYS 103          3HZ       LYS 103  -4.023  18.795 -13.575
  776    H    LEU 104           H        LEU 104  -5.666  12.327 -10.124
  777    HA   LEU 104           HA       LEU 104  -7.238  10.455 -11.606
  778   1HB   LEU 104          2HB       LEU 104  -5.013  10.066  -9.587
  779   2HB   LEU 104          1HB       LEU 104  -5.729   8.738 -10.499
  780    HG   LEU 104           HG       LEU 104  -4.389  11.183 -11.694
  781   1HD1  LEU 104          1HD1      LEU 104  -3.060   9.190 -10.553
  782   2HD1  LEU 104          2HD1      LEU 104  -2.524   9.861 -12.094
  783   3HD1  LEU 104          3HD1      LEU 104  -3.452   8.361 -12.060
  784   1HD2  LEU 104          1HD2      LEU 104  -4.612   9.477 -13.742
  785   2HD2  LEU 104          2HD2      LEU 104  -5.903  10.610 -13.345
  786   3HD2  LEU 104          3HD2      LEU 104  -6.008   8.932 -12.813
  787    H    VAL 105           H        VAL 105  -7.231  11.389  -8.232
  788    HA   VAL 105           HA       VAL 105  -8.768   9.102  -7.309
  789    HB   VAL 105           HB       VAL 105  -8.034  11.782  -6.145
  790   1HG1  VAL 105          1HG1      VAL 105  -9.202  10.831  -4.033
  791   2HG1  VAL 105          2HG1      VAL 105 -10.094   9.810  -5.161
  792   3HG1  VAL 105          3HG1      VAL 105 -10.218  11.566  -5.274
  793   1HG2  VAL 105          1HG2      VAL 105  -6.588  10.556  -4.824
  794   2HG2  VAL 105          2HG2      VAL 105  -6.650   9.492  -6.230
  795   3HG2  VAL 105          3HG2      VAL 105  -7.636   9.138  -4.810
  796    H    ASN 106           H        ASN 106  -9.588  12.510  -8.033
  797    HA   ASN 106           HA       ASN 106 -12.383  12.264  -7.525
  798   1HB   ASN 106          2HB       ASN 106 -10.714  14.128  -9.200
  799   2HB   ASN 106          1HB       ASN 106 -12.475  14.222  -9.257
  800   1HD2  ASN 106          1HD2      ASN 106  -9.816  14.095  -6.813
  801   2HD2  ASN 106          2HD2      ASN 106 -10.581  15.140  -5.716
  802    H    LEU 107           H        LEU 107 -10.615  12.084 -10.638
  803    HA   LEU 107           HA       LEU 107 -12.880  11.405 -12.226
  804   1HB   LEU 107          2HB       LEU 107 -10.869  12.091 -13.336
  805   2HB   LEU 107          1HB       LEU 107  -9.929  10.814 -12.562
  806    HG   LEU 107           HG       LEU 107 -12.239   9.769 -14.017
  807   1HD1  LEU 107          1HD1      LEU 107 -10.096  11.291 -15.530
  808   2HD1  LEU 107          2HD1      LEU 107 -11.820  11.666 -15.498
  809   3HD1  LEU 107          3HD1      LEU 107 -11.254  10.185 -16.271
  810   1HD2  LEU 107          1HD2      LEU 107 -10.147   8.584 -13.091
  811   2HD2  LEU 107          2HD2      LEU 107  -9.297   9.255 -14.482
  812   3HD2  LEU 107          3HD2      LEU 107 -10.647   8.147 -14.725
  813    H    ALA 108           H        ALA 108 -10.338   9.208 -10.962
  814    HA   ALA 108           HA       ALA 108 -11.305   6.752 -11.689
  815   1HB   ALA 108          1HB       ALA 108 -10.204   7.639  -9.018
  816   2HB   ALA 108          2HB       ALA 108  -9.365   6.787 -10.314
  817   3HB   ALA 108          3HB       ALA 108 -10.586   5.951  -9.353
  818    H    GLU 109           H        GLU 109 -12.421   8.476  -8.754
  819    HA   GLU 109           HA       GLU 109 -14.551   6.630  -8.209
  820   1HB   GLU 109          2HB       GLU 109 -14.127   9.518  -7.400
  821   2HB   GLU 109          1HB       GLU 109 -15.440   8.517  -6.782
  822   1HG   GLU 109          2HG       GLU 109 -12.573   7.592  -6.624
  823   2HG   GLU 109          1HG       GLU 109 -13.263   8.639  -5.383
  824    H    LYS 110           H        LYS 110 -14.327   9.537 -10.193
  825    HA   LYS 110           HA       LYS 110 -17.029  10.132 -10.614
  826   1HB   LYS 110          2HB       LYS 110 -15.072  11.372 -11.595
  827   2HB   LYS 110          1HB       LYS 110 -14.912  10.077 -12.782
  828   1HG   LYS 110          2HG       LYS 110 -16.368  11.274 -14.037
  829   2HG   LYS 110          1HG       LYS 110 -17.603  10.692 -12.921
  830   1HD   LYS 110          2HD       LYS 110 -16.800  12.738 -11.454
  831   2HD   LYS 110          1HD       LYS 110 -16.230  13.357 -13.005
  832   1HE   LYS 110          2HE       LYS 110 -19.062  12.449 -12.407
  833   2HE   LYS 110          1HE       LYS 110 -18.531  14.125 -12.542
  834   1HZ   LYS 110          1HZ       LYS 110 -17.843  13.671 -14.823
  835   2HZ   LYS 110          2HZ       LYS 110 -19.501  13.367 -14.607
  836   3HZ   LYS 110          3HZ       LYS 110 -18.400  12.075 -14.687
  837    H    PHE 111           H        PHE 111 -15.097   7.516 -12.022
  838    HA   PHE 111           HA       PHE 111 -17.484   6.587 -13.533
  839   1HB   PHE 111          2HB       PHE 111 -14.567   5.784 -13.579
  840   2HB   PHE 111          1HB       PHE 111 -15.815   4.880 -14.437
  841    HD1  PHE 111           HD1      PHE 111 -17.308   6.157 -16.091
  842    HD2  PHE 111           HD2      PHE 111 -13.639   7.743 -14.517
  843    HE1  PHE 111           HE1      PHE 111 -17.215   7.793 -17.953
  844    HE2  PHE 111           HE2      PHE 111 -13.547   9.379 -16.379
  845    HZ   PHE 111           HZ       PHE 111 -15.336   9.403 -18.096
  846    H    ASP 112           H        ASP 112 -14.946   4.688 -11.911
  847    HA   ASP 112           HA       ASP 112 -16.334   3.725  -9.698
  848   1HB   ASP 112          2HB       ASP 112 -17.428   2.711 -12.218
  849   2HB   ASP 112          1HB       ASP 112 -16.939   1.418 -11.122
  850    H    ILE 113           H        ILE 113 -13.639   4.079 -10.876
  851    HA   ILE 113           HA       ILE 113 -12.586   1.298 -10.575
  852    HB   ILE 113           HB       ILE 113 -10.521   2.245 -11.686
  853   1HG1  ILE 113          2HG1      ILE 113 -12.348   4.579 -12.320
  854   2HG1  ILE 113          1HG1      ILE 113 -11.110   4.634 -11.064
  855   1HG2  ILE 113          1HG2      ILE 113 -11.371   1.802 -13.788
  856   2HG2  ILE 113          2HG2      ILE 113 -12.819   2.772 -13.522
  857   3HG2  ILE 113          3HG2      ILE 113 -12.688   1.166 -12.806
  858   1HD1  ILE 113          1HD1      ILE 113  -9.751   3.613 -13.263
  859   2HD1  ILE 113          2HD1      ILE 113  -9.683   5.280 -12.694
  860   3HD1  ILE 113          3HD1      ILE 113 -10.816   4.830 -13.967
  861    H    ILE 114           H        ILE 114 -11.153   0.888  -8.914
  862    HA   ILE 114           HA       ILE 114 -10.830   2.987  -6.882
  863    HB   ILE 114           HB       ILE 114 -11.226   0.961  -5.825
  864   1HG1  ILE 114          2HG1      ILE 114  -9.149   0.143  -4.841
  865   2HG1  ILE 114          1HG1      ILE 114  -8.208   0.838  -6.157
  866   1HG2  ILE 114          1HG2      ILE 114  -9.765  -1.102  -6.777
  867   2HG2  ILE 114          2HG2      ILE 114  -9.902  -0.138  -8.248
  868   3HG2  ILE 114          3HG2      ILE 114 -11.356  -0.684  -7.412
  869   1HD1  ILE 114          1HD1      ILE 114  -9.951   2.809  -4.887
  870   2HD1  ILE 114          2HD1      ILE 114  -8.219   2.887  -5.201
  871   3HD1  ILE 114          3HD1      ILE 114  -8.817   2.090  -3.747
  872    H    TYR 115           H        TYR 115  -9.056   4.277  -6.759
  873    HA   TYR 115           HA       TYR 115  -6.743   3.648  -8.505
  874   1HB   TYR 115          2HB       TYR 115  -7.342   5.886  -8.818
  875   2HB   TYR 115          1HB       TYR 115  -7.743   6.119  -7.117
  876    HD1  TYR 115           HD1      TYR 115  -6.093   6.806  -5.534
  877    HD2  TYR 115           HD2      TYR 115  -4.927   5.644  -9.501
  878    HE1  TYR 115           HE1      TYR 115  -3.803   7.656  -5.109
  879    HE2  TYR 115           HE2      TYR 115  -2.636   6.494  -9.076
  880    HH   TYR 115           HH       TYR 115  -1.742   8.493  -7.185
  881    H    ASP 116           H        ASP 116  -5.203   2.405  -7.542
  882    HA   ASP 116           HA       ASP 116  -4.055   3.297  -4.991
  883   1HB   ASP 116          2HB       ASP 116  -5.772   1.890  -4.081
  884   2HB   ASP 116          1HB       ASP 116  -5.464   0.634  -5.280
  885    H    GLY 117           H        GLY 117  -2.229   3.597  -6.463
  886   1HA   GLY 117          2HA       GLY 117  -0.215   1.733  -6.390
  887   2HA   GLY 117          1HA       GLY 117  -1.119   1.260  -7.828
  888    H    TRP 118           H        TRP 118   0.947   3.717  -6.432
  889    HA   TRP 118           HA       TRP 118   1.325   4.813  -9.178
  890   1HB   TRP 118          2HB       TRP 118   0.987   7.001  -8.546
  891   2HB   TRP 118          1HB       TRP 118  -0.087   6.230  -7.380
  892    HD1  TRP 118           HD1      TRP 118   0.565   6.314  -4.865
  893    HE1  TRP 118           HE1      TRP 118   2.443   7.494  -3.550
  894    HE3  TRP 118           HE3      TRP 118   3.566   7.775  -8.730
  895    HZ2  TRP 118           HZ2      TRP 118   4.894   8.877  -4.070
  896    HZ3  TRP 118           HZ3      TRP 118   5.664   9.019  -8.293
  897    HH2  TRP 118           HH2      TRP 118   6.332   9.572  -5.970
  898    H    GLY 119           H        GLY 119   3.409   4.309  -9.663
  899   1HA   GLY 119          2HA       GLY 119   5.464   4.759  -7.537
  900   2HA   GLY 119          1HA       GLY 119   5.525   3.335  -8.577
  901    H    THR 120           H        THR 120   7.644   5.210  -8.452
  902    HA   THR 120           HA       THR 120   7.418   6.555 -11.114
  903    HB   THR 120           HB       THR 120   7.889   8.294  -9.628
  904    HG1  THR 120           HG1      THR 120   9.540   8.104 -11.220
  905   1HG2  THR 120          1HG2      THR 120   9.627   6.311  -8.137
  906   2HG2  THR 120          2HG2      THR 120   8.083   6.976  -7.603
  907   3HG2  THR 120          3HG2      THR 120   9.499   8.020  -7.722
  908    H    TYR 121           H        TYR 121   9.526   6.612 -12.337
  909    HA   TYR 121           HA       TYR 121  11.301   4.308 -11.694
  910   1HB   TYR 121          2HB       TYR 121   9.355   4.134 -13.638
  911   2HB   TYR 121          1HB       TYR 121  10.761   4.658 -14.565
  912    HD1  TYR 121           HD1      TYR 121  11.893   2.884 -15.549
  913    HD2  TYR 121           HD2      TYR 121  10.219   2.376 -11.626
  914    HE1  TYR 121           HE1      TYR 121  12.815   0.584 -15.454
  915    HE2  TYR 121           HE2      TYR 121  11.141   0.075 -11.531
  916    HH   TYR 121           HH       TYR 121  13.374  -1.068 -12.944
  917    H    TYR 122           H        TYR 122  13.392   4.985 -11.767
  918    HA   TYR 122           HA       TYR 122  14.345   7.508 -12.196
  919   1HB   TYR 122          2HB       TYR 122  15.563   4.825 -12.746
  920   2HB   TYR 122          1HB       TYR 122  16.440   6.270 -13.249
  921    HD1  TYR 122           HD1      TYR 122  16.228   8.245 -11.331
  922    HD2  TYR 122           HD2      TYR 122  16.178   4.002 -10.660
  923    HE1  TYR 122           HE1      TYR 122  16.977   8.606  -8.994
  924    HE2  TYR 122           HE2      TYR 122  16.929   4.364  -8.324
  925    HH   TYR 122           HH       TYR 122  18.257   7.174  -7.235
  926    H    GLU 123           H        GLU 123  15.015   8.775 -13.977
  927    HA   GLU 123           HA       GLU 123  13.639   8.133 -16.499
  928   1HB   GLU 123          2HB       GLU 123  15.411  10.507 -16.351
  929   2HB   GLU 123          1HB       GLU 123  13.754  10.373 -16.943
  930   1HG   GLU 123          2HG       GLU 123  13.436  11.605 -14.991
  931   2HG   GLU 123          1HG       GLU 123  13.192   9.960 -14.402
  932    H    GLY 124           H        GLY 124  15.319   6.185 -16.500
  933   1HA   GLY 124          2HA       GLY 124  16.843   5.997 -18.655
  934   2HA   GLY 124          1HA       GLY 124  17.897   7.044 -17.703
  935    H    LEU 125           H        LEU 125  18.338   4.245 -18.611
  936    HA   LEU 125           HA       LEU 125  19.085   3.151 -15.958
  937   1HB   LEU 125          2HB       LEU 125  16.837   2.204 -17.272
  938   2HB   LEU 125          1HB       LEU 125  18.093   1.073 -17.775
  939    HG   LEU 125           HG       LEU 125  18.740   1.004 -15.263
  940   1HD1  LEU 125          1HD1      LEU 125  15.917   1.529 -14.607
  941   2HD1  LEU 125          2HD1      LEU 125  16.819   2.965 -15.092
  942   3HD1  LEU 125          3HD1      LEU 125  17.380   1.989 -13.734
  943   1HD2  LEU 125          1HD2      LEU 125  16.772  -0.623 -14.843
  944   2HD2  LEU 125          2HD2      LEU 125  17.817  -0.959 -16.223
  945   3HD2  LEU 125          3HD2      LEU 125  16.246  -0.199 -16.472
  946    H    GLU 126           H        GLU 126  21.257   3.630 -16.585
  947    HA   GLU 126           HA       GLU 126  22.313   1.806 -18.705
  948   1HB   GLU 126          2HB       GLU 126  24.055   3.605 -19.129
  949   2HB   GLU 126          1HB       GLU 126  22.419   4.022 -19.640
  950   1HG   GLU 126          2HG       GLU 126  22.463   4.864 -17.005
  951   2HG   GLU 126          1HG       GLU 126  24.091   5.249 -17.565
  952    H    HIS 127           H        HIS 127  24.905   1.825 -18.366
  953    HA   HIS 127           HA       HIS 127  25.345   1.387 -15.437
  954   1HB   HIS 127          2HB       HIS 127  25.306  -0.701 -16.848
  955   2HB   HIS 127          1HB       HIS 127  26.704  -0.074 -17.721
  956    HD2  HIS 127           HD2      HIS 127  26.924  -2.768 -15.663
  957    HE1  HIS 127           HE1      HIS 127  29.245  -0.133 -13.313
  958    HE2  HIS 127           HE2      HIS 127  28.660  -2.568 -13.726
  959    H    HIS 128           H        HIS 128  25.805   3.906 -16.620
  960    HA   HIS 128           HA       HIS 128  28.743   4.088 -16.260
  961   1HB   HIS 128          2HB       HIS 128  27.557   4.207 -18.806
  962   2HB   HIS 128          1HB       HIS 128  27.876   5.886 -18.372
  963    HD2  HIS 128           HD2      HIS 128  30.756   5.689 -16.925
  964    HE1  HIS 128           HE1      HIS 128  32.017   3.441 -20.271
  965    HE2  HIS 128           HE2      HIS 128  32.801   4.783 -18.267
  966    H    HIS 129           H        HIS 129  29.330   5.963 -15.180
  967    HA   HIS 129           HA       HIS 129  27.231   8.055 -14.835
  968   1HB   HIS 129          2HB       HIS 129  27.898   8.222 -12.430
  969   2HB   HIS 129          1HB       HIS 129  27.160   6.670 -12.828
  970    HD2  HIS 129           HD2      HIS 129  29.388   4.682 -13.562
  971    HE1  HIS 129           HE1      HIS 129  31.932   6.427 -10.678
  972    HE2  HIS 129           HE2      HIS 129  31.566   4.399 -12.156
  973    H    HIS 130           H        HIS 130  28.817   8.902 -16.589
  974    HA   HIS 130           HA       HIS 130  31.366   9.906 -15.480
  975   1HB   HIS 130          2HB       HIS 130  31.319   9.030 -17.792
  976   2HB   HIS 130          1HB       HIS 130  30.132  10.261 -18.229
  977    HD2  HIS 130           HD2      HIS 130  32.904  11.616 -15.911
  978    HE1  HIS 130           HE1      HIS 130  33.949  12.761 -19.839
  979    HE2  HIS 130           HE2      HIS 130  34.484  13.081 -17.381
  980    H    HIS 131           H        HIS 131  29.562  11.071 -13.958
  981    HA   HIS 131           HA       HIS 131  29.640  13.886 -14.805
  982   1HB   HIS 131          2HB       HIS 131  27.399  12.580 -15.534
  983   2HB   HIS 131          1HB       HIS 131  26.952  12.996 -13.879
  984    HD2  HIS 131           HD2      HIS 131  25.299  15.191 -14.453
  985    HE1  HIS 131           HE1      HIS 131  28.150  17.427 -16.623
  986    HE2  HIS 131           HE2      HIS 131  25.831  17.474 -15.596
  987    H    HIS 132           HN       HIS 132  31.036  12.686 -12.740
  988    HA   HIS 132           HA       HIS 132  31.284  12.627 -10.385
  989   1HB   HIS 132          2HB       HIS 132  31.410  15.109 -11.226
  990   2HB   HIS 132          1HB       HIS 132  29.854  15.275 -10.413
  991    HD2  HIS 132           HD2      HIS 132  33.421  13.846  -9.298
  992    HE1  HIS 132           HE1      HIS 132  31.609  15.819  -6.033
  993    HE2  HIS 132           HE2      HIS 132  33.678  14.573  -6.806
  Start of MODEL    4
    1   1H    MET   1          1H        MET   1 -20.399   8.290  -3.416
    2   2H    MET   1          2H        MET   1 -19.922   7.860  -1.843
    3   3H    MET   1          3H        MET   1 -21.233   8.914  -2.079
    4    HA   MET   1           HA       MET   1 -21.447   6.259  -1.663
    5   1HB   MET   1          2HB       MET   1 -23.213   8.337  -2.938
    6   2HB   MET   1          1HB       MET   1 -23.774   6.670  -2.796
    7   1HG   MET   1          2HG       MET   1 -24.517   7.844  -0.826
    8   2HG   MET   1          1HG       MET   1 -23.198   6.780  -0.336
    9   1HE   MET   1          1HE       MET   1 -24.021  10.537  -1.491
   10   2HE   MET   1          2HE       MET   1 -23.604  11.192   0.091
   11   3HE   MET   1          3HE       MET   1 -24.777   9.882  -0.031
   12    H    SER   2           H        SER   2 -19.850   5.244  -3.140
   13    HA   SER   2           HA       SER   2 -20.265   5.263  -5.998
   14   1HB   SER   2          2HB       SER   2 -18.855   3.039  -5.722
   15   2HB   SER   2          1HB       SER   2 -18.104   4.610  -5.457
   16    HG   SER   2           HG       SER   2 -19.360   3.696  -3.234
   17    H    HIS   3           H        HIS   3 -20.580   2.443  -3.815
   18    HA   HIS   3           HA       HIS   3 -23.259   1.863  -4.867
   19   1HB   HIS   3          2HB       HIS   3 -22.500  -0.456  -5.622
   20   2HB   HIS   3          1HB       HIS   3 -22.017   0.883  -6.664
   21    HD2  HIS   3           HD2      HIS   3 -20.093  -1.847  -6.501
   22    HE1  HIS   3           HE1      HIS   3 -17.474   0.652  -4.325
   23    HE2  HIS   3           HE2      HIS   3 -17.657  -1.516  -5.628
   24    H    GLN   4           H        GLN   4 -23.668  -0.653  -4.031
   25    HA   GLN   4           HA       GLN   4 -24.086  -1.897  -2.084
   26   1HB   GLN   4          2HB       GLN   4 -21.266  -0.947  -1.489
   27   2HB   GLN   4          1HB       GLN   4 -22.109  -2.206  -0.587
   28   1HG   GLN   4          2HG       GLN   4 -22.461  -3.094  -3.141
   29   2HG   GLN   4          1HG       GLN   4 -20.885  -2.313  -3.278
   30   1HE2  GLN   4          1HE2      GLN   4 -20.795  -5.030  -3.556
   31   2HE2  GLN   4          2HE2      GLN   4 -20.194  -5.775  -2.154
   32    H    ASP   5           H        ASP   5 -21.962   0.318  -0.368
   33    HA   ASP   5           HA       ASP   5 -23.738   2.295   0.492
   34   1HB   ASP   5          2HB       ASP   5 -24.411  -0.310   1.569
   35   2HB   ASP   5          1HB       ASP   5 -23.967   0.796   2.870
   36    H    ASP   6           H        ASP   6 -21.144   0.087   1.275
   37    HA   ASP   6           HA       ASP   6 -20.046   1.274   3.571
   38   1HB   ASP   6          2HB       ASP   6 -18.458   0.254   1.196
   39   2HB   ASP   6          1HB       ASP   6 -17.914   0.350   2.871
   40    H    TYR   7           H        TYR   7 -19.566   3.388   3.892
   41    HA   TYR   7           HA       TYR   7 -18.881   5.080   1.552
   42   1HB   TYR   7          2HB       TYR   7 -20.561   6.036   2.981
   43   2HB   TYR   7          1HB       TYR   7 -19.598   5.719   4.424
   44    HD1  TYR   7           HD1      TYR   7 -18.124   7.353   5.240
   45    HD2  TYR   7           HD2      TYR   7 -19.505   7.585   1.179
   46    HE1  TYR   7           HE1      TYR   7 -17.019   9.560   4.990
   47    HE2  TYR   7           HE2      TYR   7 -18.400   9.792   0.930
   48    HH   TYR   7           HH       TYR   7 -16.481  11.196   3.582
   49    H    LEU   8           H        LEU   8 -16.755   5.328   1.089
   50    HA   LEU   8           HA       LEU   8 -14.755   4.855   3.232
   51   1HB   LEU   8          2HB       LEU   8 -14.755   4.754   0.258
   52   2HB   LEU   8          1HB       LEU   8 -13.255   5.272   1.026
   53    HG   LEU   8           HG       LEU   8 -14.673   2.848   2.081
   54   1HD1  LEU   8          1HD1      LEU   8 -12.897   2.966  -0.373
   55   2HD1  LEU   8          2HD1      LEU   8 -14.564   2.394  -0.298
   56   3HD1  LEU   8          3HD1      LEU   8 -13.282   1.479   0.494
   57   1HD2  LEU   8          1HD2      LEU   8 -12.263   2.205   2.497
   58   2HD2  LEU   8          2HD2      LEU   8 -12.781   3.663   3.345
   59   3HD2  LEU   8          3HD2      LEU   8 -11.800   3.793   1.885
   60    H    SER   9           H        SER   9 -13.210   6.448   3.793
   61    HA   SER   9           HA       SER   9 -14.104   9.210   3.353
   62   1HB   SER   9          2HB       SER   9 -11.887   7.963   4.987
   63   2HB   SER   9          1HB       SER   9 -12.068   9.709   4.829
   64    HG   SER   9           HG       SER   9 -13.188   8.457   6.632
   65    H    VAL  10           H        VAL  10 -13.662   9.078   0.970
   66    HA   VAL  10           HA       VAL  10 -11.307   8.614  -0.355
   67    HB   VAL  10           HB       VAL  10 -11.887  10.780  -1.698
   68   1HG1  VAL  10          1HG1      VAL  10 -13.636   8.351  -1.330
   69   2HG1  VAL  10          2HG1      VAL  10 -12.518   8.714  -2.645
   70   3HG1  VAL  10          3HG1      VAL  10 -14.044   9.588  -2.519
   71   1HG2  VAL  10          1HG2      VAL  10 -13.431  11.231   0.577
   72   2HG2  VAL  10          2HG2      VAL  10 -14.602  10.666  -0.615
   73   3HG2  VAL  10          3HG2      VAL  10 -13.596  12.072  -0.964
   74    H    GLU  11           H        GLU  11 -11.785  10.948   2.136
   75    HA   GLU  11           HA       GLU  11  -9.537  12.655   1.425
   76   1HB   GLU  11          2HB       GLU  11 -11.659  12.954   3.102
   77   2HB   GLU  11          1HB       GLU  11 -10.395  12.533   4.258
   78   1HG   GLU  11          2HG       GLU  11  -8.949  14.301   3.121
   79   2HG   GLU  11          1HG       GLU  11 -10.411  14.827   2.287
   80    H    GLU  12           H        GLU  12 -10.030  10.264   4.059
   81    HA   GLU  12           HA       GLU  12  -7.464  10.241   5.123
   82   1HB   GLU  12          2HB       GLU  12  -8.219   8.440   6.263
   83   2HB   GLU  12          1HB       GLU  12  -9.718   8.630   5.359
   84   1HG   GLU  12          2HG       GLU  12  -8.834   7.121   3.600
   85   2HG   GLU  12          1HG       GLU  12  -7.357   6.906   4.541
   86    H    LEU  13           H        LEU  13  -8.578   8.478   2.228
   87    HA   LEU  13           HA       LEU  13  -6.169   7.111   1.650
   88   1HB   LEU  13          2HB       LEU  13  -8.067   8.329  -0.378
   89   2HB   LEU  13          1HB       LEU  13  -6.976   6.968  -0.639
   90    HG   LEU  13           HG       LEU  13  -9.278   7.016   1.336
   91   1HD1  LEU  13          1HD1      LEU  13  -9.418   6.738  -1.400
   92   2HD1  LEU  13          2HD1      LEU  13 -10.584   6.068  -0.260
   93   3HD1  LEU  13          3HD1      LEU  13  -9.267   5.064  -0.867
   94   1HD2  LEU  13          1HD2      LEU  13  -8.716   4.490   1.315
   95   2HD2  LEU  13          2HD2      LEU  13  -7.632   5.552   2.214
   96   3HD2  LEU  13          3HD2      LEU  13  -7.171   4.974   0.612
   97    H    ILE  14           H        ILE  14  -7.181  10.418   0.823
   98    HA   ILE  14           HA       ILE  14  -4.850  11.038  -0.747
   99    HB   ILE  14           HB       ILE  14  -6.929  12.691   0.680
  100   1HG1  ILE  14          2HG1      ILE  14  -6.164  12.721  -2.237
  101   2HG1  ILE  14          1HG1      ILE  14  -7.220  11.460  -1.596
  102   1HG2  ILE  14          1HG2      ILE  14  -5.108  14.141   0.931
  103   2HG2  ILE  14          2HG2      ILE  14  -5.742  14.618  -0.643
  104   3HG2  ILE  14          3HG2      ILE  14  -4.326  13.571  -0.543
  105   1HD1  ILE  14          1HD1      ILE  14  -8.129  13.857  -2.506
  106   2HD1  ILE  14          2HD1      ILE  14  -7.915  14.227  -0.795
  107   3HD1  ILE  14          3HD1      ILE  14  -8.966  12.898  -1.286
  108    H    GLU  15           H        GLU  15  -5.660  11.508   2.691
  109    HA   GLU  15           HA       GLU  15  -3.324  12.926   3.448
  110   1HB   GLU  15          2HB       GLU  15  -5.498  11.581   4.769
  111   2HB   GLU  15          1HB       GLU  15  -3.985  11.137   5.559
  112   1HG   GLU  15          2HG       GLU  15  -3.391  13.548   5.720
  113   2HG   GLU  15          1HG       GLU  15  -4.953  13.958   5.008
  114    H    ILE  16           H        ILE  16  -3.928   9.395   3.546
  115    HA   ILE  16           HA       ILE  16  -1.335   8.622   4.382
  116    HB   ILE  16           HB       ILE  16  -3.158   7.130   2.469
  117   1HG1  ILE  16          2HG1      ILE  16  -3.031   7.063   5.503
  118   2HG1  ILE  16          1HG1      ILE  16  -4.304   7.844   4.563
  119   1HG2  ILE  16          1HG2      ILE  16  -0.767   6.325   2.751
  120   2HG2  ILE  16          2HG2      ILE  16  -2.003   5.155   3.215
  121   3HG2  ILE  16          3HG2      ILE  16  -1.135   6.061   4.456
  122   1HD1  ILE  16          1HD1      ILE  16  -5.161   5.690   5.119
  123   2HD1  ILE  16          2HD1      ILE  16  -3.641   4.897   4.703
  124   3HD1  ILE  16          3HD1      ILE  16  -4.658   5.575   3.431
  125    H    GLN  17           H        GLN  17  -2.583   8.572   1.019
  126    HA   GLN  17           HA       GLN  17  -0.184   8.060  -0.307
  127   1HB   GLN  17          2HB       GLN  17  -2.643   9.614  -1.025
  128   2HB   GLN  17          1HB       GLN  17  -1.246   9.708  -2.098
  129   1HG   GLN  17          2HG       GLN  17  -2.264   7.043  -1.128
  130   2HG   GLN  17          1HG       GLN  17  -2.991   7.832  -2.529
  131   1HE2  GLN  17          1HE2      GLN  17  -0.641   5.610  -1.738
  132   2HE2  GLN  17          2HE2      GLN  17   0.389   5.805  -3.072
  133    H    LYS  18           H        LYS  18  -1.331  11.128   1.032
  134    HA   LYS  18           HA       LYS  18   0.608  12.854  -0.108
  135   1HB   LYS  18          2HB       LYS  18  -1.467  13.264   1.540
  136   2HB   LYS  18          1HB       LYS  18  -0.174  13.279   2.741
  137   1HG   LYS  18          2HG       LYS  18   1.032  14.979   1.371
  138   2HG   LYS  18          1HG       LYS  18  -0.336  15.013   0.257
  139   1HD   LYS  18          2HD       LYS  18  -0.883  15.415   3.171
  140   2HD   LYS  18          1HD       LYS  18  -0.166  16.749   2.265
  141   1HE   LYS  18          2HE       LYS  18  -2.635  15.271   1.327
  142   2HE   LYS  18          1HE       LYS  18  -2.710  16.723   2.325
  143   1HZ   LYS  18          1HZ       LYS  18  -1.955  18.032   0.651
  144   2HZ   LYS  18          2HZ       LYS  18  -2.719  16.841  -0.289
  145   3HZ   LYS  18          3HZ       LYS  18  -1.035  16.802  -0.067
  146    H    GLU  19           H        GLU  19   0.724  11.113   3.019
  147    HA   GLU  19           HA       GLU  19   3.396  11.910   3.666
  148   1HB   GLU  19          2HB       GLU  19   1.445  10.596   5.011
  149   2HB   GLU  19          1HB       GLU  19   2.481   9.236   4.578
  150   1HG   GLU  19          2HG       GLU  19   3.492   9.886   6.556
  151   2HG   GLU  19          1HG       GLU  19   4.399  10.877   5.413
  152    H    GLU  20           H        GLU  20   2.264   8.716   2.490
  153    HA   GLU  20           HA       GLU  20   4.604   7.400   2.027
  154   1HB   GLU  20          2HB       GLU  20   1.999   7.429   0.733
  155   2HB   GLU  20          1HB       GLU  20   3.280   7.055  -0.421
  156   1HG   GLU  20          2HG       GLU  20   2.492   4.985   0.608
  157   2HG   GLU  20          1HG       GLU  20   4.138   5.316   1.146
  158    H    THR  21           H        THR  21   3.244   9.298  -0.682
  159    HA   THR  21           HA       THR  21   5.477   9.441  -2.292
  160    HB   THR  21           HB       THR  21   3.665  11.803  -1.720
  161    HG1  THR  21           HG1      THR  21   2.569   9.823  -2.224
  162   1HG2  THR  21          1HG2      THR  21   5.187  12.710  -3.167
  163   2HG2  THR  21          2HG2      THR  21   4.197  11.876  -4.364
  164   3HG2  THR  21          3HG2      THR  21   5.690  11.136  -3.785
  165    H    ARG  22           H        ARG  22   4.751  11.757   0.347
  166    HA   ARG  22           HA       ARG  22   6.996  13.387   0.167
  167   1HB   ARG  22          2HB       ARG  22   5.006  13.232   1.949
  168   2HB   ARG  22          1HB       ARG  22   6.264  12.442   2.901
  169   1HG   ARG  22          2HG       ARG  22   7.767  14.411   2.324
  170   2HG   ARG  22          1HG       ARG  22   6.326  15.217   1.699
  171   1HD   ARG  22          2HD       ARG  22   5.522  14.258   4.182
  172   2HD   ARG  22          1HD       ARG  22   7.171  14.809   4.469
  173    HE   ARG  22           HE       ARG  22   5.008  16.543   4.331
  174   1HH1  ARG  22          1HH2      ARG  22   7.894  16.036   2.499
  175   2HH1  ARG  22          2HH2      ARG  22   7.970  17.669   1.931
  176   1HH2  ARG  22          2HH1      ARG  22   5.108  18.670   3.603
  177   2HH2  ARG  22          1HH1      ARG  22   6.399  19.158   2.556
  178    H    ASP  23           H        ASP  23   6.827  10.394   2.141
  179    HA   ASP  23           HA       ASP  23   9.534  10.328   2.910
  180   1HB   ASP  23          2HB       ASP  23   9.138   8.157   3.614
  181   2HB   ASP  23          1HB       ASP  23   7.479   8.737   3.469
  182    H    ILE  24           H        ILE  24   8.035   9.441  -0.141
  183    HA   ILE  24           HA       ILE  24  10.409   8.135  -1.207
  184    HB   ILE  24           HB       ILE  24   8.027   9.302  -2.680
  185   1HG1  ILE  24          2HG1      ILE  24   8.529   6.521  -1.572
  186   2HG1  ILE  24          1HG1      ILE  24   7.309   7.662  -1.005
  187   1HG2  ILE  24          1HG2      ILE  24  10.382   8.480  -3.751
  188   2HG2  ILE  24          2HG2      ILE  24   8.831   8.300  -4.571
  189   3HG2  ILE  24          3HG2      ILE  24   9.521   6.943  -3.680
  190   1HD1  ILE  24          1HD1      ILE  24   6.069   6.299  -2.449
  191   2HD1  ILE  24          2HD1      ILE  24   7.402   6.130  -3.591
  192   3HD1  ILE  24          3HD1      ILE  24   6.508   7.647  -3.498
  193    H    ILE  25           H        ILE  25   8.771  11.067  -2.437
  194    HA   ILE  25           HA       ILE  25  10.833  12.150  -3.915
  195    HB   ILE  25           HB       ILE  25   9.201  13.880  -2.047
  196   1HG1  ILE  25          2HG1      ILE  25   7.614  12.316  -2.967
  197   2HG1  ILE  25          1HG1      ILE  25   7.467  13.804  -3.903
  198   1HG2  ILE  25          1HG2      ILE  25   9.328  14.794  -4.747
  199   2HG2  ILE  25          2HG2      ILE  25  10.960  14.334  -4.264
  200   3HG2  ILE  25          3HG2      ILE  25  10.064  15.523  -3.320
  201   1HD1  ILE  25          1HD1      ILE  25   8.673  11.177  -4.698
  202   2HD1  ILE  25          2HD1      ILE  25   9.295  12.657  -5.429
  203   3HD1  ILE  25          3HD1      ILE  25   7.592  12.231  -5.610
  204    H    GLN  26           H        GLN  26  10.596  11.988  -0.419
  205    HA   GLN  26           HA       GLN  26  12.781  13.829   0.092
  206   1HB   GLN  26          2HB       GLN  26  11.370  13.551   1.945
  207   2HB   GLN  26          1HB       GLN  26  11.275  11.803   1.730
  208   1HG   GLN  26          2HG       GLN  26  12.731  12.598   3.667
  209   2HG   GLN  26          1HG       GLN  26  13.504  11.488   2.536
  210   1HE2  GLN  26          1HE2      GLN  26  15.582  12.167   2.023
  211   2HE2  GLN  26          2HE2      GLN  26  16.076  13.784   1.878
  212    H    ALA  27           H        ALA  27  12.504  10.263   0.071
  213    HA   ALA  27           HA       ALA  27  15.296   9.802   0.573
  214   1HB   ALA  27          1HB       ALA  27  13.668   8.025   0.932
  215   2HB   ALA  27          2HB       ALA  27  14.815   7.505  -0.302
  216   3HB   ALA  27          3HB       ALA  27  13.208   8.059  -0.770
  217    H    LEU  28           H        LEU  28  13.443  10.462  -2.332
  218    HA   LEU  28           HA       LEU  28  15.501   9.638  -4.195
  219   1HB   LEU  28          2HB       LEU  28  13.101  11.467  -4.459
  220   2HB   LEU  28          1HB       LEU  28  14.170  11.083  -5.809
  221    HG   LEU  28           HG       LEU  28  12.673   9.039  -4.143
  222   1HD1  LEU  28          1HD1      LEU  28  11.199   8.788  -6.016
  223   2HD1  LEU  28          2HD1      LEU  28  12.204   9.824  -7.029
  224   3HD1  LEU  28          3HD1      LEU  28  11.291  10.520  -5.690
  225   1HD2  LEU  28          1HD2      LEU  28  13.450   7.834  -6.480
  226   2HD2  LEU  28          2HD2      LEU  28  14.338   7.717  -4.960
  227   3HD2  LEU  28          3HD2      LEU  28  14.815   8.908  -6.172
  228    H    LEU  29           H        LEU  29  14.348  12.924  -3.331
  229    HA   LEU  29           HA       LEU  29  16.446  14.363  -4.523
  230   1HB   LEU  29          2HB       LEU  29  14.493  14.862  -2.360
  231   2HB   LEU  29          1HB       LEU  29  15.950  15.853  -2.279
  232    HG   LEU  29           HG       LEU  29  14.664  15.554  -4.952
  233   1HD1  LEU  29          1HD1      LEU  29  13.552  17.326  -2.755
  234   2HD1  LEU  29          2HD1      LEU  29  12.735  15.931  -3.458
  235   3HD1  LEU  29          3HD1      LEU  29  13.056  17.356  -4.447
  236   1HD2  LEU  29          1HD2      LEU  29  16.758  16.873  -4.500
  237   2HD2  LEU  29          2HD2      LEU  29  15.808  17.939  -3.466
  238   3HD2  LEU  29          3HD2      LEU  29  15.455  17.843  -5.190
  239    H    GLU  30           H        GLU  30  16.402  12.554  -1.515
  240    HA   GLU  30           HA       GLU  30  18.947  13.636  -0.575
  241   1HB   GLU  30          2HB       GLU  30  17.569  12.855   1.170
  242   2HB   GLU  30          1HB       GLU  30  17.141  11.385   0.295
  243   1HG   GLU  30          2HG       GLU  30  20.021  11.853   0.970
  244   2HG   GLU  30          1HG       GLU  30  18.934  11.321   2.252
  245    H    ASP  31           H        ASP  31  17.861  10.811  -2.393
  246    HA   ASP  31           HA       ASP  31  20.376   9.406  -2.313
  247   1HB   ASP  31          2HB       ASP  31  17.837   9.215  -3.845
  248   2HB   ASP  31          1HB       ASP  31  19.263   8.523  -4.618
  249    H    GLY  32           H        GLY  32  19.084  11.980  -4.318
  250   1HA   GLY  32          2HA       GLY  32  21.064  13.373  -5.244
  251   2HA   GLY  32          1HA       GLY  32  21.542  11.858  -6.010
  252    H    SER  33           H        SER  33  18.203  11.977  -5.878
  253    HA   SER  33           HA       SER  33  17.669  11.900  -8.574
  254   1HB   SER  33          2HB       SER  33  16.146  12.742  -6.201
  255   2HB   SER  33          1HB       SER  33  15.563  13.449  -7.706
  256    HG   SER  33           HG       SER  33  16.122  10.689  -7.340
  257    H    ASP  34           H        ASP  34  16.764  13.639 -10.042
  258    HA   ASP  34           HA       ASP  34  17.859  16.345  -9.472
  259   1HB   ASP  34          2HB       ASP  34  19.287  14.600 -11.024
  260   2HB   ASP  34          1HB       ASP  34  18.302  15.416 -12.238
  261    HA   PRO  35           HA       PRO  35  13.539  16.688 -10.997
  262   1HB   PRO  35          2HB       PRO  35  14.092  19.489 -10.151
  263   2HB   PRO  35          1HB       PRO  35  12.713  18.444  -9.760
  264   1HG   PRO  35          2HG       PRO  35  14.624  18.988  -7.974
  265   2HG   PRO  35          1HG       PRO  35  13.806  17.416  -8.033
  266   1HD   PRO  35          2HD       PRO  35  16.566  18.136  -8.916
  267   2HD   PRO  35          1HD       PRO  35  15.952  16.600  -8.267
  268    H    ASP  36           H        ASP  36  16.482  18.212 -11.931
  269    HA   ASP  36           HA       ASP  36  15.258  19.766 -14.114
  270   1HB   ASP  36          2HB       ASP  36  17.715  19.848 -12.692
  271   2HB   ASP  36          1HB       ASP  36  18.114  19.496 -14.373
  272    H    ALA  37           H        ALA  37  15.220  16.695 -13.889
  273    HA   ALA  37           HA       ALA  37  16.216  16.216 -16.664
  274   1HB   ALA  37          1HB       ALA  37  16.836  14.756 -14.164
  275   2HB   ALA  37          2HB       ALA  37  17.766  14.877 -15.657
  276   3HB   ALA  37          3HB       ALA  37  16.421  13.742 -15.545
  277    H    LEU  38           H        LEU  38  13.547  16.538 -14.881
  278    HA   LEU  38           HA       LEU  38  11.334  15.806 -15.137
  279   1HB   LEU  38          2HB       LEU  38  12.646  15.340 -17.728
  280   2HB   LEU  38          1HB       LEU  38  11.245  14.306 -17.445
  281    HG   LEU  38           HG       LEU  38  11.081  17.251 -16.858
  282   1HD1  LEU  38          1HD1      LEU  38  10.474  17.752 -19.104
  283   2HD1  LEU  38          2HD1      LEU  38  10.388  16.045 -19.543
  284   3HD1  LEU  38          3HD1      LEU  38  11.952  16.799 -19.232
  285   1HD2  LEU  38          1HD2      LEU  38   8.709  16.858 -17.276
  286   2HD2  LEU  38          2HD2      LEU  38   9.294  15.651 -16.131
  287   3HD2  LEU  38          3HD2      LEU  38   9.046  15.215 -17.822
  288    H    TYR  39           H        TYR  39  10.013  13.850 -14.957
  289    HA   TYR  39           HA       TYR  39  11.568  11.334 -14.591
  290   1HB   TYR  39          2HB       TYR  39  10.213  12.914 -12.521
  291   2HB   TYR  39          1HB       TYR  39   9.685  11.233 -12.564
  292    HD1  TYR  39           HD1      TYR  39  12.675  13.434 -12.319
  293    HD2  TYR  39           HD2      TYR  39  11.108   9.464 -11.835
  294    HE1  TYR  39           HE1      TYR  39  14.773  12.743 -11.192
  295    HE2  TYR  39           HE2      TYR  39  13.207   8.774 -10.709
  296    HH   TYR  39           HH       TYR  39  15.346   9.371 -10.287
  297    H    GLU  40           H        GLU  40  10.098   9.413 -14.522
  298    HA   GLU  40           HA       GLU  40   7.636   9.925 -16.138
  299   1HB   GLU  40          2HB       GLU  40   9.769   7.870 -16.274
  300   2HB   GLU  40          1HB       GLU  40   8.124   7.274 -16.502
  301   1HG   GLU  40          2HG       GLU  40   7.778   8.555 -18.416
  302   2HG   GLU  40          1HG       GLU  40   8.999   9.745 -17.964
  303    H    ILE  41           H        ILE  41   5.887   9.812 -14.813
  304    HA   ILE  41           HA       ILE  41   5.929   8.159 -12.391
  305    HB   ILE  41           HB       ILE  41   3.497   9.539 -13.519
  306   1HG1  ILE  41          2HG1      ILE  41   5.274  11.194 -13.663
  307   2HG1  ILE  41          1HG1      ILE  41   4.258  11.580 -12.273
  308   1HG2  ILE  41          1HG2      ILE  41   4.479   8.626 -10.833
  309   2HG2  ILE  41          2HG2      ILE  41   2.896   8.408 -11.576
  310   3HG2  ILE  41          3HG2      ILE  41   3.354   9.981 -10.922
  311   1HD1  ILE  41          1HD1      ILE  41   6.548  11.772 -11.551
  312   2HD1  ILE  41          2HD1      ILE  41   6.958  10.205 -12.248
  313   3HD1  ILE  41          3HD1      ILE  41   5.902  10.295 -10.838
  314    H    GLU  42           H        GLU  42   4.422   6.414 -12.008
  315    HA   GLU  42           HA       GLU  42   3.161   5.269 -14.457
  316   1HB   GLU  42          2HB       GLU  42   5.460   4.230 -13.765
  317   2HB   GLU  42          1HB       GLU  42   4.539   3.492 -12.454
  318   1HG   GLU  42          2HG       GLU  42   4.082   3.175 -15.430
  319   2HG   GLU  42          1HG       GLU  42   4.524   1.921 -14.271
  320    H    HIS  43           H        HIS  43   1.024   5.457 -13.869
  321    HA   HIS  43           HA       HIS  43   0.260   4.734 -11.086
  322   1HB   HIS  43          2HB       HIS  43  -1.582   5.856 -13.199
  323   2HB   HIS  43          1HB       HIS  43  -1.754   5.929 -11.446
  324    HD2  HIS  43           HD2      HIS  43   0.521   7.610 -14.233
  325    HE1  HIS  43           HE1      HIS  43   0.696   9.955 -10.725
  326    HE2  HIS  43           HE2      HIS  43   1.408   9.814 -13.155
  327    H    HIS  44           H        HIS  44  -1.259   3.079 -10.688
  328    HA   HIS  44           HA       HIS  44  -1.835   1.314 -13.035
  329   1HB   HIS  44          2HB       HIS  44  -0.975   0.703 -10.226
  330   2HB   HIS  44          1HB       HIS  44  -1.994  -0.458 -11.078
  331    HD2  HIS  44           HD2      HIS  44  -0.636  -0.298 -14.067
  332    HE1  HIS  44           HE1      HIS  44   3.002  -1.144 -12.093
  333    HE2  HIS  44           HE2      HIS  44   1.826  -1.113 -14.342
  334    H    LEU  45           H        LEU  45  -3.977   0.868 -13.386
  335    HA   LEU  45           HA       LEU  45  -5.893   1.426 -11.165
  336   1HB   LEU  45          2HB       LEU  45  -6.126   2.313 -14.054
  337   2HB   LEU  45          1HB       LEU  45  -7.438   2.408 -12.879
  338    HG   LEU  45           HG       LEU  45  -5.294   3.576 -11.551
  339   1HD1  LEU  45          1HD1      LEU  45  -4.450   5.269 -13.150
  340   2HD1  LEU  45          2HD1      LEU  45  -5.338   4.474 -14.449
  341   3HD1  LEU  45          3HD1      LEU  45  -4.007   3.637 -13.649
  342   1HD2  LEU  45          1HD2      LEU  45  -7.724   4.262 -11.666
  343   2HD2  LEU  45          2HD2      LEU  45  -7.375   5.014 -13.223
  344   3HD2  LEU  45          3HD2      LEU  45  -6.589   5.609 -11.761
  345    H    PHE  46           H        PHE  46  -7.795   0.125 -11.209
  346    HA   PHE  46           HA       PHE  46  -7.862  -2.013 -13.283
  347   1HB   PHE  46          2HB       PHE  46  -8.723  -3.224 -10.901
  348   2HB   PHE  46          1HB       PHE  46  -7.210  -3.533 -11.753
  349    HD1  PHE  46           HD1      PHE  46  -8.656  -2.373  -8.722
  350    HD2  PHE  46           HD2      PHE  46  -5.268  -1.818 -11.304
  351    HE1  PHE  46           HE1      PHE  46  -7.388  -1.369  -6.842
  352    HE2  PHE  46           HE2      PHE  46  -4.000  -0.815  -9.424
  353    HZ   PHE  46           HZ       PHE  46  -5.060  -0.590  -7.193
  354    H    ALA  47           H        ALA  47  -9.998  -3.046 -13.453
  355    HA   ALA  47           HA       ALA  47 -12.235  -1.696 -12.079
  356   1HB   ALA  47          1HB       ALA  47 -12.607  -1.799 -15.007
  357   2HB   ALA  47          2HB       ALA  47 -11.411  -0.625 -14.459
  358   3HB   ALA  47          3HB       ALA  47 -13.068  -0.543 -13.858
  359    H    GLU  48           H        GLU  48 -14.382  -2.683 -13.177
  360    HA   GLU  48           HA       GLU  48 -13.874  -5.620 -13.454
  361   1HB   GLU  48          2HB       GLU  48 -15.694  -4.090 -11.764
  362   2HB   GLU  48          1HB       GLU  48 -16.550  -5.290 -12.734
  363   1HG   GLU  48          2HG       GLU  48 -14.116  -5.862 -11.018
  364   2HG   GLU  48          1HG       GLU  48 -15.782  -6.228 -10.565
  365    H    ASP  49           H        ASP  49 -15.780  -2.861 -14.595
  366    HA   ASP  49           HA       ASP  49 -16.766  -4.560 -16.845
  367   1HB   ASP  49          2HB       ASP  49 -18.279  -3.055 -15.224
  368   2HB   ASP  49          1HB       ASP  49 -17.830  -1.808 -16.388
  369    H    PHE  50           H        PHE  50 -15.537  -4.341 -18.647
  370    HA   PHE  50           HA       PHE  50 -13.564  -2.392 -19.106
  371   1HB   PHE  50          2HB       PHE  50 -13.861  -4.508 -20.421
  372   2HB   PHE  50          1HB       PHE  50 -15.234  -3.760 -21.237
  373    HD1  PHE  50           HD1      PHE  50 -14.830  -2.708 -23.270
  374    HD2  PHE  50           HD2      PHE  50 -11.669  -2.938 -20.370
  375    HE1  PHE  50           HE1      PHE  50 -13.286  -1.602 -24.864
  376    HE2  PHE  50           HE2      PHE  50 -10.126  -1.832 -21.965
  377    HZ   PHE  50           HZ       PHE  50 -10.935  -1.164 -24.213
  378    H    ASP  51           H        ASP  51 -16.939  -1.987 -19.097
  379    HA   ASP  51           HA       ASP  51 -17.203   0.067 -21.094
  380   1HB   ASP  51          2HB       ASP  51 -19.076  -1.251 -19.929
  381   2HB   ASP  51          1HB       ASP  51 -18.868  -0.136 -18.579
  382    H    LYS  52           H        LYS  52 -17.463   0.566 -17.563
  383    HA   LYS  52           HA       LYS  52 -16.877   3.338 -17.650
  384   1HB   LYS  52          2HB       LYS  52 -16.503   3.174 -15.254
  385   2HB   LYS  52          1HB       LYS  52 -17.839   2.106 -15.682
  386   1HG   LYS  52          2HG       LYS  52 -16.199   0.208 -15.818
  387   2HG   LYS  52          1HG       LYS  52 -14.957   1.300 -15.204
  388   1HD   LYS  52          2HD       LYS  52 -15.907   1.421 -13.092
  389   2HD   LYS  52          1HD       LYS  52 -17.529   1.069 -13.688
  390   1HE   LYS  52          2HE       LYS  52 -17.241  -1.170 -13.481
  391   2HE   LYS  52          1HE       LYS  52 -15.614  -1.109 -14.157
  392   1HZ   LYS  52          1HZ       LYS  52 -16.142  -0.080 -11.448
  393   2HZ   LYS  52          2HZ       LYS  52 -14.684  -0.643 -12.113
  394   3HZ   LYS  52          3HZ       LYS  52 -15.914  -1.741 -11.699
  395    H    LEU  53           H        LEU  53 -14.732   0.536 -17.377
  396    HA   LEU  53           HA       LEU  53 -12.324   1.896 -16.754
  397   1HB   LEU  53          2HB       LEU  53 -12.735  -0.627 -16.862
  398   2HB   LEU  53          1HB       LEU  53 -12.504  -0.489 -18.603
  399    HG   LEU  53           HG       LEU  53 -10.479   0.581 -16.632
  400   1HD1  LEU  53          1HD1      LEU  53  -9.217  -1.523 -17.023
  401   2HD1  LEU  53          2HD1      LEU  53 -10.597  -2.166 -17.914
  402   3HD1  LEU  53          3HD1      LEU  53 -10.745  -1.817 -16.192
  403   1HD2  LEU  53          1HD2      LEU  53  -9.062  -0.032 -18.782
  404   2HD2  LEU  53          2HD2      LEU  53  -9.985   1.471 -18.729
  405   3HD2  LEU  53          3HD2      LEU  53 -10.627   0.071 -19.588
  406    H    GLU  54           H        GLU  54 -13.585   0.980 -19.981
  407    HA   GLU  54           HA       GLU  54 -11.553   2.181 -21.524
  408   1HB   GLU  54          2HB       GLU  54 -13.495   0.724 -22.328
  409   2HB   GLU  54          1HB       GLU  54 -14.477   2.190 -22.299
  410   1HG   GLU  54          2HG       GLU  54 -13.285   3.188 -24.030
  411   2HG   GLU  54          1HG       GLU  54 -11.831   2.241 -23.712
  412    H    LYS  55           H        LYS  55 -14.719   3.634 -20.665
  413    HA   LYS  55           HA       LYS  55 -14.297   6.189 -21.714
  414   1HB   LYS  55          2HB       LYS  55 -16.330   5.145 -20.394
  415   2HB   LYS  55          1HB       LYS  55 -15.570   5.933 -19.011
  416   1HG   LYS  55          2HG       LYS  55 -16.808   7.726 -19.712
  417   2HG   LYS  55          1HG       LYS  55 -15.450   7.950 -20.815
  418   1HD   LYS  55          2HD       LYS  55 -16.640   6.586 -22.520
  419   2HD   LYS  55          1HD       LYS  55 -18.015   6.450 -21.423
  420   1HE   LYS  55          2HE       LYS  55 -18.603   8.269 -22.799
  421   2HE   LYS  55          1HE       LYS  55 -17.938   9.048 -21.361
  422   1HZ   LYS  55          1HZ       LYS  55 -16.680   8.671 -24.005
  423   2HZ   LYS  55          2HZ       LYS  55 -15.734   8.941 -22.619
  424   3HZ   LYS  55          3HZ       LYS  55 -16.872  10.102 -23.114
  425    H    ALA  56           H        ALA  56 -13.660   5.279 -18.303
  426    HA   ALA  56           HA       ALA  56 -12.360   7.646 -17.534
  427   1HB   ALA  56          1HB       ALA  56 -11.096   5.246 -16.425
  428   2HB   ALA  56          2HB       ALA  56 -12.857   5.189 -16.357
  429   3HB   ALA  56          3HB       ALA  56 -11.989   6.526 -15.603
  430    H    ALA  57           H        ALA  57 -11.042   4.849 -19.265
  431    HA   ALA  57           HA       ALA  57  -8.290   5.584 -19.101
  432   1HB   ALA  57          1HB       ALA  57  -9.927   3.874 -20.929
  433   2HB   ALA  57          2HB       ALA  57  -8.547   3.435 -19.924
  434   3HB   ALA  57          3HB       ALA  57  -8.295   4.308 -21.436
  435    H    VAL  58           H        VAL  58 -10.790   6.412 -21.507
  436    HA   VAL  58           HA       VAL  58  -9.077   7.871 -23.260
  437    HB   VAL  58           HB       VAL  58 -11.993   8.482 -22.725
  438   1HG1  VAL  58          1HG1      VAL  58 -12.003   9.275 -24.992
  439   2HG1  VAL  58          2HG1      VAL  58 -10.393   8.623 -25.292
  440   3HG1  VAL  58          3HG1      VAL  58 -10.599  10.000 -24.209
  441   1HG2  VAL  58          1HG2      VAL  58 -12.499   6.407 -23.448
  442   2HG2  VAL  58          2HG2      VAL  58 -10.785   6.025 -23.610
  443   3HG2  VAL  58          3HG2      VAL  58 -11.659   6.748 -24.961
  444    H    GLU  59           H        GLU  59 -11.142   9.027 -20.573
  445    HA   GLU  59           HA       GLU  59 -10.489  11.770 -20.772
  446   1HB   GLU  59          2HB       GLU  59 -11.937  10.164 -18.993
  447   2HB   GLU  59          1HB       GLU  59 -10.683  10.906 -17.999
  448   1HG   GLU  59          2HG       GLU  59 -12.407  12.506 -17.948
  449   2HG   GLU  59          1HG       GLU  59 -11.343  13.110 -19.219
  450    H    ALA  60           H        ALA  60  -8.693   9.103 -19.311
  451    HA   ALA  60           HA       ALA  60  -6.768  10.725 -17.924
  452   1HB   ALA  60          1HB       ALA  60  -6.004   8.065 -19.068
  453   2HB   ALA  60          2HB       ALA  60  -7.270   8.121 -17.841
  454   3HB   ALA  60          3HB       ALA  60  -5.659   8.738 -17.474
  455    H    PHE  61           H        PHE  61  -6.268   8.829 -20.928
  456    HA   PHE  61           HA       PHE  61  -3.844  10.020 -21.690
  457   1HB   PHE  61          2HB       PHE  61  -4.458   8.184 -23.000
  458   2HB   PHE  61          1HB       PHE  61  -6.100   8.779 -23.242
  459    HD1  PHE  61           HD1      PHE  61  -2.576   9.112 -24.285
  460    HD2  PHE  61           HD2      PHE  61  -6.606  10.449 -24.933
  461    HE1  PHE  61           HE1      PHE  61  -1.879  10.177 -26.414
  462    HE2  PHE  61           HE2      PHE  61  -5.911  11.514 -27.063
  463    HZ   PHE  61           HZ       PHE  61  -3.547  11.378 -27.803
  464    H    LYS  62           H        LYS  62  -7.160  11.158 -22.280
  465    HA   LYS  62           HA       LYS  62  -6.607  13.281 -24.045
  466   1HB   LYS  62          2HB       LYS  62  -8.897  12.637 -23.421
  467   2HB   LYS  62          1HB       LYS  62  -8.623  13.219 -21.778
  468   1HG   LYS  62          2HG       LYS  62  -8.386  15.485 -22.524
  469   2HG   LYS  62          1HG       LYS  62  -8.319  14.989 -24.215
  470   1HD   LYS  62          2HD       LYS  62 -10.724  14.475 -22.449
  471   2HD   LYS  62          1HD       LYS  62 -10.558  15.925 -23.438
  472   1HE   LYS  62          2HE       LYS  62 -10.848  13.062 -24.326
  473   2HE   LYS  62          1HE       LYS  62 -11.766  14.477 -24.838
  474   1HZ   LYS  62          1HZ       LYS  62  -9.743  15.325 -25.901
  475   2HZ   LYS  62          2HZ       LYS  62 -10.229  13.833 -26.553
  476   3HZ   LYS  62          3HZ       LYS  62  -8.922  13.904 -25.470
  477    H    MET  63           H        MET  63  -6.750  13.443 -20.466
  478    HA   MET  63           HA       MET  63  -5.957  16.112 -20.147
  479   1HB   MET  63          2HB       MET  63  -5.314  13.675 -18.466
  480   2HB   MET  63          1HB       MET  63  -4.939  15.322 -17.959
  481   1HG   MET  63          2HG       MET  63  -7.434  15.823 -18.448
  482   2HG   MET  63          1HG       MET  63  -7.643  14.072 -18.419
  483   1HE   MET  63          1HE       MET  63  -7.668  12.611 -16.392
  484   2HE   MET  63          2HE       MET  63  -9.073  13.662 -16.551
  485   3HE   MET  63          3HE       MET  63  -8.361  13.389 -14.962
  486    H    GLY  64           H        GLY  64  -3.887  13.236 -20.544
  487   1HA   GLY  64          2HA       GLY  64  -1.901  14.044 -22.127
  488   2HA   GLY  64          1HA       GLY  64  -1.501  14.987 -20.691
  489    H    PHE  65           H        PHE  65  -2.950  11.808 -20.446
  490    HA   PHE  65           HA       PHE  65  -0.429  10.851 -19.174
  491   1HB   PHE  65          2HB       PHE  65  -3.328  10.077 -18.908
  492   2HB   PHE  65          1HB       PHE  65  -2.057   8.964 -18.403
  493    HD1  PHE  65           HD1      PHE  65  -0.756   9.361 -16.425
  494    HD2  PHE  65           HD2      PHE  65  -3.505  12.336 -17.853
  495    HE1  PHE  65           HE1      PHE  65  -0.499  10.617 -14.303
  496    HE2  PHE  65           HE2      PHE  65  -3.248  13.593 -15.731
  497    HZ   PHE  65           HZ       PHE  65  -1.744  12.734 -13.956
  498    H    GLU  66           H        GLU  66  -0.031   8.418 -19.533
  499    HA   GLU  66           HA       GLU  66  -0.626   7.753 -22.389
  500   1HB   GLU  66          2HB       GLU  66   1.888   7.887 -20.925
  501   2HB   GLU  66          1HB       GLU  66   1.638   6.287 -21.625
  502   1HG   GLU  66          2HG       GLU  66   1.028   7.494 -23.801
  503   2HG   GLU  66          1HG       GLU  66   1.683   8.951 -23.052
  504    H    VAL  67           H        VAL  67  -2.528   6.576 -21.677
  505    HA   VAL  67           HA       VAL  67  -2.524   4.540 -19.699
  506    HB   VAL  67           HB       VAL  67  -4.603   5.392 -20.661
  507   1HG1  VAL  67          1HG1      VAL  67  -5.097   5.368 -22.904
  508   2HG1  VAL  67          2HG1      VAL  67  -4.227   3.860 -23.185
  509   3HG1  VAL  67          3HG1      VAL  67  -3.338   5.376 -23.038
  510   1HG2  VAL  67          1HG2      VAL  67  -4.181   2.465 -21.349
  511   2HG2  VAL  67          2HG2      VAL  67  -5.737   3.245 -21.065
  512   3HG2  VAL  67          3HG2      VAL  67  -4.578   3.083 -19.745
  513    H    LEU  68           H        LEU  68  -2.017   2.347 -19.786
  514    HA   LEU  68           HA       LEU  68  -0.707   1.412 -22.308
  515   1HB   LEU  68          2HB       LEU  68   0.590   1.787 -19.962
  516   2HB   LEU  68          1HB       LEU  68   0.026   0.133 -19.728
  517    HG   LEU  68           HG       LEU  68   0.931  -0.053 -22.272
  518   1HD1  LEU  68          1HD1      LEU  68   2.938   1.777 -20.953
  519   2HD1  LEU  68          2HD1      LEU  68   1.679   2.406 -22.015
  520   3HD1  LEU  68          3HD1      LEU  68   2.868   1.263 -22.637
  521   1HD2  LEU  68          1HD2      LEU  68   2.467  -0.315 -19.672
  522   2HD2  LEU  68          2HD2      LEU  68   3.080  -0.909 -21.216
  523   3HD2  LEU  68          3HD2      LEU  68   1.598  -1.582 -20.537
  524    H    GLU  69           H        GLU  69  -1.108  -0.780 -22.900
  525    HA   GLU  69           HA       GLU  69  -3.680  -1.793 -22.514
  526   1HB   GLU  69          2HB       GLU  69  -1.195  -3.480 -22.930
  527   2HB   GLU  69          1HB       GLU  69  -2.849  -3.919 -23.356
  528   1HG   GLU  69          2HG       GLU  69  -1.751  -1.370 -24.465
  529   2HG   GLU  69          1HG       GLU  69  -1.192  -2.887 -25.168
  530    H    ALA  70           H        ALA  70  -4.462  -3.608 -21.215
  531    HA   ALA  70           HA       ALA  70  -3.077  -3.737 -18.570
  532   1HB   ALA  70          1HB       ALA  70  -5.980  -4.150 -19.338
  533   2HB   ALA  70          2HB       ALA  70  -5.313  -2.831 -18.377
  534   3HB   ALA  70          3HB       ALA  70  -5.340  -4.471 -17.727
  535    H    GLU  71           H        GLU  71  -3.830  -5.945 -17.424
  536    HA   GLU  71           HA       GLU  71  -3.793  -8.200 -19.341
  537   1HB   GLU  71          2HB       GLU  71  -1.911  -9.231 -17.889
  538   2HB   GLU  71          1HB       GLU  71  -1.454  -7.998 -19.064
  539   1HG   GLU  71          2HG       GLU  71  -0.957  -6.450 -17.451
  540   2HG   GLU  71          1HG       GLU  71  -2.237  -7.010 -16.374
  541    H    GLU  72           H        GLU  72  -5.035  -9.861 -18.571
  542    HA   GLU  72           HA       GLU  72  -6.713  -9.621 -16.347
  543   1HB   GLU  72          2HB       GLU  72  -5.930 -11.746 -18.177
  544   2HB   GLU  72          1HB       GLU  72  -6.237 -12.373 -16.556
  545   1HG   GLU  72          2HG       GLU  72  -8.138 -10.503 -17.990
  546   2HG   GLU  72          1HG       GLU  72  -8.277 -12.260 -18.060
  547    H    THR  73           H        THR  73  -6.214  -9.494 -14.216
  548    HA   THR  73           HA       THR  73  -4.148 -11.306 -13.114
  549    HB   THR  73           HB       THR  73  -2.915  -9.238 -13.664
  550    HG1  THR  73           HG1      THR  73  -2.570 -10.453 -11.664
  551   1HG2  THR  73          1HG2      THR  73  -3.520  -7.126 -12.564
  552   2HG2  THR  73          2HG2      THR  73  -4.918  -7.902 -11.821
  553   3HG2  THR  73          3HG2      THR  73  -4.849  -7.697 -13.572
  554    H    GLU  74           H        GLU  74  -4.056 -10.416 -10.545
  555    HA   GLU  74           HA       GLU  74  -6.803  -9.885  -9.608
  556   1HB   GLU  74          2HB       GLU  74  -7.131 -11.900  -8.465
  557   2HB   GLU  74          1HB       GLU  74  -6.360 -12.452  -9.953
  558   1HG   GLU  74          2HG       GLU  74  -4.132 -12.185  -8.674
  559   2HG   GLU  74          1HG       GLU  74  -5.128 -12.119  -7.219
  560    H    ASP  75           H        ASP  75  -6.827  -9.217  -7.370
  561    HA   ASP  75           HA       ASP  75  -4.105  -8.525  -6.343
  562   1HB   ASP  75          2HB       ASP  75  -6.667  -7.102  -5.610
  563   2HB   ASP  75          1HB       ASP  75  -5.008  -6.530  -5.424
  564    H    GLU  76           H        GLU  76  -5.940  -7.627  -3.911
  565    HA   GLU  76           HA       GLU  76  -5.542 -10.171  -2.464
  566   1HB   GLU  76          2HB       GLU  76  -5.130  -7.587  -1.717
  567   2HB   GLU  76          1HB       GLU  76  -6.744  -7.857  -1.058
  568   1HG   GLU  76          2HG       GLU  76  -4.296  -9.570  -0.543
  569   2HG   GLU  76          1HG       GLU  76  -5.063  -8.477   0.609
  570    H    ASP  77           H        ASP  77  -7.869  -9.329  -4.441
  571    HA   ASP  77           HA       ASP  77 -10.128  -9.988  -2.610
  572   1HB   ASP  77          2HB       ASP  77 -11.463  -9.403  -4.781
  573   2HB   ASP  77          1HB       ASP  77 -10.742  -8.092  -3.848
  574    H    GLY  78           H        GLY  78  -8.571 -11.008  -5.641
  575   1HA   GLY  78          2HA       GLY  78  -8.442 -13.203  -6.518
  576   2HA   GLY  78          1HA       GLY  78  -9.409 -13.766  -5.155
  577    H    ASN  79           H        ASN  79 -10.043 -11.356  -7.723
  578    HA   ASN  79           HA       ASN  79 -12.481 -12.945  -8.420
  579   1HB   ASN  79          2HB       ASN  79 -12.791 -10.691  -7.141
  580   2HB   ASN  79          1HB       ASN  79 -12.365  -9.946  -8.682
  581   1HD2  ASN  79          1HD2      ASN  79 -14.235 -12.969  -8.185
  582   2HD2  ASN  79          2HD2      ASN  79 -15.654 -12.395  -8.921
  583    H    LYS  80           H        LYS  80  -9.552 -11.708  -9.491
  584    HA   LYS  80           HA       LYS  80  -8.605 -11.558 -11.633
  585   1HB   LYS  80          2HB       LYS  80 -10.726 -13.533 -11.810
  586   2HB   LYS  80          1HB       LYS  80 -10.560 -12.656 -13.332
  587   1HG   LYS  80          2HG       LYS  80  -8.123 -13.116 -13.316
  588   2HG   LYS  80          1HG       LYS  80  -8.318 -14.036 -11.825
  589   1HD   LYS  80          2HD       LYS  80  -9.184 -15.836 -12.906
  590   2HD   LYS  80          1HD       LYS  80 -10.157 -14.836 -13.984
  591   1HE   LYS  80          2HE       LYS  80  -8.031 -14.258 -15.222
  592   2HE   LYS  80          1HE       LYS  80  -7.206 -15.470 -14.242
  593   1HZ   LYS  80          1HZ       LYS  80  -7.817 -16.728 -16.020
  594   2HZ   LYS  80          2HZ       LYS  80  -9.221 -15.825 -16.337
  595   3HZ   LYS  80          3HZ       LYS  80  -9.195 -16.940 -15.055
  596    H    LEU  81           H        LEU  81  -8.536  -9.659 -12.737
  597    HA   LEU  81           HA       LEU  81 -10.966  -8.595 -14.004
  598   1HB   LEU  81          2HB       LEU  81 -10.130  -6.298 -12.780
  599   2HB   LEU  81          1HB       LEU  81 -11.451  -7.306 -12.187
  600    HG   LEU  81           HG       LEU  81  -9.827  -8.572 -10.792
  601   1HD1  LEU  81          1HD1      LEU  81  -7.542  -7.816 -10.575
  602   2HD1  LEU  81          2HD1      LEU  81  -7.849  -6.430 -11.621
  603   3HD1  LEU  81          3HD1      LEU  81  -7.861  -8.061 -12.293
  604   1HD2  LEU  81          1HD2      LEU  81  -9.140  -5.918  -9.840
  605   2HD2  LEU  81          2HD2      LEU  81 -10.264  -7.087  -9.148
  606   3HD2  LEU  81          3HD2      LEU  81 -10.815  -5.962 -10.389
  607    H    LEU  82           H        LEU  82 -10.022  -6.046 -14.612
  608    HA   LEU  82           HA       LEU  82  -7.546  -6.695 -16.160
  609   1HB   LEU  82          2HB       LEU  82  -9.595  -4.567 -16.832
  610   2HB   LEU  82          1HB       LEU  82  -8.309  -5.189 -17.868
  611    HG   LEU  82           HG       LEU  82  -9.788  -7.449 -17.058
  612   1HD1  LEU  82          1HD1      LEU  82 -12.066  -6.774 -17.947
  613   2HD1  LEU  82          2HD1      LEU  82 -11.537  -5.096 -17.821
  614   3HD1  LEU  82          3HD1      LEU  82 -11.655  -6.095 -16.372
  615   1HD2  LEU  82          1HD2      LEU  82 -10.540  -7.284 -19.539
  616   2HD2  LEU  82          2HD2      LEU  82  -8.811  -7.395 -19.210
  617   3HD2  LEU  82          3HD2      LEU  82  -9.536  -5.835 -19.596
  618    H    CYS  83           H        CYS  83  -5.857  -5.182 -16.152
  619    HA   CYS  83           HA       CYS  83  -6.224  -2.735 -14.502
  620   1HB   CYS  83          2HB       CYS  83  -5.233  -4.022 -12.842
  621   2HB   CYS  83          1HB       CYS  83  -4.330  -5.000 -13.998
  622    HG   CYS  83           HG       CYS  83  -2.605  -3.106 -14.255
  623    H    PHE  84           H        PHE  84  -5.640  -1.088 -15.813
  624    HA   PHE  84           HA       PHE  84  -3.569  -1.589 -17.894
  625   1HB   PHE  84          2HB       PHE  84  -4.379   0.734 -18.690
  626   2HB   PHE  84          1HB       PHE  84  -5.489  -0.621 -18.885
  627    HD1  PHE  84           HD1      PHE  84  -5.166   2.672 -17.662
  628    HD2  PHE  84           HD2      PHE  84  -7.056  -1.084 -16.784
  629    HE1  PHE  84           HE1      PHE  84  -6.844   3.844 -16.262
  630    HE2  PHE  84           HE2      PHE  84  -8.734   0.089 -15.384
  631    HZ   PHE  84           HZ       PHE  84  -8.628   2.553 -15.124
  632    H    ASP  85           H        ASP  85  -2.071   0.369 -18.273
  633    HA   ASP  85           HA       ASP  85  -1.300   1.537 -15.626
  634   1HB   ASP  85          2HB       ASP  85   0.794   1.112 -17.701
  635   2HB   ASP  85          1HB       ASP  85   0.905   0.975 -15.947
  636    H    ALA  86           H        ALA  86  -0.720   3.712 -15.638
  637    HA   ALA  86           HA       ALA  86  -0.894   5.103 -18.282
  638   1HB   ALA  86          1HB       ALA  86  -1.590   7.027 -16.448
  639   2HB   ALA  86          2HB       ALA  86  -2.311   5.582 -15.739
  640   3HB   ALA  86          3HB       ALA  86  -2.745   6.070 -17.377
  641    H    THR  87           H        THR  87   0.855   6.382 -18.748
  642    HA   THR  87           HA       THR  87   2.811   6.837 -16.534
  643    HB   THR  87           HB       THR  87   4.189   7.307 -18.876
  644    HG1  THR  87           HG1      THR  87   2.705   6.518 -20.244
  645   1HG2  THR  87          1HG2      THR  87   4.883   4.791 -18.470
  646   2HG2  THR  87          2HG2      THR  87   3.875   4.967 -17.031
  647   3HG2  THR  87          3HG2      THR  87   5.268   6.024 -17.269
  648    H    MET  88           H        MET  88   3.725   8.917 -16.315
  649    HA   MET  88           HA       MET  88   2.735  11.060 -18.112
  650   1HB   MET  88          2HB       MET  88   1.194  10.731 -16.056
  651   2HB   MET  88          1HB       MET  88   2.533  11.390 -15.117
  652   1HG   MET  88          2HG       MET  88   2.541  13.389 -16.625
  653   2HG   MET  88          1HG       MET  88   1.107  12.745 -17.425
  654   1HE   MET  88          1HE       MET  88   0.531  15.046 -17.030
  655   2HE   MET  88          2HE       MET  88  -0.272  15.689 -15.600
  656   3HE   MET  88          3HE       MET  88  -1.082  14.473 -16.584
  657    H    GLN  89           H        GLN  89   4.059  13.004 -17.955
  658    HA   GLN  89           HA       GLN  89   6.737  12.427 -16.761
  659   1HB   GLN  89          2HB       GLN  89   6.310  14.670 -18.696
  660   2HB   GLN  89          1HB       GLN  89   7.707  13.610 -18.498
  661   1HG   GLN  89          2HG       GLN  89   5.034  12.807 -19.688
  662   2HG   GLN  89          1HG       GLN  89   6.521  13.095 -20.594
  663   1HE2  GLN  89          1HE2      GLN  89   5.613  10.601 -21.000
  664   2HE2  GLN  89          2HE2      GLN  89   6.446   9.447 -20.075
  665    H    SER  90           H        SER  90   7.227  13.552 -14.945
  666    HA   SER  90           HA       SER  90   6.146  16.310 -14.644
  667   1HB   SER  90          2HB       SER  90   5.393  15.909 -12.409
  668   2HB   SER  90          1HB       SER  90   4.733  14.598 -13.382
  669    HG   SER  90           HG       SER  90   6.031  13.221 -12.414
  670    H    ALA  91           H        ALA  91   7.328  17.454 -12.792
  671    HA   ALA  91           HA       ALA  91  10.205  16.841 -13.042
  672   1HB   ALA  91          1HB       ALA  91  10.164  19.110 -13.126
  673   2HB   ALA  91          2HB       ALA  91  10.010  19.029 -11.372
  674   3HB   ALA  91          3HB       ALA  91   8.570  19.193 -12.376
  675    H    LEU  92           H        LEU  92   8.813  14.891 -11.581
  676    HA   LEU  92           HA       LEU  92   8.608  13.938  -9.412
  677   1HB   LEU  92          2HB       LEU  92  11.065  13.752 -10.267
  678   2HB   LEU  92          1HB       LEU  92  11.412  14.979  -9.049
  679    HG   LEU  92           HG       LEU  92  10.058  13.390  -7.457
  680   1HD1  LEU  92          1HD1      LEU  92  11.152  11.107  -8.909
  681   2HD1  LEU  92          2HD1      LEU  92   9.900  11.936  -9.834
  682   3HD1  LEU  92          3HD1      LEU  92   9.544  11.327  -8.218
  683   1HD2  LEU  92          1HD2      LEU  92  12.119  12.368  -6.772
  684   2HD2  LEU  92          2HD2      LEU  92  12.547  13.945  -7.435
  685   3HD2  LEU  92          3HD2      LEU  92  12.793  12.486  -8.397
  686    H    ASP  93           H        ASP  93   7.090  15.590  -8.595
  687    HA   ASP  93           HA       ASP  93   8.350  17.186  -6.420
  688   1HB   ASP  93          2HB       ASP  93   7.012  18.237  -8.774
  689   2HB   ASP  93          1HB       ASP  93   6.157  18.709  -7.305
  690    H    ALA  94           H        ALA  94   7.001  17.415  -4.574
  691    HA   ALA  94           HA       ALA  94   4.968  15.345  -4.293
  692   1HB   ALA  94          1HB       ALA  94   4.688  16.612  -2.001
  693   2HB   ALA  94          2HB       ALA  94   6.175  17.426  -2.492
  694   3HB   ALA  94          3HB       ALA  94   6.150  15.672  -2.305
  695    H    LYS  95           H        LYS  95   4.913  18.923  -4.108
  696    HA   LYS  95           HA       LYS  95   2.132  19.248  -3.788
  697   1HB   LYS  95          2HB       LYS  95   3.885  21.070  -3.723
  698   2HB   LYS  95          1HB       LYS  95   3.905  21.024  -5.486
  699   1HG   LYS  95          2HG       LYS  95   1.768  21.903  -5.674
  700   2HG   LYS  95          1HG       LYS  95   1.267  21.297  -4.095
  701   1HD   LYS  95          2HD       LYS  95   2.631  22.972  -2.968
  702   2HD   LYS  95          1HD       LYS  95   3.273  23.531  -4.513
  703   1HE   LYS  95          2HE       LYS  95   0.303  23.504  -4.061
  704   2HE   LYS  95          1HE       LYS  95   1.274  24.826  -3.413
  705   1HZ   LYS  95          1HZ       LYS  95   1.165  25.719  -5.426
  706   2HZ   LYS  95          2HZ       LYS  95   0.485  24.316  -6.101
  707   3HZ   LYS  95          3HZ       LYS  95   2.172  24.470  -5.978
  708    H    LEU  96           H        LEU  96   3.965  19.281  -6.866
  709    HA   LEU  96           HA       LEU  96   1.689  19.354  -8.568
  710   1HB   LEU  96          2HB       LEU  96   4.479  18.250  -8.979
  711   2HB   LEU  96          1HB       LEU  96   3.277  18.318 -10.269
  712    HG   LEU  96           HG       LEU  96   3.726  20.811  -8.698
  713   1HD1  LEU  96          1HD1      LEU  96   5.785  19.452 -10.365
  714   2HD1  LEU  96          2HD1      LEU  96   5.989  20.577  -9.022
  715   3HD1  LEU  96          3HD1      LEU  96   5.571  21.183 -10.624
  716   1HD2  LEU  96          1HD2      LEU  96   3.511  20.394 -11.686
  717   2HD2  LEU  96          2HD2      LEU  96   3.138  21.848 -10.760
  718   3HD2  LEU  96          3HD2      LEU  96   2.087  20.437 -10.645
  719    H    ILE  97           H        ILE  97   3.591  16.550  -7.413
  720    HA   ILE  97           HA       ILE  97   2.098  14.525  -8.695
  721    HB   ILE  97           HB       ILE  97   3.661  14.623  -6.123
  722   1HG1  ILE  97          2HG1      ILE  97   3.998  12.980  -8.651
  723   2HG1  ILE  97          1HG1      ILE  97   4.760  14.550  -8.395
  724   1HG2  ILE  97          1HG2      ILE  97   3.297  11.985  -6.385
  725   2HG2  ILE  97          2HG2      ILE  97   1.757  12.522  -7.058
  726   3HG2  ILE  97          3HG2      ILE  97   2.207  12.977  -5.415
  727   1HD1  ILE  97          1HD1      ILE  97   5.572  11.952  -7.409
  728   2HD1  ILE  97          2HD1      ILE  97   5.310  13.066  -6.067
  729   3HD1  ILE  97          3HD1      ILE  97   6.445  13.483  -7.350
  730    H    ASP  98           H        ASP  98   1.332  16.457  -5.869
  731    HA   ASP  98           HA       ASP  98  -0.793  14.788  -4.872
  732   1HB   ASP  98          2HB       ASP  98   0.471  16.969  -3.895
  733   2HB   ASP  98          1HB       ASP  98  -0.994  17.732  -4.512
  734    H    GLU  99           H        GLU  99  -0.839  17.735  -6.905
  735    HA   GLU  99           HA       GLU  99  -3.625  17.834  -7.355
  736   1HB   GLU  99          2HB       GLU  99  -1.613  18.476  -9.511
  737   2HB   GLU  99          1HB       GLU  99  -3.150  19.273  -9.173
  738   1HG   GLU  99          2HG       GLU  99  -2.216  20.038  -6.981
  739   2HG   GLU  99          1HG       GLU  99  -0.659  19.351  -7.448
  740    H    GLN 100           H        GLN 100  -1.145  15.842  -8.897
  741    HA   GLN 100           HA       GLN 100  -2.844  14.857 -11.011
  742   1HB   GLN 100          2HB       GLN 100  -0.247  13.951  -9.786
  743   2HB   GLN 100          1HB       GLN 100  -1.080  12.933 -10.963
  744   1HG   GLN 100          2HG       GLN 100  -0.952  14.616 -12.653
  745   2HG   GLN 100          1HG       GLN 100  -0.467  15.848 -11.488
  746   1HE2  GLN 100          1HE2      GLN 100   1.007  12.792 -10.900
  747   2HE2  GLN 100          2HE2      GLN 100   2.518  13.137 -11.592
  748    H    VAL 101           H        VAL 101  -1.547  12.984  -8.248
  749    HA   VAL 101           HA       VAL 101  -3.234  10.803  -8.348
  750    HB   VAL 101           HB       VAL 101  -2.260  12.305  -5.903
  751   1HG1  VAL 101          1HG1      VAL 101  -3.661   9.633  -6.167
  752   2HG1  VAL 101          2HG1      VAL 101  -4.144  11.008  -5.174
  753   3HG1  VAL 101          3HG1      VAL 101  -2.706  10.078  -4.753
  754   1HG2  VAL 101          1HG2      VAL 101  -0.792  10.998  -7.745
  755   2HG2  VAL 101          2HG2      VAL 101  -1.257   9.625  -6.742
  756   3HG2  VAL 101          3HG2      VAL 101  -0.382  10.980  -6.029
  757    H    GLU 102           H        GLU 102  -3.991  13.942  -6.821
  758    HA   GLU 102           HA       GLU 102  -6.542  13.275  -5.807
  759   1HB   GLU 102          2HB       GLU 102  -5.038  15.564  -5.897
  760   2HB   GLU 102          1HB       GLU 102  -6.340  15.961  -7.018
  761   1HG   GLU 102          2HG       GLU 102  -8.016  15.574  -5.360
  762   2HG   GLU 102          1HG       GLU 102  -6.863  14.802  -4.273
  763    H    LYS 103           H        LYS 103  -5.647  14.491  -9.045
  764    HA   LYS 103           HA       LYS 103  -8.302  14.594 -10.086
  765   1HB   LYS 103          2HB       LYS 103  -5.998  15.409 -11.088
  766   2HB   LYS 103          1HB       LYS 103  -5.993  13.810 -11.834
  767   1HG   LYS 103          2HG       LYS 103  -7.090  15.161 -13.428
  768   2HG   LYS 103          1HG       LYS 103  -8.413  14.371 -12.570
  769   1HD   LYS 103          2HD       LYS 103  -7.917  16.632 -11.036
  770   2HD   LYS 103          1HD       LYS 103  -7.714  17.209 -12.690
  771   1HE   LYS 103          2HE       LYS 103  -9.908  16.363 -13.309
  772   2HE   LYS 103          1HE       LYS 103 -10.109  15.624 -11.721
  773   1HZ   LYS 103          1HZ       LYS 103  -9.485  18.253 -11.229
  774   2HZ   LYS 103          2HZ       LYS 103 -11.012  17.526 -11.079
  775   3HZ   LYS 103          3HZ       LYS 103 -10.579  18.309 -12.524
  776    H    LEU 104           H        LEU 104  -5.829  12.018 -10.430
  777    HA   LEU 104           HA       LEU 104  -7.527  10.150 -11.739
  778   1HB   LEU 104          2HB       LEU 104  -5.214   9.604  -9.851
  779   2HB   LEU 104          1HB       LEU 104  -5.914   8.439 -10.976
  780    HG   LEU 104           HG       LEU 104  -4.762  11.098 -11.853
  781   1HD1  LEU 104          1HD1      LEU 104  -3.470   8.362 -11.680
  782   2HD1  LEU 104          2HD1      LEU 104  -2.940   9.844 -10.882
  783   3HD1  LEU 104          3HD1      LEU 104  -2.815   9.692 -12.634
  784   1HD2  LEU 104          1HD2      LEU 104  -5.698  10.501 -13.816
  785   2HD2  LEU 104          2HD2      LEU 104  -6.243   8.970 -13.131
  786   3HD2  LEU 104          3HD2      LEU 104  -4.637   9.093 -13.849
  787    H    VAL 105           H        VAL 105  -7.487  11.255  -8.484
  788    HA   VAL 105           HA       VAL 105  -8.809   8.883  -7.373
  789    HB   VAL 105           HB       VAL 105  -7.972  11.571  -6.335
  790   1HG1  VAL 105          1HG1      VAL 105 -10.043  11.613  -5.290
  791   2HG1  VAL 105          2HG1      VAL 105  -9.130  10.645  -4.133
  792   3HG1  VAL 105          3HG1      VAL 105 -10.198   9.857  -5.294
  793   1HG2  VAL 105          1HG2      VAL 105  -7.694   8.838  -5.075
  794   2HG2  VAL 105          2HG2      VAL 105  -6.701  10.272  -4.811
  795   3HG2  VAL 105          3HG2      VAL 105  -6.587   9.388  -6.332
  796    H    ASN 106           H        ASN 106  -9.871  12.303  -7.392
  797    HA   ASN 106           HA       ASN 106 -12.601  11.840  -7.031
  798   1HB   ASN 106          2HB       ASN 106 -11.022  13.999  -8.364
  799   2HB   ASN 106          1HB       ASN 106 -12.765  13.976  -8.634
  800   1HD2  ASN 106          1HD2      ASN 106 -10.260  14.501  -6.214
  801   2HD2  ASN 106          2HD2      ASN 106 -11.301  15.030  -4.982
  802    H    LEU 107           H        LEU 107 -10.695  11.558  -9.984
  803    HA   LEU 107           HA       LEU 107 -12.998  11.206 -11.724
  804   1HB   LEU 107          2HB       LEU 107 -10.818  11.982 -12.593
  805   2HB   LEU 107          1HB       LEU 107 -10.090  10.442 -12.140
  806    HG   LEU 107           HG       LEU 107 -12.294   9.655 -13.612
  807   1HD1  LEU 107          1HD1      LEU 107 -12.135  11.009 -15.703
  808   2HD1  LEU 107          2HD1      LEU 107 -11.073  12.137 -14.859
  809   3HD1  LEU 107          3HD1      LEU 107 -12.747  11.942 -14.338
  810   1HD2  LEU 107          1HD2      LEU 107 -10.624   9.103 -15.350
  811   2HD2  LEU 107          2HD2      LEU 107 -10.001   8.739 -13.740
  812   3HD2  LEU 107          3HD2      LEU 107  -9.468  10.192 -14.584
  813    H    ALA 108           H        ALA 108 -10.443   8.894 -10.716
  814    HA   ALA 108           HA       ALA 108 -11.513   6.521 -11.594
  815   1HB   ALA 108          1HB       ALA 108  -9.483   6.372 -10.382
  816   2HB   ALA 108          2HB       ALA 108 -10.650   5.524  -9.368
  817   3HB   ALA 108          3HB       ALA 108 -10.169   7.173  -8.969
  818    H    GLU 109           H        GLU 109 -12.540   8.287  -8.672
  819    HA   GLU 109           HA       GLU 109 -14.622   6.331  -8.062
  820   1HB   GLU 109          2HB       GLU 109 -13.563   8.810  -6.863
  821   2HB   GLU 109          1HB       GLU 109 -15.300   8.587  -6.651
  822   1HG   GLU 109          2HG       GLU 109 -13.384   6.324  -6.112
  823   2HG   GLU 109          1HG       GLU 109 -13.709   7.543  -4.879
  824    H    LYS 110           H        LYS 110 -14.367   9.303  -9.895
  825    HA   LYS 110           HA       LYS 110 -17.093  10.058 -10.014
  826   1HB   LYS 110          2HB       LYS 110 -15.106  11.317 -10.982
  827   2HB   LYS 110          1HB       LYS 110 -15.161  10.197 -12.343
  828   1HG   LYS 110          2HG       LYS 110 -16.548  11.824 -13.192
  829   2HG   LYS 110          1HG       LYS 110 -17.753  10.904 -12.290
  830   1HD   LYS 110          2HD       LYS 110 -17.194  12.429 -10.301
  831   2HD   LYS 110          1HD       LYS 110 -16.359  13.456 -11.468
  832   1HE   LYS 110          2HE       LYS 110 -18.407  14.424 -11.711
  833   2HE   LYS 110          1HE       LYS 110 -18.724  13.043 -12.760
  834   1HZ   LYS 110          1HZ       LYS 110 -19.393  11.892 -10.575
  835   2HZ   LYS 110          2HZ       LYS 110 -20.480  12.985 -11.290
  836   3HZ   LYS 110          3HZ       LYS 110 -19.537  13.467  -9.961
  837    H    PHE 111           H        PHE 111 -15.332   7.518 -11.717
  838    HA   PHE 111           HA       PHE 111 -17.798   6.829 -13.231
  839   1HB   PHE 111          2HB       PHE 111 -14.888   6.177 -13.523
  840   2HB   PHE 111          1HB       PHE 111 -16.075   5.048 -14.176
  841    HD1  PHE 111           HD1      PHE 111 -14.094   7.761 -15.020
  842    HD2  PHE 111           HD2      PHE 111 -18.142   6.375 -15.401
  843    HE1  PHE 111           HE1      PHE 111 -14.416   9.242 -16.983
  844    HE2  PHE 111           HE2      PHE 111 -18.464   7.855 -17.364
  845    HZ   PHE 111           HZ       PHE 111 -16.600   9.289 -18.156
  846    H    ASP 112           H        ASP 112 -15.276   4.709 -11.863
  847    HA   ASP 112           HA       ASP 112 -16.662   3.621  -9.700
  848   1HB   ASP 112          2HB       ASP 112 -17.750   2.766 -12.304
  849   2HB   ASP 112          1HB       ASP 112 -17.371   1.440 -11.203
  850    H    ILE 113           H        ILE 113 -13.969   3.997 -10.859
  851    HA   ILE 113           HA       ILE 113 -13.001   1.170 -10.725
  852    HB   ILE 113           HB       ILE 113 -10.981   1.983 -11.919
  853   1HG1  ILE 113          2HG1      ILE 113 -12.537   4.590 -11.996
  854   2HG1  ILE 113          1HG1      ILE 113 -11.007   4.310 -11.163
  855   1HG2  ILE 113          1HG2      ILE 113 -13.489   1.475 -12.959
  856   2HG2  ILE 113          2HG2      ILE 113 -12.008   1.620 -13.907
  857   3HG2  ILE 113          3HG2      ILE 113 -13.069   3.015 -13.709
  858   1HD1  ILE 113          1HD1      ILE 113 -11.401   5.094 -13.874
  859   2HD1  ILE 113          2HD1      ILE 113 -10.718   3.468 -13.888
  860   3HD1  ILE 113          3HD1      ILE 113  -9.875   4.771 -13.050
  861    H    ILE 114           H        ILE 114 -11.283   0.720  -9.285
  862    HA   ILE 114           HA       ILE 114 -10.940   2.761  -7.158
  863    HB   ILE 114           HB       ILE 114 -11.554   0.683  -6.224
  864   1HG1  ILE 114          2HG1      ILE 114  -9.613  -0.012  -4.950
  865   2HG1  ILE 114          1HG1      ILE 114  -8.521   0.638  -6.174
  866   1HG2  ILE 114          1HG2      ILE 114  -9.858  -0.391  -8.428
  867   2HG2  ILE 114          2HG2      ILE 114 -11.418  -0.957  -7.833
  868   3HG2  ILE 114          3HG2      ILE 114  -9.942  -1.345  -6.947
  869   1HD1  ILE 114          1HD1      ILE 114  -8.858   2.816  -5.518
  870   2HD1  ILE 114          2HD1      ILE 114  -9.181   2.028  -3.973
  871   3HD1  ILE 114          3HD1      ILE 114 -10.521   2.517  -5.011
  872    H    TYR 115           H        TYR 115  -9.198   4.067  -7.388
  873    HA   TYR 115           HA       TYR 115  -6.816   3.076  -8.849
  874   1HB   TYR 115          2HB       TYR 115  -7.025   5.213  -9.617
  875   2HB   TYR 115          1HB       TYR 115  -7.989   5.717  -8.232
  876    HD1  TYR 115           HD1      TYR 115  -4.494   4.919  -9.290
  877    HD2  TYR 115           HD2      TYR 115  -7.016   6.950  -6.466
  878    HE1  TYR 115           HE1      TYR 115  -2.503   6.019  -8.303
  879    HE2  TYR 115           HE2      TYR 115  -5.025   8.051  -5.479
  880    HH   TYR 115           HH       TYR 115  -2.200   7.155  -5.568
  881    H    ASP 116           H        ASP 116  -5.511   1.874  -7.517
  882    HA   ASP 116           HA       ASP 116  -4.520   3.185  -5.051
  883   1HB   ASP 116          2HB       ASP 116  -6.508   1.574  -4.577
  884   2HB   ASP 116          1HB       ASP 116  -5.352   0.291  -4.935
  885    H    GLY 117           H        GLY 117  -2.565   3.369  -6.351
  886   1HA   GLY 117          2HA       GLY 117  -0.517   1.628  -5.878
  887   2HA   GLY 117          1HA       GLY 117  -1.274   0.911  -7.301
  888    H    TRP 118           H        TRP 118   0.584   3.629  -6.114
  889    HA   TRP 118           HA       TRP 118   1.047   4.427  -8.956
  890   1HB   TRP 118          2HB       TRP 118   0.721   6.659  -8.510
  891   2HB   TRP 118          1HB       TRP 118  -0.354   6.001  -7.278
  892    HD1  TRP 118           HD1      TRP 118   0.517   5.985  -4.755
  893    HE1  TRP 118           HE1      TRP 118   2.335   7.373  -3.565
  894    HE3  TRP 118           HE3      TRP 118   3.022   7.819  -8.810
  895    HZ2  TRP 118           HZ2      TRP 118   4.559   9.042  -4.245
  896    HZ3  TRP 118           HZ3      TRP 118   4.984   9.303  -8.511
  897    HH2  TRP 118           HH2      TRP 118   5.754   9.916  -6.236
  898    H    GLY 119           H        GLY 119   3.194   4.642  -9.498
  899   1HA   GLY 119          2HA       GLY 119   5.225   5.022  -7.403
  900   2HA   GLY 119          1HA       GLY 119   5.289   3.466  -8.231
  901    H    THR 120           H        THR 120   7.169   5.837  -8.277
  902    HA   THR 120           HA       THR 120   6.976   6.670 -11.116
  903    HB   THR 120           HB       THR 120   7.542   8.505  -9.742
  904    HG1  THR 120           HG1      THR 120   9.805   8.835 -10.213
  905   1HG2  THR 120          1HG2      THR 120   9.776   7.950  -8.246
  906   2HG2  THR 120          2HG2      THR 120   8.904   6.418  -8.176
  907   3HG2  THR 120          3HG2      THR 120   8.123   7.904  -7.633
  908    H    TYR 121           H        TYR 121   9.217   6.679 -12.281
  909    HA   TYR 121           HA       TYR 121  10.481   4.009 -11.812
  910   1HB   TYR 121          2HB       TYR 121   9.545   5.388 -14.226
  911   2HB   TYR 121          1HB       TYR 121  11.197   4.789 -14.373
  912    HD1  TYR 121           HD1      TYR 121  11.668   2.449 -14.520
  913    HD2  TYR 121           HD2      TYR 121   7.702   3.803 -13.575
  914    HE1  TYR 121           HE1      TYR 121  10.807   0.142 -14.824
  915    HE2  TYR 121           HE2      TYR 121   6.841   1.496 -13.879
  916    HH   TYR 121           HH       TYR 121   8.930  -1.101 -15.064
  917    H    TYR 122           H        TYR 122  12.661   3.983 -11.400
  918    HA   TYR 122           HA       TYR 122  14.068   6.304 -10.662
  919   1HB   TYR 122          2HB       TYR 122  14.619   3.537 -10.796
  920   2HB   TYR 122          1HB       TYR 122  15.904   4.329 -11.709
  921    HD1  TYR 122           HD1      TYR 122  17.446   5.883 -10.639
  922    HD2  TYR 122           HD2      TYR 122  14.271   4.032  -8.415
  923    HE1  TYR 122           HE1      TYR 122  18.501   6.619  -8.519
  924    HE2  TYR 122           HE2      TYR 122  15.328   4.766  -6.295
  925    HH   TYR 122           HH       TYR 122  17.770   7.085  -6.169
  926    H    GLU 123           H        GLU 123  16.218   6.978 -11.813
  927    HA   GLU 123           HA       GLU 123  15.462   7.780 -14.551
  928   1HB   GLU 123          2HB       GLU 123  16.459   9.350 -12.785
  929   2HB   GLU 123          1HB       GLU 123  17.991   8.524 -13.073
  930   1HG   GLU 123          2HG       GLU 123  17.982   9.162 -15.400
  931   2HG   GLU 123          1HG       GLU 123  16.338   9.792 -15.273
  932    H    GLY 124           H        GLY 124  15.748   5.333 -15.099
  933   1HA   GLY 124          2HA       GLY 124  17.071   4.163 -16.759
  934   2HA   GLY 124          1HA       GLY 124  18.499   5.023 -16.183
  935    H    LEU 125           H        LEU 125  16.613   3.937 -13.596
  936    HA   LEU 125           HA       LEU 125  17.170   2.365 -11.925
  937   1HB   LEU 125          2HB       LEU 125  16.834   0.933 -14.510
  938   2HB   LEU 125          1HB       LEU 125  17.574   0.016 -13.198
  939    HG   LEU 125           HG       LEU 125  15.084   1.619 -12.683
  940   1HD1  LEU 125          1HD1      LEU 125  13.960  -0.731 -13.091
  941   2HD1  LEU 125          2HD1      LEU 125  15.342  -0.985 -14.158
  942   3HD1  LEU 125          3HD1      LEU 125  14.236   0.357 -14.451
  943   1HD2  LEU 125          1HD2      LEU 125  16.362  -0.872 -11.519
  944   2HD2  LEU 125          2HD2      LEU 125  14.770  -0.281 -11.041
  945   3HD2  LEU 125          3HD2      LEU 125  16.202   0.705 -10.746
  946    H    GLU 126           H        GLU 126  19.334   3.719 -11.924
  947    HA   GLU 126           HA       GLU 126  21.590   1.868 -12.587
  948   1HB   GLU 126          2HB       GLU 126  22.633   4.433 -12.072
  949   2HB   GLU 126          1HB       GLU 126  22.486   3.646 -13.644
  950   1HG   GLU 126          2HG       GLU 126  20.159   4.523 -13.827
  951   2HG   GLU 126          1HG       GLU 126  20.394   5.387 -12.306
  952    H    HIS 127           H        HIS 127  22.324   0.878 -10.772
  953    HA   HIS 127           HA       HIS 127  21.874   2.115  -8.136
  954   1HB   HIS 127          2HB       HIS 127  22.976  -0.550  -9.046
  955   2HB   HIS 127          1HB       HIS 127  23.032  -0.043  -7.357
  956    HD2  HIS 127           HD2      HIS 127  21.056  -2.384  -7.322
  957    HE1  HIS 127           HE1      HIS 127  17.885   0.221  -8.319
  958    HE2  HIS 127           HE2      HIS 127  18.468  -2.078  -7.416
  959    H    HIS 128           H        HIS 128  23.330   3.940  -8.365
  960    HA   HIS 128           HA       HIS 128  25.442   5.005  -8.391
  961   1HB   HIS 128          2HB       HIS 128  25.400   2.879  -6.327
  962   2HB   HIS 128          1HB       HIS 128  26.999   3.497  -6.743
  963    HD2  HIS 128           HD2      HIS 128  23.985   6.000  -6.824
  964    HE1  HIS 128           HE1      HIS 128  26.347   6.928  -3.450
  965    HE2  HIS 128           HE2      HIS 128  24.395   7.688  -4.880
  966    H    HIS 129           H        HIS 129  27.146   2.066  -7.738
  967    HA   HIS 129           HA       HIS 129  28.166   2.088 -10.552
  968   1HB   HIS 129          2HB       HIS 129  29.708   1.060  -8.166
  969   2HB   HIS 129          1HB       HIS 129  30.326   1.527  -9.750
  970    HD2  HIS 129           HD2      HIS 129  30.922   3.047  -6.610
  971    HE1  HIS 129           HE1      HIS 129  29.491   6.374  -8.781
  972    HE2  HIS 129           HE2      HIS 129  30.745   5.647  -6.699
  973    H    HIS 130           H        HIS 130  29.674  -0.432  -9.334
  974    HA   HIS 130           HA       HIS 130  27.797  -2.352 -10.470
  975   1HB   HIS 130          2HB       HIS 130  30.185  -2.716 -10.764
  976   2HB   HIS 130          1HB       HIS 130  30.435  -2.715  -9.019
  977    HD2  HIS 130           HD2      HIS 130  27.489  -4.764 -10.671
  978    HE1  HIS 130           HE1      HIS 130  30.243  -7.493  -8.995
  979    HE2  HIS 130           HE2      HIS 130  27.979  -7.266 -10.117
  980    H    HIS 131           H        HIS 131  27.394  -0.773  -7.774
  981    HA   HIS 131           HA       HIS 131  25.961  -1.295  -5.957
  982   1HB   HIS 131          2HB       HIS 131  25.410  -3.370  -7.540
  983   2HB   HIS 131          1HB       HIS 131  26.352  -4.236  -6.326
  984    HD2  HIS 131           HD2      HIS 131  25.044  -4.611  -3.872
  985    HE1  HIS 131           HE1      HIS 131  21.576  -2.381  -4.790
  986    HE2  HIS 131           HE2      HIS 131  22.650  -3.930  -3.091
  987    H    HIS 132           HN       HIS 132  28.720  -0.802  -5.708
  988    HA   HIS 132           HA       HIS 132  29.270  -2.322  -3.228
  989   1HB   HIS 132          2HB       HIS 132  30.428  -3.304  -5.411
  990   2HB   HIS 132          1HB       HIS 132  31.558  -1.980  -5.127
  991    HD2  HIS 132           HD2      HIS 132  30.925  -2.558  -1.659
  992    HE1  HIS 132           HE1      HIS 132  33.394  -5.862  -2.570
  993    HE2  HIS 132           HE2      HIS 132  32.422  -4.463  -0.691
  Start of MODEL    5
    1   1H    MET   1          1H        MET   1 -33.665  14.695   7.933
    2   2H    MET   1          2H        MET   1 -32.651  13.566   8.697
    3   3H    MET   1          3H        MET   1 -34.103  14.044   9.437
    4    HA   MET   1           HA       MET   1 -35.345  12.627   8.258
    5   1HB   MET   1          2HB       MET   1 -33.496  12.913   5.879
    6   2HB   MET   1          1HB       MET   1 -35.177  12.375   5.888
    7   1HG   MET   1          2HG       MET   1 -35.788  14.507   5.501
    8   2HG   MET   1          1HG       MET   1 -35.197  14.910   7.113
    9   1HE   MET   1          1HE       MET   1 -34.036  13.926   3.638
   10   2HE   MET   1          2HE       MET   1 -33.038  15.273   3.098
   11   3HE   MET   1          3HE       MET   1 -34.768  15.507   3.335
   12    H    SER   2           H        SER   2 -33.438  11.713   9.992
   13    HA   SER   2           HA       SER   2 -31.917   9.946  10.431
   14   1HB   SER   2          2HB       SER   2 -33.353   8.086   8.689
   15   2HB   SER   2          1HB       SER   2 -33.192   8.080  10.443
   16    HG   SER   2           HG       SER   2 -34.706  10.134   9.834
   17    H    HIS   3           H        HIS   3 -30.769  11.481   8.478
   18    HA   HIS   3           HA       HIS   3 -29.789   9.457   6.502
   19   1HB   HIS   3          2HB       HIS   3 -30.365  12.391   6.255
   20   2HB   HIS   3          1HB       HIS   3 -29.079  11.691   5.271
   21    HD2  HIS   3           HD2      HIS   3 -30.950  12.109   3.024
   22    HE1  HIS   3           HE1      HIS   3 -33.360   8.812   4.100
   23    HE2  HIS   3           HE2      HIS   3 -32.845  10.485   2.264
   24    H    GLN   4           H        GLN   4 -28.389   9.013   8.550
   25    HA   GLN   4           HA       GLN   4 -26.501  10.577   9.728
   26   1HB   GLN   4          2HB       GLN   4 -26.729   7.993   9.757
   27   2HB   GLN   4          1HB       GLN   4 -25.590   8.020   8.410
   28   1HG   GLN   4          2HG       GLN   4 -24.339   9.706  10.135
   29   2HG   GLN   4          1HG       GLN   4 -25.142   8.626  11.276
   30   1HE2  GLN   4          1HE2      GLN   4 -22.245   8.702  10.819
   31   2HE2  GLN   4          2HE2      GLN   4 -21.801   7.183  10.205
   32    H    ASP   5           H        ASP   5 -24.817  11.865   9.099
   33    HA   ASP   5           HA       ASP   5 -24.340  12.249   6.240
   34   1HB   ASP   5          2HB       ASP   5 -22.396  13.607   7.855
   35   2HB   ASP   5          1HB       ASP   5 -23.748  14.299   6.958
   36    H    ASP   6           H        ASP   6 -23.269  10.467   5.391
   37    HA   ASP   6           HA       ASP   6 -20.438  10.198   6.071
   38   1HB   ASP   6          2HB       ASP   6 -22.093   8.629   7.564
   39   2HB   ASP   6          1HB       ASP   6 -21.810   7.576   6.179
   40    H    TYR   7           H        TYR   7 -19.576  10.171   4.051
   41    HA   TYR   7           HA       TYR   7 -20.629   8.229   2.087
   42   1HB   TYR   7          2HB       TYR   7 -21.238  11.029   1.968
   43   2HB   TYR   7          1HB       TYR   7 -20.155  10.642   0.633
   44    HD1  TYR   7           HD1      TYR   7 -20.730   8.272  -0.538
   45    HD2  TYR   7           HD2      TYR   7 -23.515  10.762   1.585
   46    HE1  TYR   7           HE1      TYR   7 -22.610   7.210  -1.757
   47    HE2  TYR   7           HE2      TYR   7 -25.394   9.698   0.365
   48    HH   TYR   7           HH       TYR   7 -25.795   8.482  -1.692
   49    H    LEU   8           H        LEU   8 -18.406   7.495   2.986
   50    HA   LEU   8           HA       LEU   8 -16.110   7.171   2.612
   51   1HB   LEU   8          2HB       LEU   8 -17.325   7.868   0.024
   52   2HB   LEU   8          1HB       LEU   8 -15.594   8.193   0.104
   53    HG   LEU   8           HG       LEU   8 -16.773   5.568   1.029
   54   1HD1  LEU   8          1HD1      LEU   8 -17.370   5.977  -1.358
   55   2HD1  LEU   8          2HD1      LEU   8 -16.233   4.642  -1.168
   56   3HD1  LEU   8          3HD1      LEU   8 -15.660   6.215  -1.719
   57   1HD2  LEU   8          1HD2      LEU   8 -14.124   6.774   0.867
   58   2HD2  LEU   8          2HD2      LEU   8 -14.194   5.258  -0.030
   59   3HD2  LEU   8          3HD2      LEU   8 -14.626   5.292   1.679
   60    H    SER   9           H        SER   9 -14.081   8.334   2.599
   61    HA   SER   9           HA       SER   9 -14.417  11.302   2.784
   62   1HB   SER   9          2HB       SER   9 -13.397   9.400   4.720
   63   2HB   SER   9          1HB       SER   9 -12.152  10.570   4.295
   64    HG   SER   9           HG       SER   9 -13.561  11.254   6.011
   65    H    VAL  10           H        VAL  10 -13.845  10.992   0.386
   66    HA   VAL  10           HA       VAL  10 -11.480  10.021  -0.657
   67    HB   VAL  10           HB       VAL  10 -12.978  12.569  -1.269
   68   1HG1  VAL  10          1HG1      VAL  10 -11.486  12.374  -3.446
   69   2HG1  VAL  10          2HG1      VAL  10 -10.355  11.586  -2.346
   70   3HG1  VAL  10          3HG1      VAL  10 -10.885  13.240  -2.033
   71   1HG2  VAL  10          1HG2      VAL  10 -13.699  10.078  -1.804
   72   2HG2  VAL  10          2HG2      VAL  10 -12.534  10.245  -3.118
   73   3HG2  VAL  10          3HG2      VAL  10 -13.913  11.340  -3.016
   74    H    GLU  11           H        GLU  11 -11.810  12.472   1.717
   75    HA   GLU  11           HA       GLU  11  -9.322  13.864   1.229
   76   1HB   GLU  11          2HB       GLU  11 -11.358  14.596   2.675
   77   2HB   GLU  11          1HB       GLU  11 -10.617  13.614   3.940
   78   1HG   GLU  11          2HG       GLU  11  -9.746  15.801   4.272
   79   2HG   GLU  11          1HG       GLU  11  -8.455  14.912   3.462
   80    H    GLU  12           H        GLU  12 -10.247  11.383   3.654
   81    HA   GLU  12           HA       GLU  12  -7.751  11.008   4.853
   82   1HB   GLU  12          2HB       GLU  12  -8.533   8.915   5.596
   83   2HB   GLU  12          1HB       GLU  12 -10.020   9.822   5.316
   84   1HG   GLU  12          2HG       GLU  12 -10.111   8.820   3.009
   85   2HG   GLU  12          1HG       GLU  12  -8.744   7.799   3.455
   86    H    LEU  13           H        LEU  13  -8.912   9.742   1.750
   87    HA   LEU  13           HA       LEU  13  -6.667   8.031   1.240
   88   1HB   LEU  13          2HB       LEU  13  -8.335   9.493  -0.827
   89   2HB   LEU  13          1HB       LEU  13  -7.436   7.991  -1.049
   90    HG   LEU  13           HG       LEU  13  -9.737   8.329   0.897
   91   1HD1  LEU  13          1HD1      LEU  13  -9.918   8.237  -1.858
   92   2HD1  LEU  13          2HD1      LEU  13 -11.187   7.732  -0.741
   93   3HD1  LEU  13          3HD1      LEU  13 -10.073   6.538  -1.409
   94   1HD2  LEU  13          1HD2      LEU  13  -9.612   5.771   0.767
   95   2HD2  LEU  13          2HD2      LEU  13  -8.301   6.569   1.636
   96   3HD2  LEU  13          3HD2      LEU  13  -8.045   5.990  -0.011
   97    H    ILE  14           H        ILE  14  -7.352  11.395   0.232
   98    HA   ILE  14           HA       ILE  14  -4.928  11.826  -1.182
   99    HB   ILE  14           HB       ILE  14  -6.763  13.691   0.330
  100   1HG1  ILE  14          2HG1      ILE  14  -6.165  13.542  -2.630
  101   2HG1  ILE  14          1HG1      ILE  14  -7.401  12.533  -1.879
  102   1HG2  ILE  14          1HG2      ILE  14  -4.938  15.065   0.429
  103   2HG2  ILE  14          2HG2      ILE  14  -5.326  15.346  -1.268
  104   3HG2  ILE  14          3HG2      ILE  14  -4.077  14.181  -0.831
  105   1HD1  ILE  14          1HD1      ILE  14  -7.625  15.316  -1.042
  106   2HD1  ILE  14          2HD1      ILE  14  -8.850  14.257  -1.741
  107   3HD1  ILE  14          3HD1      ILE  14  -7.748  15.146  -2.793
  108    H    GLU  15           H        GLU  15  -5.701  12.313   2.265
  109    HA   GLU  15           HA       GLU  15  -3.230  13.432   3.070
  110   1HB   GLU  15          2HB       GLU  15  -5.442  12.946   4.418
  111   2HB   GLU  15          1HB       GLU  15  -4.632  11.430   4.816
  112   1HG   GLU  15          2HG       GLU  15  -2.759  12.595   5.786
  113   2HG   GLU  15          1HG       GLU  15  -3.353  14.148   5.198
  114    H    ILE  16           H        ILE  16  -4.144   9.997   3.544
  115    HA   ILE  16           HA       ILE  16  -1.619   8.988   4.145
  116    HB   ILE  16           HB       ILE  16  -4.025   7.844   2.780
  117   1HG1  ILE  16          2HG1      ILE  16  -4.071   6.438   4.728
  118   2HG1  ILE  16          1HG1      ILE  16  -2.416   6.872   5.155
  119   1HG2  ILE  16          1HG2      ILE  16  -1.257   6.661   2.772
  120   2HG2  ILE  16          2HG2      ILE  16  -2.451   6.691   1.475
  121   3HG2  ILE  16          3HG2      ILE  16  -2.670   5.610   2.851
  122   1HD1  ILE  16          1HD1      ILE  16  -3.018   8.990   5.908
  123   2HD1  ILE  16          2HD1      ILE  16  -4.442   8.053   6.366
  124   3HD1  ILE  16          3HD1      ILE  16  -4.471   9.044   4.908
  125    H    GLN  17           H        GLN  17  -3.009   9.504   0.901
  126    HA   GLN  17           HA       GLN  17  -0.885   8.469  -0.636
  127   1HB   GLN  17          2HB       GLN  17  -3.206  10.071  -1.088
  128   2HB   GLN  17          1HB       GLN  17  -1.849  10.854  -1.896
  129   1HG   GLN  17          2HG       GLN  17  -2.307   7.886  -2.178
  130   2HG   GLN  17          1HG       GLN  17  -3.162   9.037  -3.204
  131   1HE2  GLN  17          1HE2      GLN  17  -1.179  10.983  -3.639
  132   2HE2  GLN  17          2HE2      GLN  17   0.124  10.287  -4.475
  133    H    LYS  18           H        LYS  18  -1.269  11.728   0.756
  134    HA   LYS  18           HA       LYS  18   1.098  12.848  -0.374
  135   1HB   LYS  18          2HB       LYS  18  -0.504  13.464   2.108
  136   2HB   LYS  18          1HB       LYS  18   0.966  14.361   1.723
  137   1HG   LYS  18          2HG       LYS  18   0.026  14.934  -0.495
  138   2HG   LYS  18          1HG       LYS  18  -1.454  14.069  -0.081
  139   1HD   LYS  18          2HD       LYS  18  -1.884  15.595   1.768
  140   2HD   LYS  18          1HD       LYS  18  -0.346  16.413   1.491
  141   1HE   LYS  18          2HE       LYS  18  -2.786  16.391  -0.291
  142   2HE   LYS  18          1HE       LYS  18  -1.979  17.783   0.429
  143   1HZ   LYS  18          1HZ       LYS  18  -1.296  16.271  -1.946
  144   2HZ   LYS  18          2HZ       LYS  18   0.020  16.688  -0.955
  145   3HZ   LYS  18          3HZ       LYS  18  -1.000  17.899  -1.572
  146    H    GLU  19           H        GLU  19   0.570  10.955   2.581
  147    HA   GLU  19           HA       GLU  19   3.177  11.297   3.693
  148   1HB   GLU  19          2HB       GLU  19   1.052  10.188   4.718
  149   2HB   GLU  19          1HB       GLU  19   1.637   8.719   3.934
  150   1HG   GLU  19          2HG       GLU  19   3.815   8.988   5.091
  151   2HG   GLU  19          1HG       GLU  19   3.187  10.419   5.910
  152    H    GLU  20           H        GLU  20   1.932   8.484   1.846
  153    HA   GLU  20           HA       GLU  20   4.326   7.103   1.503
  154   1HB   GLU  20          2HB       GLU  20   1.941   6.527   0.654
  155   2HB   GLU  20          1HB       GLU  20   2.394   7.428  -0.792
  156   1HG   GLU  20          2HG       GLU  20   3.500   5.629  -1.561
  157   2HG   GLU  20          1HG       GLU  20   4.563   5.689  -0.156
  158    H    THR  21           H        THR  21   3.209   9.990  -0.197
  159    HA   THR  21           HA       THR  21   5.266   9.982  -2.213
  160    HB   THR  21           HB       THR  21   4.019  12.503  -1.139
  161    HG1  THR  21           HG1      THR  21   2.218  11.382  -1.345
  162   1HG2  THR  21          1HG2      THR  21   4.996  11.477  -3.800
  163   2HG2  THR  21          2HG2      THR  21   5.493  12.929  -2.929
  164   3HG2  THR  21          3HG2      THR  21   3.908  12.862  -3.701
  165    H    ARG  22           H        ARG  22   4.940  11.997   0.732
  166    HA   ARG  22           HA       ARG  22   7.405  13.258   0.727
  167   1HB   ARG  22          2HB       ARG  22   5.626  12.243   2.900
  168   2HB   ARG  22          1HB       ARG  22   7.247  12.775   3.351
  169   1HG   ARG  22          2HG       ARG  22   5.767  14.562   1.501
  170   2HG   ARG  22          1HG       ARG  22   5.138  14.466   3.146
  171   1HD   ARG  22          2HD       ARG  22   8.029  15.047   2.439
  172   2HD   ARG  22          1HD       ARG  22   6.840  16.270   2.887
  173    HE   ARG  22           HE       ARG  22   6.758  14.455   4.984
  174   1HH1  ARG  22          1HH2      ARG  22   9.175  16.284   3.338
  175   2HH1  ARG  22          2HH2      ARG  22  10.192  16.440   4.731
  176   1HH2  ARG  22          2HH1      ARG  22   8.071  14.648   6.809
  177   2HH2  ARG  22          1HH1      ARG  22   9.568  15.514   6.697
  178    H    ASP  23           H        ASP  23   6.743   9.952   1.913
  179    HA   ASP  23           HA       ASP  23   9.410   9.398   2.775
  180   1HB   ASP  23          2HB       ASP  23   7.198   7.575   1.797
  181   2HB   ASP  23          1HB       ASP  23   8.720   6.982   2.464
  182    H    ILE  24           H        ILE  24   7.799   8.745  -0.348
  183    HA   ILE  24           HA       ILE  24  10.079   7.521  -1.575
  184    HB   ILE  24           HB       ILE  24   7.640   8.912  -2.695
  185   1HG1  ILE  24          2HG1      ILE  24   8.523   6.014  -2.800
  186   2HG1  ILE  24          1HG1      ILE  24   7.471   6.661  -1.541
  187   1HG2  ILE  24          1HG2      ILE  24  10.136   8.072  -4.036
  188   2HG2  ILE  24          2HG2      ILE  24   8.889   9.197  -4.578
  189   3HG2  ILE  24          3HG2      ILE  24   8.658   7.460  -4.777
  190   1HD1  ILE  24          1HD1      ILE  24   6.497   7.483  -4.128
  191   2HD1  ILE  24          2HD1      ILE  24   5.683   6.514  -2.899
  192   3HD1  ILE  24          3HD1      ILE  24   6.708   5.732  -4.104
  193    H    ILE  25           H        ILE  25   8.804  10.854  -1.952
  194    HA   ILE  25           HA       ILE  25  10.860  11.887  -3.554
  195    HB   ILE  25           HB       ILE  25   9.508  13.360  -1.275
  196   1HG1  ILE  25          2HG1      ILE  25   7.767  12.345  -2.576
  197   2HG1  ILE  25          1HG1      ILE  25   7.884  14.015  -3.130
  198   1HG2  ILE  25          1HG2      ILE  25  10.712  15.100  -2.044
  199   2HG2  ILE  25          2HG2      ILE  25   9.847  14.965  -3.575
  200   3HG2  ILE  25          3HG2      ILE  25  11.376  14.116  -3.348
  201   1HD1  ILE  25          1HD1      ILE  25   9.549  13.080  -4.893
  202   2HD1  ILE  25          2HD1      ILE  25   7.826  12.790  -5.139
  203   3HD1  ILE  25          3HD1      ILE  25   8.854  11.510  -4.493
  204    H    GLN  26           H        GLN  26  10.881  11.165  -0.116
  205    HA   GLN  26           HA       GLN  26  13.250  12.643   0.556
  206   1HB   GLN  26          2HB       GLN  26  11.701  10.400   1.779
  207   2HB   GLN  26          1HB       GLN  26  13.342  10.680   2.361
  208   1HG   GLN  26          2HG       GLN  26  11.179  12.799   2.201
  209   2HG   GLN  26          1HG       GLN  26  11.651  11.951   3.674
  210   1HE2  GLN  26          1HE2      GLN  26  14.278  12.009   3.902
  211   2HE2  GLN  26          2HE2      GLN  26  14.945  13.556   3.703
  212    H    ALA  27           H        ALA  27  12.874   9.115   0.037
  213    HA   ALA  27           HA       ALA  27  15.567   8.401   0.036
  214   1HB   ALA  27          1HB       ALA  27  13.397   7.335  -1.797
  215   2HB   ALA  27          2HB       ALA  27  13.756   6.754  -0.170
  216   3HB   ALA  27          3HB       ALA  27  14.932   6.533  -1.465
  217    H    LEU  28           H        LEU  28  13.683   9.586  -2.764
  218    HA   LEU  28           HA       LEU  28  15.856   9.474  -4.623
  219   1HB   LEU  28          2HB       LEU  28  13.254  10.976  -4.510
  220   2HB   LEU  28          1HB       LEU  28  14.428  11.346  -5.774
  221    HG   LEU  28           HG       LEU  28  13.934   8.465  -5.343
  222   1HD1  LEU  28          1HD1      LEU  28  11.653   9.319  -5.035
  223   2HD1  LEU  28          2HD1      LEU  28  11.793   8.524  -6.603
  224   3HD1  LEU  28          3HD1      LEU  28  11.800  10.285  -6.503
  225   1HD2  LEU  28          1HD2      LEU  28  15.276   9.768  -7.187
  226   2HD2  LEU  28          2HD2      LEU  28  13.690  10.004  -7.917
  227   3HD2  LEU  28          3HD2      LEU  28  14.305   8.373  -7.656
  228    H    LEU  29           H        LEU  29  14.428  12.478  -3.290
  229    HA   LEU  29           HA       LEU  29  16.407  14.272  -3.942
  230   1HB   LEU  29          2HB       LEU  29  14.250  14.299  -2.210
  231   2HB   LEU  29          1HB       LEU  29  15.616  14.579  -1.132
  232    HG   LEU  29           HG       LEU  29  14.724  16.707  -2.018
  233   1HD1  LEU  29          1HD1      LEU  29  17.202  16.317  -1.556
  234   2HD1  LEU  29          2HD1      LEU  29  16.828  17.655  -2.642
  235   3HD1  LEU  29          3HD1      LEU  29  17.403  16.122  -3.297
  236   1HD2  LEU  29          1HD2      LEU  29  14.239  17.024  -4.211
  237   2HD2  LEU  29          2HD2      LEU  29  14.370  15.271  -4.358
  238   3HD2  LEU  29          3HD2      LEU  29  15.756  16.294  -4.737
  239    H    GLU  30           H        GLU  30  16.524  11.916  -1.295
  240    HA   GLU  30           HA       GLU  30  18.919  12.820  -0.062
  241   1HB   GLU  30          2HB       GLU  30  17.185  10.774   0.413
  242   2HB   GLU  30          1HB       GLU  30  18.558   9.886  -0.246
  243   1HG   GLU  30          2HG       GLU  30  19.089   9.979   2.031
  244   2HG   GLU  30          1HG       GLU  30  19.966  11.369   1.392
  245    H    ASP  31           H        ASP  31  18.499  10.335  -2.610
  246    HA   ASP  31           HA       ASP  31  21.231   9.766  -3.027
  247   1HB   ASP  31          2HB       ASP  31  18.756   9.244  -4.370
  248   2HB   ASP  31          1HB       ASP  31  19.926   9.793  -5.570
  249    H    GLY  32           H        GLY  32  19.313  12.526  -4.042
  250   1HA   GLY  32          2HA       GLY  32  20.581  14.643  -4.400
  251   2HA   GLY  32          1HA       GLY  32  21.792  13.685  -5.253
  252    H    SER  33           H        SER  33  18.591  12.682  -5.861
  253    HA   SER  33           HA       SER  33  18.657  13.008  -8.626
  254   1HB   SER  33          2HB       SER  33  16.893  11.751  -7.413
  255   2HB   SER  33          1HB       SER  33  16.207  13.274  -6.855
  256    HG   SER  33           HG       SER  33  16.355  13.676  -9.340
  257    H    ASP  34           H        ASP  34  18.120  14.673 -10.059
  258    HA   ASP  34           HA       ASP  34  17.838  17.369  -8.809
  259   1HB   ASP  34          2HB       ASP  34  19.163  16.348 -11.281
  260   2HB   ASP  34          1HB       ASP  34  18.447  17.958 -11.358
  261    HA   PRO  35           HA       PRO  35  13.725  17.590 -10.423
  262   1HB   PRO  35          2HB       PRO  35  13.464  20.315 -10.615
  263   2HB   PRO  35          1HB       PRO  35  13.387  19.426  -9.081
  264   1HG   PRO  35          2HG       PRO  35  15.626  20.985 -10.256
  265   2HG   PRO  35          1HG       PRO  35  15.116  20.834  -8.567
  266   1HD   PRO  35          2HD       PRO  35  17.263  19.481  -9.615
  267   2HD   PRO  35          1HD       PRO  35  16.308  18.885  -8.241
  268    H    ASP  36           H        ASP  36  16.413  18.946 -12.151
  269    HA   ASP  36           HA       ASP  36  14.798  19.569 -14.541
  270   1HB   ASP  36          2HB       ASP  36  17.692  19.857 -13.778
  271   2HB   ASP  36          1HB       ASP  36  17.227  19.926 -15.478
  272    H    ALA  37           H        ALA  37  15.662  16.758 -13.226
  273    HA   ALA  37           HA       ALA  37  16.782  15.487 -15.646
  274   1HB   ALA  37          1HB       ALA  37  15.895  14.033 -13.159
  275   2HB   ALA  37          2HB       ALA  37  17.414  14.928 -13.190
  276   3HB   ALA  37          3HB       ALA  37  17.160  13.586 -14.306
  277    H    LEU  38           H        LEU  38  13.721  16.221 -14.391
  278    HA   LEU  38           HA       LEU  38  11.572  15.615 -15.121
  279   1HB   LEU  38          2HB       LEU  38  12.986  15.643 -17.372
  280   2HB   LEU  38          1HB       LEU  38  12.726  13.902 -17.289
  281    HG   LEU  38           HG       LEU  38  10.254  14.405 -16.950
  282   1HD1  LEU  38          1HD1      LEU  38   9.880  16.593 -16.437
  283   2HD1  LEU  38          2HD1      LEU  38   9.937  16.828 -18.184
  284   3HD1  LEU  38          3HD1      LEU  38  11.373  17.128 -17.207
  285   1HD2  LEU  38          1HD2      LEU  38  11.441  15.418 -19.552
  286   2HD2  LEU  38          2HD2      LEU  38   9.855  14.681 -19.324
  287   3HD2  LEU  38          3HD2      LEU  38  11.313  13.709 -19.133
  288    H    TYR  39           H        TYR  39  10.183  13.967 -14.514
  289    HA   TYR  39           HA       TYR  39  11.368  11.258 -14.101
  290   1HB   TYR  39          2HB       TYR  39  10.128  13.080 -12.107
  291   2HB   TYR  39          1HB       TYR  39   9.639  11.388 -12.021
  292    HD1  TYR  39           HD1      TYR  39  12.428  13.755 -11.674
  293    HD2  TYR  39           HD2      TYR  39  11.276   9.617 -11.558
  294    HE1  TYR  39           HE1      TYR  39  14.576  13.186 -10.571
  295    HE2  TYR  39           HE2      TYR  39  13.424   9.051 -10.456
  296    HH   TYR  39           HH       TYR  39  15.795  11.587  -9.643
  297    H    GLU  40           H        GLU  40   9.891   9.541 -14.423
  298    HA   GLU  40           HA       GLU  40   7.340  10.363 -15.732
  299   1HB   GLU  40          2HB       GLU  40   9.088   7.912 -15.943
  300   2HB   GLU  40          1HB       GLU  40   7.413   7.885 -16.497
  301   1HG   GLU  40          2HG       GLU  40   7.837   9.256 -18.278
  302   2HG   GLU  40          1HG       GLU  40   9.030  10.206 -17.391
  303    H    ILE  41           H        ILE  41   5.509  10.097 -14.563
  304    HA   ILE  41           HA       ILE  41   5.597   8.436 -12.117
  305    HB   ILE  41           HB       ILE  41   3.115   9.860 -12.981
  306   1HG1  ILE  41          2HG1      ILE  41   5.019  11.412 -13.530
  307   2HG1  ILE  41          1HG1      ILE  41   3.967  12.017 -12.253
  308   1HG2  ILE  41          1HG2      ILE  41   3.190  10.443 -10.507
  309   2HG2  ILE  41          2HG2      ILE  41   4.609   9.403 -10.388
  310   3HG2  ILE  41          3HG2      ILE  41   3.055   8.724 -10.870
  311   1HD1  ILE  41          1HD1      ILE  41   6.393  10.389 -11.542
  312   2HD1  ILE  41          2HD1      ILE  41   5.535  11.583 -10.570
  313   3HD1  ILE  41          3HD1      ILE  41   6.559  12.106 -11.907
  314    H    GLU  42           H        GLU  42   4.804   6.398 -12.089
  315    HA   GLU  42           HA       GLU  42   3.121   5.521 -14.394
  316   1HB   GLU  42          2HB       GLU  42   5.283   4.310 -13.974
  317   2HB   GLU  42          1HB       GLU  42   4.645   3.811 -12.407
  318   1HG   GLU  42          2HG       GLU  42   3.583   2.091 -13.392
  319   2HG   GLU  42          1HG       GLU  42   2.656   3.229 -14.369
  320    H    HIS  43           H        HIS  43   0.980   5.432 -13.920
  321    HA   HIS  43           HA       HIS  43   0.199   4.823 -11.099
  322   1HB   HIS  43          2HB       HIS  43  -1.223   6.347 -13.297
  323   2HB   HIS  43          1HB       HIS  43  -2.018   5.855 -11.801
  324    HD2  HIS  43           HD2      HIS  43   1.548   7.599 -12.277
  325    HE1  HIS  43           HE1      HIS  43  -0.705   9.763  -9.435
  326    HE2  HIS  43           HE2      HIS  43   1.533   9.613 -10.619
  327    H    HIS  44           H        HIS  44  -1.097   3.051 -10.719
  328    HA   HIS  44           HA       HIS  44  -1.850   1.427 -13.115
  329   1HB   HIS  44          2HB       HIS  44  -1.125   0.630 -10.286
  330   2HB   HIS  44          1HB       HIS  44  -1.881  -0.486 -11.422
  331    HD2  HIS  44           HD2      HIS  44   0.550   1.748 -13.324
  332    HE1  HIS  44           HE1      HIS  44   2.740  -1.720 -12.320
  333    HE2  HIS  44           HE2      HIS  44   2.738   0.389 -13.729
  334    H    LEU  45           H        LEU  45  -3.998   0.884 -13.370
  335    HA   LEU  45           HA       LEU  45  -5.846   1.340 -11.082
  336   1HB   LEU  45          2HB       LEU  45  -6.390   2.395 -13.869
  337   2HB   LEU  45          1HB       LEU  45  -7.372   2.645 -12.425
  338    HG   LEU  45           HG       LEU  45  -5.019   3.597 -11.517
  339   1HD1  LEU  45          1HD1      LEU  45  -4.196   3.094 -13.983
  340   2HD1  LEU  45          2HD1      LEU  45  -3.682   4.564 -13.156
  341   3HD1  LEU  45          3HD1      LEU  45  -4.993   4.628 -14.333
  342   1HD2  LEU  45          1HD2      LEU  45  -7.307   4.858 -12.987
  343   2HD2  LEU  45          2HD2      LEU  45  -5.932   5.871 -12.544
  344   3HD2  LEU  45          3HD2      LEU  45  -6.841   5.021 -11.293
  345    H    PHE  46           H        PHE  46  -7.653  -0.031 -11.113
  346    HA   PHE  46           HA       PHE  46  -7.833  -1.919 -13.423
  347   1HB   PHE  46          2HB       PHE  46  -8.664  -3.251 -11.039
  348   2HB   PHE  46          1HB       PHE  46  -7.291  -3.639 -12.077
  349    HD1  PHE  46           HD1      PHE  46  -8.259  -2.605  -8.836
  350    HD2  PHE  46           HD2      PHE  46  -5.175  -2.079 -11.778
  351    HE1  PHE  46           HE1      PHE  46  -6.704  -1.831  -7.067
  352    HE2  PHE  46           HE2      PHE  46  -3.619  -1.305 -10.009
  353    HZ   PHE  46           HZ       PHE  46  -4.384  -1.181  -7.652
  354    H    ALA  47           H        ALA  47  -9.979  -2.792 -13.765
  355    HA   ALA  47           HA       ALA  47 -12.149  -1.400 -12.265
  356   1HB   ALA  47          1HB       ALA  47 -11.393  -0.703 -14.847
  357   2HB   ALA  47          2HB       ALA  47 -12.952  -0.352 -14.101
  358   3HB   ALA  47          3HB       ALA  47 -12.757  -1.792 -15.101
  359    H    GLU  48           H        GLU  48 -14.337  -2.482 -12.858
  360    HA   GLU  48           HA       GLU  48 -13.873  -5.431 -12.969
  361   1HB   GLU  48          2HB       GLU  48 -16.093  -3.786 -11.724
  362   2HB   GLU  48          1HB       GLU  48 -16.158  -5.543 -11.878
  363   1HG   GLU  48          2HG       GLU  48 -15.313  -4.917  -9.658
  364   2HG   GLU  48          1HG       GLU  48 -14.048  -5.722 -10.589
  365    H    ASP  49           H        ASP  49 -15.145  -2.803 -14.712
  366    HA   ASP  49           HA       ASP  49 -16.511  -4.710 -16.555
  367   1HB   ASP  49          2HB       ASP  49 -17.599  -2.174 -15.357
  368   2HB   ASP  49          1HB       ASP  49 -18.136  -2.693 -16.955
  369    H    PHE  50           H        PHE  50 -15.759  -4.467 -18.610
  370    HA   PHE  50           HA       PHE  50 -13.715  -2.616 -19.294
  371   1HB   PHE  50          2HB       PHE  50 -14.853  -3.225 -21.720
  372   2HB   PHE  50          1HB       PHE  50 -13.675  -4.238 -20.887
  373    HD1  PHE  50           HD1      PHE  50 -17.361  -3.567 -21.022
  374    HD2  PHE  50           HD2      PHE  50 -14.241  -6.430 -20.308
  375    HE1  PHE  50           HE1      PHE  50 -19.060  -5.359 -20.789
  376    HE2  PHE  50           HE2      PHE  50 -15.939  -8.222 -20.073
  377    HZ   PHE  50           HZ       PHE  50 -18.349  -7.687 -20.313
  378    H    ASP  51           H        ASP  51 -17.120  -2.199 -19.066
  379    HA   ASP  51           HA       ASP  51 -17.494  -0.112 -20.988
  380   1HB   ASP  51          2HB       ASP  51 -19.332  -1.353 -19.795
  381   2HB   ASP  51          1HB       ASP  51 -18.936  -0.436 -18.341
  382    H    LYS  52           H        LYS  52 -17.370   0.322 -17.435
  383    HA   LYS  52           HA       LYS  52 -16.774   3.105 -17.574
  384   1HB   LYS  52          2HB       LYS  52 -16.291   2.964 -15.223
  385   2HB   LYS  52          1HB       LYS  52 -17.594   1.818 -15.539
  386   1HG   LYS  52          2HG       LYS  52 -15.875   0.005 -15.748
  387   2HG   LYS  52          1HG       LYS  52 -14.646   1.172 -15.260
  388   1HD   LYS  52          2HD       LYS  52 -15.510   1.372 -13.090
  389   2HD   LYS  52          1HD       LYS  52 -17.097   0.767 -13.565
  390   1HE   LYS  52          2HE       LYS  52 -16.495  -1.363 -13.146
  391   2HE   LYS  52          1HE       LYS  52 -15.026  -1.197 -14.108
  392   1HZ   LYS  52          1HZ       LYS  52 -14.125   0.074 -12.122
  393   2HZ   LYS  52          2HZ       LYS  52 -14.286  -1.609 -11.952
  394   3HZ   LYS  52          3HZ       LYS  52 -15.430  -0.567 -11.249
  395    H    LEU  53           H        LEU  53 -14.732   0.268 -17.783
  396    HA   LEU  53           HA       LEU  53 -12.220   1.487 -17.203
  397   1HB   LEU  53          2HB       LEU  53 -12.843  -1.024 -17.627
  398   2HB   LEU  53          1HB       LEU  53 -12.505  -0.637 -19.314
  399    HG   LEU  53           HG       LEU  53 -10.570  -0.005 -17.076
  400   1HD1  LEU  53          1HD1      LEU  53  -9.581  -2.078 -17.270
  401   2HD1  LEU  53          2HD1      LEU  53 -10.111  -2.293 -18.938
  402   3HD1  LEU  53          3HD1      LEU  53 -11.249  -2.541 -17.614
  403   1HD2  LEU  53          1HD2      LEU  53  -9.031  -0.211 -19.202
  404   2HD2  LEU  53          2HD2      LEU  53  -9.961   1.266 -18.943
  405   3HD2  LEU  53          3HD2      LEU  53 -10.537   0.049 -20.082
  406    H    GLU  54           H        GLU  54 -13.712   0.854 -20.403
  407    HA   GLU  54           HA       GLU  54 -11.793   2.287 -21.920
  408   1HB   GLU  54          2HB       GLU  54 -13.812   0.773 -22.666
  409   2HB   GLU  54          1HB       GLU  54 -14.696   2.299 -22.703
  410   1HG   GLU  54          2HG       GLU  54 -12.278   2.880 -23.977
  411   2HG   GLU  54          1HG       GLU  54 -12.708   1.277 -24.572
  412    H    LYS  55           H        LYS  55 -14.807   3.412 -20.383
  413    HA   LYS  55           HA       LYS  55 -14.731   6.078 -21.380
  414   1HB   LYS  55          2HB       LYS  55 -15.867   4.889 -18.840
  415   2HB   LYS  55          1HB       LYS  55 -16.052   6.596 -19.247
  416   1HG   LYS  55          2HG       LYS  55 -17.048   5.895 -21.446
  417   2HG   LYS  55          1HG       LYS  55 -17.007   4.226 -20.877
  418   1HD   LYS  55          2HD       LYS  55 -18.347   5.017 -18.856
  419   2HD   LYS  55          1HD       LYS  55 -18.585   6.534 -19.723
  420   1HE   LYS  55          2HE       LYS  55 -19.393   3.775 -20.690
  421   2HE   LYS  55          1HE       LYS  55 -20.483   5.048 -20.140
  422   1HZ   LYS  55          1HZ       LYS  55 -18.886   6.203 -22.065
  423   2HZ   LYS  55          2HZ       LYS  55 -20.521   5.770 -22.219
  424   3HZ   LYS  55          3HZ       LYS  55 -19.304   4.684 -22.694
  425    H    ALA  56           H        ALA  56 -13.713   4.953 -18.128
  426    HA   ALA  56           HA       ALA  56 -12.432   7.332 -17.332
  427   1HB   ALA  56          1HB       ALA  56 -11.906   6.120 -15.499
  428   2HB   ALA  56          2HB       ALA  56 -10.990   4.950 -16.451
  429   3HB   ALA  56          3HB       ALA  56 -12.736   4.771 -16.277
  430    H    ALA  57           H        ALA  57 -10.842   4.439 -18.738
  431    HA   ALA  57           HA       ALA  57  -8.258   5.405 -19.008
  432   1HB   ALA  57          1HB       ALA  57  -8.085   3.980 -21.062
  433   2HB   ALA  57          2HB       ALA  57  -9.834   3.765 -21.013
  434   3HB   ALA  57          3HB       ALA  57  -8.833   3.146 -19.700
  435    H    VAL  58           H        VAL  58 -10.676   5.660 -21.647
  436    HA   VAL  58           HA       VAL  58  -9.370   7.288 -23.417
  437    HB   VAL  58           HB       VAL  58 -12.214   7.138 -22.535
  438   1HG1  VAL  58          1HG1      VAL  58 -11.057   9.410 -24.169
  439   2HG1  VAL  58          2HG1      VAL  58 -12.063   9.524 -22.725
  440   3HG1  VAL  58          3HG1      VAL  58 -12.759   8.951 -24.241
  441   1HG2  VAL  58          1HG2      VAL  58 -11.255   5.636 -24.252
  442   2HG2  VAL  58          2HG2      VAL  58 -10.822   7.038 -25.230
  443   3HG2  VAL  58          3HG2      VAL  58 -12.518   6.659 -24.935
  444    H    GLU  59           H        GLU  59 -11.127   8.522 -20.550
  445    HA   GLU  59           HA       GLU  59 -10.478  11.248 -20.867
  446   1HB   GLU  59          2HB       GLU  59 -11.487   9.539 -18.749
  447   2HB   GLU  59          1HB       GLU  59 -10.397  10.766 -18.101
  448   1HG   GLU  59          2HG       GLU  59 -12.760  11.558 -18.215
  449   2HG   GLU  59          1HG       GLU  59 -11.673  12.534 -19.203
  450    H    ALA  60           H        ALA  60  -8.747   8.872 -18.808
  451    HA   ALA  60           HA       ALA  60  -6.625  10.369 -17.920
  452   1HB   ALA  60          1HB       ALA  60  -5.404   8.014 -18.905
  453   2HB   ALA  60          2HB       ALA  60  -7.059   7.571 -18.487
  454   3HB   ALA  60          3HB       ALA  60  -6.009   8.301 -17.274
  455    H    PHE  61           H        PHE  61  -6.839   8.905 -21.174
  456    HA   PHE  61           HA       PHE  61  -4.333   9.912 -22.111
  457   1HB   PHE  61          2HB       PHE  61  -5.602   8.127 -23.267
  458   2HB   PHE  61          1HB       PHE  61  -6.846   9.301 -23.699
  459    HD1  PHE  61           HD1      PHE  61  -3.411   8.158 -24.335
  460    HD2  PHE  61           HD2      PHE  61  -6.403  11.072 -25.339
  461    HE1  PHE  61           HE1      PHE  61  -2.094   8.822 -26.329
  462    HE2  PHE  61           HE2      PHE  61  -5.085  11.737 -27.334
  463    HZ   PHE  61           HZ       PHE  61  -2.931  10.612 -27.828
  464    H    LYS  62           H        LYS  62  -7.618  11.276 -22.194
  465    HA   LYS  62           HA       LYS  62  -7.025  13.556 -23.794
  466   1HB   LYS  62          2HB       LYS  62  -9.220  12.610 -22.197
  467   2HB   LYS  62          1HB       LYS  62  -8.933  14.309 -21.818
  468   1HG   LYS  62          2HG       LYS  62  -9.022  13.356 -24.678
  469   2HG   LYS  62          1HG       LYS  62 -10.503  13.762 -23.809
  470   1HD   LYS  62          2HD       LYS  62 -10.059  15.994 -23.833
  471   2HD   LYS  62          1HD       LYS  62  -8.334  15.751 -23.553
  472   1HE   LYS  62          2HE       LYS  62  -8.009  15.127 -25.895
  473   2HE   LYS  62          1HE       LYS  62  -9.741  15.265 -26.195
  474   1HZ   LYS  62          1HZ       LYS  62  -9.576  17.619 -25.512
  475   2HZ   LYS  62          2HZ       LYS  62  -8.673  17.264 -26.906
  476   3HZ   LYS  62          3HZ       LYS  62  -7.893  17.449 -25.408
  477    H    MET  63           H        MET  63  -6.773  13.045 -20.281
  478    HA   MET  63           HA       MET  63  -5.986  15.755 -19.689
  479   1HB   MET  63          2HB       MET  63  -5.589  13.156 -18.183
  480   2HB   MET  63          1HB       MET  63  -5.156  14.737 -17.533
  481   1HG   MET  63          2HG       MET  63  -7.588  15.417 -18.084
  482   2HG   MET  63          1HG       MET  63  -7.898  13.687 -18.234
  483   1HE   MET  63          1HE       MET  63  -8.289  12.357 -14.898
  484   2HE   MET  63          2HE       MET  63  -7.306  11.925 -16.294
  485   3HE   MET  63          3HE       MET  63  -8.932  12.556 -16.534
  486    H    GLY  64           H        GLY  64  -4.113  12.736 -20.100
  487   1HA   GLY  64          2HA       GLY  64  -2.022  13.405 -21.601
  488   2HA   GLY  64          1HA       GLY  64  -1.618  14.343 -20.162
  489    H    PHE  65           H        PHE  65  -3.225  11.211 -20.058
  490    HA   PHE  65           HA       PHE  65  -0.807  10.136 -18.671
  491   1HB   PHE  65          2HB       PHE  65  -3.756   9.610 -18.387
  492   2HB   PHE  65          1HB       PHE  65  -2.590   8.385 -17.884
  493    HD1  PHE  65           HD1      PHE  65  -3.984  11.702 -17.189
  494    HD2  PHE  65           HD2      PHE  65  -0.969   8.851 -16.079
  495    HE1  PHE  65           HE1      PHE  65  -3.587  12.944 -15.079
  496    HE2  PHE  65           HE2      PHE  65  -0.572  10.092 -13.970
  497    HZ   PHE  65           HZ       PHE  65  -1.880  12.139 -13.469
  498    H    GLU  66           H        GLU  66   0.356   8.742 -19.896
  499    HA   GLU  66           HA       GLU  66  -0.642   7.653 -22.377
  500   1HB   GLU  66          2HB       GLU  66   1.780   8.113 -21.882
  501   2HB   GLU  66          1HB       GLU  66   1.767   6.737 -20.779
  502   1HG   GLU  66          2HG       GLU  66   0.844   5.392 -22.794
  503   2HG   GLU  66          1HG       GLU  66   1.416   6.744 -23.773
  504    H    VAL  67           H        VAL  67  -2.573   6.513 -21.730
  505    HA   VAL  67           HA       VAL  67  -2.627   4.462 -19.745
  506    HB   VAL  67           HB       VAL  67  -4.626   5.562 -20.858
  507   1HG1  VAL  67          1HG1      VAL  67  -4.339   3.457 -22.984
  508   2HG1  VAL  67          2HG1      VAL  67  -3.541   5.017 -23.189
  509   3HG1  VAL  67          3HG1      VAL  67  -5.294   4.940 -23.010
  510   1HG2  VAL  67          1HG2      VAL  67  -5.943   3.390 -20.905
  511   2HG2  VAL  67          2HG2      VAL  67  -4.992   3.648 -19.442
  512   3HG2  VAL  67          3HG2      VAL  67  -4.412   2.543 -20.687
  513    H    LEU  68           H        LEU  68  -1.906   2.368 -19.809
  514    HA   LEU  68           HA       LEU  68  -0.782   1.407 -22.405
  515   1HB   LEU  68          2HB       LEU  68   0.311   1.512 -19.783
  516   2HB   LEU  68          1HB       LEU  68   0.057  -0.191 -20.167
  517    HG   LEU  68           HG       LEU  68   1.424   1.745 -22.052
  518   1HD1  LEU  68          1HD1      LEU  68   3.541   0.844 -21.276
  519   2HD1  LEU  68          2HD1      LEU  68   2.713  -0.265 -20.182
  520   3HD1  LEU  68          3HD1      LEU  68   2.661   1.472 -19.882
  521   1HD2  LEU  68          1HD2      LEU  68   2.233  -0.379 -23.073
  522   2HD2  LEU  68          2HD2      LEU  68   0.474  -0.258 -23.103
  523   3HD2  LEU  68          3HD2      LEU  68   1.268  -1.285 -21.907
  524    H    GLU  69           H        GLU  69  -1.224  -0.761 -23.048
  525    HA   GLU  69           HA       GLU  69  -3.822  -1.722 -22.724
  526   1HB   GLU  69          2HB       GLU  69  -2.723  -2.789 -24.458
  527   2HB   GLU  69          1HB       GLU  69  -1.233  -2.981 -23.535
  528   1HG   GLU  69          2HG       GLU  69  -2.137  -4.802 -22.272
  529   2HG   GLU  69          1HG       GLU  69  -3.771  -4.483 -22.858
  530    H    ALA  70           H        ALA  70  -4.724  -3.437 -21.443
  531    HA   ALA  70           HA       ALA  70  -3.405  -3.695 -18.785
  532   1HB   ALA  70          1HB       ALA  70  -5.580  -2.961 -18.382
  533   2HB   ALA  70          2HB       ALA  70  -5.797  -4.707 -18.284
  534   3HB   ALA  70          3HB       ALA  70  -6.240  -3.847 -19.758
  535    H    GLU  71           H        GLU  71  -3.741  -5.913 -17.728
  536    HA   GLU  71           HA       GLU  71  -3.728  -8.105 -19.748
  537   1HB   GLU  71          2HB       GLU  71  -1.377  -7.509 -19.225
  538   2HB   GLU  71          1HB       GLU  71  -1.700  -7.787 -17.514
  539   1HG   GLU  71          2HG       GLU  71  -2.439 -10.136 -18.157
  540   2HG   GLU  71          1HG       GLU  71  -1.770  -9.815 -19.757
  541    H    GLU  72           H        GLU  72  -5.429  -9.353 -19.139
  542    HA   GLU  72           HA       GLU  72  -6.880  -9.411 -16.826
  543   1HB   GLU  72          2HB       GLU  72  -7.070 -11.981 -17.230
  544   2HB   GLU  72          1HB       GLU  72  -7.632 -10.888 -18.494
  545   1HG   GLU  72          2HG       GLU  72  -4.781 -11.850 -18.490
  546   2HG   GLU  72          1HG       GLU  72  -6.060 -12.866 -19.157
  547    H    THR  73           H        THR  73  -5.850  -9.136 -14.862
  548    HA   THR  73           HA       THR  73  -3.692 -11.060 -14.144
  549    HB   THR  73           HB       THR  73  -3.363  -8.554 -13.843
  550    HG1  THR  73           HG1      THR  73  -2.034  -9.176 -12.364
  551   1HG2  THR  73          1HG2      THR  73  -5.261  -8.953 -11.519
  552   2HG2  THR  73          2HG2      THR  73  -5.737  -8.199 -13.042
  553   3HG2  THR  73          3HG2      THR  73  -4.499  -7.448 -12.035
  554    H    GLU  74           H        GLU  74  -4.126 -10.781 -11.293
  555    HA   GLU  74           HA       GLU  74  -6.848 -11.826 -10.824
  556   1HB   GLU  74          2HB       GLU  74  -5.519 -13.752  -9.492
  557   2HB   GLU  74          1HB       GLU  74  -6.040 -13.951 -11.165
  558   1HG   GLU  74          2HG       GLU  74  -3.897 -13.534 -12.020
  559   2HG   GLU  74          1HG       GLU  74  -3.367 -12.713 -10.550
  560    H    ASP  75           H        ASP  75  -7.530 -11.322  -8.763
  561    HA   ASP  75           HA       ASP  75  -5.909  -9.554  -7.159
  562   1HB   ASP  75          2HB       ASP  75  -8.357  -9.392  -7.155
  563   2HB   ASP  75          1HB       ASP  75  -8.480 -11.019  -6.486
  564    H    GLU  76           H        GLU  76  -4.364 -11.802  -7.481
  565    HA   GLU  76           HA       GLU  76  -3.348 -13.617  -6.343
  566   1HB   GLU  76          2HB       GLU  76  -3.408 -11.192  -4.688
  567   2HB   GLU  76          1HB       GLU  76  -3.191 -12.669  -3.749
  568   1HG   GLU  76          2HG       GLU  76  -1.230 -13.271  -4.935
  569   2HG   GLU  76          1HG       GLU  76  -1.572 -12.133  -6.239
  570    H    ASP  77           H        ASP  77  -6.418 -13.470  -6.278
  571    HA   ASP  77           HA       ASP  77  -6.733 -15.351  -3.976
  572   1HB   ASP  77          2HB       ASP  77  -7.819 -13.275  -3.341
  573   2HB   ASP  77          1HB       ASP  77  -8.662 -13.198  -4.887
  574    H    GLY  78           H        GLY  78  -7.666 -14.416  -7.243
  575   1HA   GLY  78          2HA       GLY  78  -7.901 -16.480  -8.740
  576   2HA   GLY  78          1HA       GLY  78  -9.044 -17.057  -7.526
  577    H    ASN  79           H        ASN  79  -8.770 -13.706  -8.617
  578    HA   ASN  79           HA       ASN  79 -11.577 -13.916  -9.613
  579   1HB   ASN  79          2HB       ASN  79 -10.012 -11.806  -8.232
  580   2HB   ASN  79          1HB       ASN  79 -11.099 -11.243  -9.502
  581   1HD2  ASN  79          1HD2      ASN  79 -11.159 -11.412  -6.310
  582   2HD2  ASN  79          2HD2      ASN  79 -12.751 -11.926  -6.018
  583    H    LYS  80           H        LYS  80 -11.471 -11.479 -11.135
  584    HA   LYS  80           HA       LYS  80  -9.328 -11.747 -13.108
  585   1HB   LYS  80          2HB       LYS  80 -11.326 -12.027 -14.892
  586   2HB   LYS  80          1HB       LYS  80 -10.473 -13.410 -14.205
  587   1HG   LYS  80          2HG       LYS  80 -12.199 -13.860 -12.659
  588   2HG   LYS  80          1HG       LYS  80 -12.903 -12.252 -12.845
  589   1HD   LYS  80          2HD       LYS  80 -12.756 -14.172 -15.167
  590   2HD   LYS  80          1HD       LYS  80 -14.098 -14.218 -14.024
  591   1HE   LYS  80          2HE       LYS  80 -14.275 -11.665 -14.462
  592   2HE   LYS  80          1HE       LYS  80 -13.295 -11.993 -15.891
  593   1HZ   LYS  80          1HZ       LYS  80 -15.221 -12.487 -16.863
  594   2HZ   LYS  80          2HZ       LYS  80 -16.058 -12.592 -15.388
  595   3HZ   LYS  80          3HZ       LYS  80 -15.187 -13.929 -15.972
  596    H    LEU  81           H        LEU  81  -8.982  -9.519 -12.819
  597    HA   LEU  81           HA       LEU  81 -11.190  -7.768 -13.825
  598   1HB   LEU  81          2HB       LEU  81  -9.294  -6.429 -12.043
  599   2HB   LEU  81          1HB       LEU  81 -11.058  -6.423 -12.009
  600    HG   LEU  81           HG       LEU  81 -10.807  -8.857 -11.100
  601   1HD1  LEU  81          1HD1      LEU  81  -8.226  -8.601 -11.606
  602   2HD1  LEU  81          2HD1      LEU  81  -8.762  -9.479 -10.173
  603   3HD1  LEU  81          3HD1      LEU  81  -8.207  -7.810 -10.029
  604   1HD2  LEU  81          1HD2      LEU  81 -11.736  -7.354  -9.586
  605   2HD2  LEU  81          2HD2      LEU  81 -10.355  -6.260  -9.670
  606   3HD2  LEU  81          3HD2      LEU  81 -10.235  -7.764  -8.757
  607    H    LEU  82           H        LEU  82 -10.526  -6.114 -15.242
  608    HA   LEU  82           HA       LEU  82  -7.965  -6.555 -16.567
  609   1HB   LEU  82          2HB       LEU  82  -9.880  -4.248 -16.999
  610   2HB   LEU  82          1HB       LEU  82  -8.689  -4.882 -18.135
  611    HG   LEU  82           HG       LEU  82 -10.568  -6.923 -17.176
  612   1HD1  LEU  82          1HD1      LEU  82 -12.509  -6.111 -18.381
  613   2HD1  LEU  82          2HD1      LEU  82 -11.627  -4.683 -18.924
  614   3HD1  LEU  82          3HD1      LEU  82 -12.029  -4.875 -17.218
  615   1HD2  LEU  82          1HD2      LEU  82  -8.965  -7.183 -19.063
  616   2HD2  LEU  82          2HD2      LEU  82  -9.822  -5.917 -19.942
  617   3HD2  LEU  82          3HD2      LEU  82 -10.633  -7.439 -19.575
  618    H    CYS  83           H        CYS  83  -6.086  -5.425 -16.231
  619    HA   CYS  83           HA       CYS  83  -6.248  -3.011 -14.468
  620   1HB   CYS  83          2HB       CYS  83  -3.931  -3.708 -13.680
  621   2HB   CYS  83          1HB       CYS  83  -5.250  -4.752 -13.151
  622    HG   CYS  83           HG       CYS  83  -3.811  -5.621 -15.747
  623    H    PHE  84           H        PHE  84  -5.898  -1.337 -15.878
  624    HA   PHE  84           HA       PHE  84  -3.842  -1.685 -18.001
  625   1HB   PHE  84          2HB       PHE  84  -4.768   0.544 -18.807
  626   2HB   PHE  84          1HB       PHE  84  -5.902  -0.805 -18.857
  627    HD1  PHE  84           HD1      PHE  84  -7.528  -1.102 -16.902
  628    HD2  PHE  84           HD2      PHE  84  -5.230   2.473 -17.524
  629    HE1  PHE  84           HE1      PHE  84  -9.079   0.151 -15.428
  630    HE2  PHE  84           HE2      PHE  84  -6.780   3.726 -16.049
  631    HZ   PHE  84           HZ       PHE  84  -8.705   2.565 -15.001
  632    H    ASP  85           H        ASP  85  -2.289   0.132 -18.320
  633    HA   ASP  85           HA       ASP  85  -1.502   1.274 -15.671
  634   1HB   ASP  85          2HB       ASP  85  -0.014   0.010 -17.843
  635   2HB   ASP  85          1HB       ASP  85   0.659   1.581 -17.406
  636    H    ALA  86           H        ALA  86  -0.224   3.413 -15.956
  637    HA   ALA  86           HA       ALA  86  -1.057   5.056 -18.246
  638   1HB   ALA  86          1HB       ALA  86  -2.305   5.254 -15.544
  639   2HB   ALA  86          2HB       ALA  86  -2.997   5.604 -17.128
  640   3HB   ALA  86          3HB       ALA  86  -1.915   6.767 -16.362
  641    H    THR  87           H        THR  87   0.653   6.378 -18.681
  642    HA   THR  87           HA       THR  87   2.526   6.987 -16.429
  643    HB   THR  87           HB       THR  87   3.630   7.409 -19.088
  644    HG1  THR  87           HG1      THR  87   3.369   4.720 -18.657
  645   1HG2  THR  87          1HG2      THR  87   4.754   7.080 -16.786
  646   2HG2  THR  87          2HG2      THR  87   5.474   6.257 -18.170
  647   3HG2  THR  87          3HG2      THR  87   4.461   5.359 -17.040
  648    H    MET  88           H        MET  88   3.360   9.131 -16.297
  649    HA   MET  88           HA       MET  88   2.370  11.163 -18.188
  650   1HB   MET  88          2HB       MET  88   0.545  10.883 -16.476
  651   2HB   MET  88          1HB       MET  88   1.704  11.368 -15.237
  652   1HG   MET  88          2HG       MET  88   1.803  13.558 -15.988
  653   2HG   MET  88          1HG       MET  88   1.385  13.119 -17.644
  654   1HE   MET  88          1HE       MET  88  -0.212  14.966 -17.977
  655   2HE   MET  88          2HE       MET  88   0.102  15.624 -16.373
  656   3HE   MET  88          3HE       MET  88  -1.559  15.407 -16.917
  657    H    GLN  89           H        GLN  89   4.282  12.162 -18.617
  658    HA   GLN  89           HA       GLN  89   6.559  12.185 -16.924
  659   1HB   GLN  89          2HB       GLN  89   5.809  14.241 -19.024
  660   2HB   GLN  89          1HB       GLN  89   7.430  13.926 -18.404
  661   1HG   GLN  89          2HG       GLN  89   5.970  11.567 -19.456
  662   2HG   GLN  89          1HG       GLN  89   6.452  12.767 -20.654
  663   1HE2  GLN  89          1HE2      GLN  89   7.775  10.431 -20.966
  664   2HE2  GLN  89          2HE2      GLN  89   9.353  10.501 -20.344
  665    H    SER  90           H        SER  90   7.327  13.707 -15.425
  666    HA   SER  90           HA       SER  90   5.951  16.219 -14.934
  667   1HB   SER  90          2HB       SER  90   4.580  15.675 -13.213
  668   2HB   SER  90          1HB       SER  90   4.743  14.014 -13.778
  669    HG   SER  90           HG       SER  90   6.849  14.304 -12.406
  670    H    ALA  91           H        ALA  91   6.892  17.236 -12.844
  671    HA   ALA  91           HA       ALA  91   9.778  16.506 -12.735
  672   1HB   ALA  91          1HB       ALA  91  10.231  18.743 -12.181
  673   2HB   ALA  91          2HB       ALA  91   8.601  19.020 -11.567
  674   3HB   ALA  91          3HB       ALA  91   8.880  18.893 -13.304
  675    H    LEU  92           H        LEU  92  10.464  15.424 -10.955
  676    HA   LEU  92           HA       LEU  92   9.033  14.468  -8.842
  677   1HB   LEU  92          2HB       LEU  92  11.583  14.288  -9.311
  678   2HB   LEU  92          1HB       LEU  92  11.723  15.708  -8.275
  679    HG   LEU  92           HG       LEU  92  10.174  14.268  -6.668
  680   1HD1  LEU  92          1HD1      LEU  92  11.780  12.030  -7.842
  681   2HD1  LEU  92          2HD1      LEU  92  10.263  12.470  -8.626
  682   3HD1  LEU  92          3HD1      LEU  92  10.269  11.967  -6.935
  683   1HD2  LEU  92          1HD2      LEU  92  12.513  13.121  -5.973
  684   2HD2  LEU  92          2HD2      LEU  92  12.180  14.829  -5.689
  685   3HD2  LEU  92          3HD2      LEU  92  13.121  14.336  -7.097
  686    H    ASP  93           H        ASP  93   7.431  15.698  -7.882
  687    HA   ASP  93           HA       ASP  93   8.292  17.802  -6.041
  688   1HB   ASP  93          2HB       ASP  93   6.827  18.410  -8.581
  689   2HB   ASP  93          1HB       ASP  93   6.401  19.318  -7.130
  690    H    ALA  94           H        ALA  94   7.332  16.605  -4.380
  691    HA   ALA  94           HA       ALA  94   5.041  15.125  -4.265
  692   1HB   ALA  94          1HB       ALA  94   4.681  16.510  -1.965
  693   2HB   ALA  94          2HB       ALA  94   6.342  16.972  -2.338
  694   3HB   ALA  94          3HB       ALA  94   5.920  15.270  -2.155
  695    H    LYS  95           H        LYS  95   5.112  18.694  -4.102
  696    HA   LYS  95           HA       LYS  95   2.356  19.169  -3.819
  697   1HB   LYS  95          2HB       LYS  95   4.484  20.692  -5.340
  698   2HB   LYS  95          1HB       LYS  95   2.834  21.292  -5.160
  699   1HG   LYS  95          2HG       LYS  95   3.308  20.722  -2.592
  700   2HG   LYS  95          1HG       LYS  95   4.976  20.985  -3.103
  701   1HD   LYS  95          2HD       LYS  95   4.395  23.156  -2.567
  702   2HD   LYS  95          1HD       LYS  95   3.909  23.132  -4.262
  703   1HE   LYS  95          2HE       LYS  95   2.134  22.750  -1.838
  704   2HE   LYS  95          1HE       LYS  95   2.068  24.058  -3.019
  705   1HZ   LYS  95          1HZ       LYS  95   0.397  22.211  -3.299
  706   2HZ   LYS  95          2HZ       LYS  95   1.693  21.220  -3.773
  707   3HZ   LYS  95          3HZ       LYS  95   1.305  22.606  -4.675
  708    H    LEU  96           H        LEU  96   4.177  18.948  -6.900
  709    HA   LEU  96           HA       LEU  96   1.835  19.001  -8.549
  710   1HB   LEU  96          2HB       LEU  96   4.540  19.082  -9.021
  711   2HB   LEU  96          1HB       LEU  96   4.140  17.457  -9.572
  712    HG   LEU  96           HG       LEU  96   2.090  18.899 -10.676
  713   1HD1  LEU  96          1HD1      LEU  96   4.573  20.624 -10.894
  714   2HD1  LEU  96          2HD1      LEU  96   3.201  21.007  -9.855
  715   3HD1  LEU  96          3HD1      LEU  96   2.992  20.946 -11.605
  716   1HD2  LEU  96          1HD2      LEU  96   3.412  17.266 -11.880
  717   2HD2  LEU  96          2HD2      LEU  96   4.843  18.293 -11.790
  718   3HD2  LEU  96          3HD2      LEU  96   3.469  18.782 -12.780
  719    H    ILE  97           H        ILE  97   3.974  16.222  -7.809
  720    HA   ILE  97           HA       ILE  97   2.534  14.128  -8.831
  721    HB   ILE  97           HB       ILE  97   3.749  14.226  -6.053
  722   1HG1  ILE  97          2HG1      ILE  97   5.030  13.008  -8.479
  723   2HG1  ILE  97          1HG1      ILE  97   5.106  14.757  -8.260
  724   1HG2  ILE  97          1HG2      ILE  97   2.858  11.947  -7.831
  725   2HG2  ILE  97          2HG2      ILE  97   2.372  12.277  -6.168
  726   3HG2  ILE  97          3HG2      ILE  97   4.011  11.723  -6.515
  727   1HD1  ILE  97          1HD1      ILE  97   6.525  14.603  -6.481
  728   2HD1  ILE  97          2HD1      ILE  97   6.903  13.025  -7.172
  729   3HD1  ILE  97          3HD1      ILE  97   5.740  13.155  -5.853
  730    H    ASP  98           H        ASP  98   1.723  15.942  -5.890
  731    HA   ASP  98           HA       ASP  98  -0.494  14.270  -5.123
  732   1HB   ASP  98          2HB       ASP  98   0.127  17.181  -4.540
  733   2HB   ASP  98          1HB       ASP  98  -1.208  16.297  -3.801
  734    H    GLU  99           H        GLU  99  -0.232  17.204  -7.122
  735    HA   GLU  99           HA       GLU  99  -3.025  17.574  -7.563
  736   1HB   GLU  99          2HB       GLU  99  -0.697  18.208  -9.406
  737   2HB   GLU  99          1HB       GLU  99  -2.330  18.856  -9.564
  738   1HG   GLU  99          2HG       GLU  99  -1.282  19.208  -6.865
  739   2HG   GLU  99          1HG       GLU  99  -0.258  19.982  -8.075
  740    H    GLN 100           H        GLN 100  -0.601  15.667  -9.348
  741    HA   GLN 100           HA       GLN 100  -2.359  14.796 -11.431
  742   1HB   GLN 100          2HB       GLN 100   0.270  13.936 -10.334
  743   2HB   GLN 100          1HB       GLN 100  -0.630  12.727 -11.251
  744   1HG   GLN 100          2HG       GLN 100  -0.869  14.356 -13.116
  745   2HG   GLN 100          1HG       GLN 100   0.115  15.506 -12.210
  746   1HE2  GLN 100          1HE2      GLN 100   0.949  12.141 -11.848
  747   2HE2  GLN 100          2HE2      GLN 100   2.330  12.167 -12.836
  748    H    VAL 101           H        VAL 101  -1.518  13.355  -8.281
  749    HA   VAL 101           HA       VAL 101  -3.122  11.001  -8.595
  750    HB   VAL 101           HB       VAL 101  -2.220  12.483  -6.109
  751   1HG1  VAL 101          1HG1      VAL 101  -2.668  10.212  -5.029
  752   2HG1  VAL 101          2HG1      VAL 101  -3.588   9.810  -6.478
  753   3HG1  VAL 101          3HG1      VAL 101  -4.098  11.153  -5.455
  754   1HG2  VAL 101          1HG2      VAL 101  -0.529  11.434  -7.753
  755   2HG2  VAL 101          2HG2      VAL 101  -1.180   9.879  -7.233
  756   3HG2  VAL 101          3HG2      VAL 101  -0.410  10.949  -6.063
  757    H    GLU 102           H        GLU 102  -3.810  13.867  -6.550
  758    HA   GLU 102           HA       GLU 102  -6.389  13.436  -5.797
  759   1HB   GLU 102          2HB       GLU 102  -5.067  15.582  -5.492
  760   2HB   GLU 102          1HB       GLU 102  -5.592  16.047  -7.111
  761   1HG   GLU 102          2HG       GLU 102  -7.714  16.499  -6.426
  762   2HG   GLU 102          1HG       GLU 102  -7.763  15.103  -5.348
  763    H    LYS 103           H        LYS 103  -5.473  14.607  -9.052
  764    HA   LYS 103           HA       LYS 103  -8.116  14.717 -10.105
  765   1HB   LYS 103          2HB       LYS 103  -5.413  14.286 -11.385
  766   2HB   LYS 103          1HB       LYS 103  -6.896  14.325 -12.342
  767   1HG   LYS 103          2HG       LYS 103  -7.421  16.562 -11.341
  768   2HG   LYS 103          1HG       LYS 103  -5.848  16.528 -10.541
  769   1HD   LYS 103          2HD       LYS 103  -4.695  16.452 -12.669
  770   2HD   LYS 103          1HD       LYS 103  -6.220  16.266 -13.537
  771   1HE   LYS 103          2HE       LYS 103  -5.207  18.628 -13.480
  772   2HE   LYS 103          1HE       LYS 103  -6.905  18.483 -13.026
  773   1HZ   LYS 103          1HZ       LYS 103  -4.909  19.604 -11.526
  774   2HZ   LYS 103          2HZ       LYS 103  -5.176  18.093 -10.796
  775   3HZ   LYS 103          3HZ       LYS 103  -6.461  19.186 -10.984
  776    H    LEU 104           H        LEU 104  -5.749  12.057 -10.023
  777    HA   LEU 104           HA       LEU 104  -7.444  10.205 -11.461
  778   1HB   LEU 104          2HB       LEU 104  -5.062   9.784  -9.634
  779   2HB   LEU 104          1HB       LEU 104  -5.854   8.481 -10.521
  780    HG   LEU 104           HG       LEU 104  -4.777  10.966 -11.871
  781   1HD1  LEU 104          1HD1      LEU 104  -3.005   9.599 -10.665
  782   2HD1  LEU 104          2HD1      LEU 104  -2.782   9.742 -12.409
  783   3HD1  LEU 104          3HD1      LEU 104  -3.437   8.255 -11.721
  784   1HD2  LEU 104          1HD2      LEU 104  -4.744   8.851 -13.641
  785   2HD2  LEU 104          2HD2      LEU 104  -6.027  10.056 -13.537
  786   3HD2  LEU 104          3HD2      LEU 104  -6.192   8.518 -12.690
  787    H    VAL 105           H        VAL 105  -7.395  11.353  -8.216
  788    HA   VAL 105           HA       VAL 105  -8.703   8.989  -7.079
  789    HB   VAL 105           HB       VAL 105  -7.979  11.727  -6.052
  790   1HG1  VAL 105          1HG1      VAL 105  -9.932   9.745  -4.913
  791   2HG1  VAL 105          2HG1      VAL 105 -10.038  11.504  -4.965
  792   3HG1  VAL 105          3HG1      VAL 105  -8.942  10.720  -3.828
  793   1HG2  VAL 105          1HG2      VAL 105  -7.343   9.318  -4.501
  794   2HG2  VAL 105          2HG2      VAL 105  -6.278  10.614  -5.046
  795   3HG2  VAL 105          3HG2      VAL 105  -6.673   9.282  -6.133
  796    H    ASN 106           H        ASN 106  -9.698  12.360  -7.771
  797    HA   ASN 106           HA       ASN 106 -12.456  11.931  -7.103
  798   1HB   ASN 106          2HB       ASN 106 -11.833  13.947  -9.185
  799   2HB   ASN 106          1HB       ASN 106 -12.730  14.127  -7.677
  800   1HD2  ASN 106          1HD2      ASN 106 -10.469  15.823  -8.739
  801   2HD2  ASN 106          2HD2      ASN 106  -9.280  15.788  -7.528
  802    H    LEU 107           H        LEU 107 -10.703  11.820 -10.206
  803    HA   LEU 107           HA       LEU 107 -13.033  11.286 -11.806
  804   1HB   LEU 107          2HB       LEU 107 -11.035  12.078 -12.893
  805   2HB   LEU 107          1HB       LEU 107 -10.089  10.733 -12.256
  806    HG   LEU 107           HG       LEU 107 -12.415   9.761 -13.694
  807   1HD1  LEU 107          1HD1      LEU 107 -10.453  11.468 -15.257
  808   2HD1  LEU 107          2HD1      LEU 107 -12.136  11.892 -14.942
  809   3HD1  LEU 107          3HD1      LEU 107 -11.752  10.489 -15.940
  810   1HD2  LEU 107          1HD2      LEU 107 -10.551   8.598 -14.978
  811   2HD2  LEU 107          2HD2      LEU 107 -10.529   8.340 -13.233
  812   3HD2  LEU 107          3HD2      LEU 107  -9.409   9.485 -13.969
  813    H    ALA 108           H        ALA 108 -10.511   9.105 -10.501
  814    HA   ALA 108           HA       ALA 108 -11.490   6.667 -11.452
  815   1HB   ALA 108          1HB       ALA 108 -10.604   5.757  -9.177
  816   2HB   ALA 108          2HB       ALA 108 -10.103   7.423  -8.889
  817   3HB   ALA 108          3HB       ALA 108  -9.461   6.537 -10.272
  818    H    GLU 109           H        GLU 109 -12.381   8.220  -8.347
  819    HA   GLU 109           HA       GLU 109 -14.445   6.293  -7.769
  820   1HB   GLU 109          2HB       GLU 109 -14.226   9.130  -6.727
  821   2HB   GLU 109          1HB       GLU 109 -15.078   7.783  -5.971
  822   1HG   GLU 109          2HG       GLU 109 -12.094   7.821  -6.504
  823   2HG   GLU 109          1HG       GLU 109 -12.829   8.229  -4.953
  824    H    LYS 110           H        LYS 110 -14.306   9.066  -9.822
  825    HA   LYS 110           HA       LYS 110 -17.105   9.741  -9.798
  826   1HB   LYS 110          2HB       LYS 110 -15.228  11.173 -10.729
  827   2HB   LYS 110          1HB       LYS 110 -15.190  10.085 -12.118
  828   1HG   LYS 110          2HG       LYS 110 -17.772  10.545 -12.208
  829   2HG   LYS 110          1HG       LYS 110 -17.362  11.974 -11.258
  830   1HD   LYS 110          2HD       LYS 110 -17.281  12.655 -13.554
  831   2HD   LYS 110          1HD       LYS 110 -15.605  12.497 -13.026
  832   1HE   LYS 110          2HE       LYS 110 -16.883  10.060 -14.162
  833   2HE   LYS 110          1HE       LYS 110 -16.514  11.362 -15.293
  834   1HZ   LYS 110          1HZ       LYS 110 -14.441  10.615 -15.282
  835   2HZ   LYS 110          2HZ       LYS 110 -14.747   9.547 -13.997
  836   3HZ   LYS 110          3HZ       LYS 110 -14.303  11.156 -13.680
  837    H    PHE 111           H        PHE 111 -15.191   7.357 -11.560
  838    HA   PHE 111           HA       PHE 111 -17.592   6.596 -13.140
  839   1HB   PHE 111          2HB       PHE 111 -14.652   6.059 -13.362
  840   2HB   PHE 111          1HB       PHE 111 -15.777   4.901 -14.072
  841    HD1  PHE 111           HD1      PHE 111 -13.868   7.677 -14.837
  842    HD2  PHE 111           HD2      PHE 111 -17.878   6.204 -15.289
  843    HE1  PHE 111           HE1      PHE 111 -14.205   9.188 -16.775
  844    HE2  PHE 111           HE2      PHE 111 -18.214   7.714 -17.228
  845    HZ   PHE 111           HZ       PHE 111 -16.377   9.206 -17.971
  846    H    ASP 112           H        ASP 112 -15.042   4.523 -11.748
  847    HA   ASP 112           HA       ASP 112 -16.483   3.332  -9.665
  848   1HB   ASP 112          2HB       ASP 112 -17.511   2.598 -12.280
  849   2HB   ASP 112          1HB       ASP 112 -16.924   1.180 -11.413
  850    H    ILE 113           H        ILE 113 -13.756   3.867 -10.704
  851    HA   ILE 113           HA       ILE 113 -12.644   1.093 -10.553
  852    HB   ILE 113           HB       ILE 113 -10.665   1.963 -11.707
  853   1HG1  ILE 113          2HG1      ILE 113 -12.178   4.594 -11.658
  854   2HG1  ILE 113          1HG1      ILE 113 -10.689   4.238 -10.785
  855   1HG2  ILE 113          1HG2      ILE 113 -12.752   3.140 -13.432
  856   2HG2  ILE 113          2HG2      ILE 113 -13.120   1.521 -12.840
  857   3HG2  ILE 113          3HG2      ILE 113 -11.642   1.809 -13.758
  858   1HD1  ILE 113          1HD1      ILE 113 -10.978   5.170 -13.474
  859   2HD1  ILE 113          2HD1      ILE 113 -10.268   3.557 -13.525
  860   3HD1  ILE 113          3HD1      ILE 113  -9.489   4.834 -12.590
  861    H    ILE 114           H        ILE 114 -10.307   1.192  -9.539
  862    HA   ILE 114           HA       ILE 114 -10.398   3.062  -7.203
  863    HB   ILE 114           HB       ILE 114 -10.875   0.960  -6.249
  864   1HG1  ILE 114          2HG1      ILE 114  -7.849   1.011  -6.185
  865   2HG1  ILE 114          1HG1      ILE 114  -8.830   2.188  -5.314
  866   1HG2  ILE 114          1HG2      ILE 114  -9.062  -0.034  -8.412
  867   2HG2  ILE 114          2HG2      ILE 114 -10.631  -0.652  -7.894
  868   3HG2  ILE 114          3HG2      ILE 114  -9.189  -0.989  -6.935
  869   1HD1  ILE 114          1HD1      ILE 114  -8.431  -0.710  -4.780
  870   2HD1  ILE 114          2HD1      ILE 114 -10.050  -0.073  -4.499
  871   3HD1  ILE 114          3HD1      ILE 114  -8.669   0.620  -3.648
  872    H    TYR 115           H        TYR 115  -8.568   4.244  -6.907
  873    HA   TYR 115           HA       TYR 115  -6.223   3.596  -8.630
  874   1HB   TYR 115          2HB       TYR 115  -6.671   5.820  -9.066
  875   2HB   TYR 115          1HB       TYR 115  -7.357   6.104  -7.467
  876    HD1  TYR 115           HD1      TYR 115  -6.008   6.875  -5.653
  877    HD2  TYR 115           HD2      TYR 115  -4.173   5.636  -9.334
  878    HE1  TYR 115           HE1      TYR 115  -3.841   7.804  -4.886
  879    HE2  TYR 115           HE2      TYR 115  -2.006   6.564  -8.565
  880    HH   TYR 115           HH       TYR 115  -1.148   8.176  -7.001
  881    H    ASP 116           H        ASP 116  -5.151   2.049  -7.357
  882    HA   ASP 116           HA       ASP 116  -3.956   3.118  -4.856
  883   1HB   ASP 116          2HB       ASP 116  -5.994   1.670  -4.345
  884   2HB   ASP 116          1HB       ASP 116  -5.080   0.314  -5.008
  885    H    GLY 117           H        GLY 117  -2.080   3.285  -6.343
  886   1HA   GLY 117          2HA       GLY 117  -0.102   1.416  -6.019
  887   2HA   GLY 117          1HA       GLY 117  -0.964   0.807  -7.431
  888    H    TRP 118           H        TRP 118   0.697   3.703  -6.183
  889    HA   TRP 118           HA       TRP 118   1.288   4.428  -9.026
  890   1HB   TRP 118          2HB       TRP 118   1.068   6.672  -8.520
  891   2HB   TRP 118          1HB       TRP 118  -0.076   6.009  -7.355
  892    HD1  TRP 118           HD1      TRP 118   0.795   5.735  -4.807
  893    HE1  TRP 118           HE1      TRP 118   2.575   7.064  -3.497
  894    HE3  TRP 118           HE3      TRP 118   3.282   7.943  -8.685
  895    HZ2  TRP 118           HZ2      TRP 118   4.764   8.829  -4.025
  896    HZ3  TRP 118           HZ3      TRP 118   5.208   9.440  -8.253
  897    HH2  TRP 118           HH2      TRP 118   5.952   9.886  -5.930
  898    H    GLY 119           H        GLY 119   3.470   5.104  -9.479
  899   1HA   GLY 119          2HA       GLY 119   5.473   5.062  -7.351
  900   2HA   GLY 119          1HA       GLY 119   5.557   3.661  -8.418
  901    H    THR 120           H        THR 120   7.715   5.366  -8.338
  902    HA   THR 120           HA       THR 120   7.521   6.730 -10.994
  903    HB   THR 120           HB       THR 120   7.651   8.447  -9.267
  904    HG1  THR 120           HG1      THR 120   9.572   7.987 -11.093
  905   1HG2  THR 120          1HG2      THR 120  10.256   7.251  -8.336
  906   2HG2  THR 120          2HG2      THR 120   8.721   6.771  -7.611
  907   3HG2  THR 120          3HG2      THR 120   9.247   8.453  -7.531
  908    H    TYR 121           H        TYR 121   9.774   6.962 -11.998
  909    HA   TYR 121           HA       TYR 121  11.142   4.365 -11.756
  910   1HB   TYR 121          2HB       TYR 121  10.684   6.190 -13.854
  911   2HB   TYR 121          1HB       TYR 121  12.423   6.232 -13.565
  912    HD1  TYR 121           HD1      TYR 121   9.684   4.356 -14.961
  913    HD2  TYR 121           HD2      TYR 121  13.691   4.011 -13.456
  914    HE1  TYR 121           HE1      TYR 121   9.928   2.173 -16.113
  915    HE2  TYR 121           HE2      TYR 121  13.937   1.828 -14.607
  916    HH   TYR 121           HH       TYR 121  12.922   0.259 -15.805
  917    H    TYR 122           H        TYR 122  12.488   4.311  -9.983
  918    HA   TYR 122           HA       TYR 122  13.897   6.567  -8.926
  919   1HB   TYR 122          2HB       TYR 122  13.419   4.207  -7.882
  920   2HB   TYR 122          1HB       TYR 122  14.940   3.760  -8.655
  921    HD1  TYR 122           HD1      TYR 122  13.436   5.291  -5.800
  922    HD2  TYR 122           HD2      TYR 122  16.979   5.322  -8.230
  923    HE1  TYR 122           HE1      TYR 122  14.693   6.369  -3.953
  924    HE2  TYR 122           HE2      TYR 122  18.236   6.398  -6.383
  925    HH   TYR 122           HH       TYR 122  18.057   6.558  -3.887
  926    H    GLU 123           H        GLU 123  16.091   7.194  -9.208
  927    HA   GLU 123           HA       GLU 123  17.250   6.310 -11.799
  928   1HB   GLU 123          2HB       GLU 123  16.858   8.799 -11.101
  929   2HB   GLU 123          1HB       GLU 123  18.310   8.580 -10.126
  930   1HG   GLU 123          2HG       GLU 123  18.850   7.477 -12.698
  931   2HG   GLU 123          1HG       GLU 123  18.119   9.062 -12.949
  932    H    GLY 124           H        GLY 124  18.046   4.272 -10.895
  933   1HA   GLY 124          2HA       GLY 124  20.765   4.469  -9.945
  934   2HA   GLY 124          1HA       GLY 124  19.687   3.942  -8.652
  935    H    LEU 125           H        LEU 125  19.705   1.760  -8.463
  936    HA   LEU 125           HA       LEU 125  19.800  -0.510  -9.059
  937   1HB   LEU 125          2HB       LEU 125  17.847   0.723 -10.635
  938   2HB   LEU 125          1HB       LEU 125  18.812  -0.201 -11.785
  939    HG   LEU 125           HG       LEU 125  18.616  -2.154 -10.118
  940   1HD1  LEU 125          1HD1      LEU 125  17.803  -1.221  -8.138
  941   2HD1  LEU 125          2HD1      LEU 125  16.326  -1.867  -8.854
  942   3HD1  LEU 125          3HD1      LEU 125  16.689  -0.147  -8.984
  943   1HD2  LEU 125          1HD2      LEU 125  16.386  -2.773 -11.005
  944   2HD2  LEU 125          2HD2      LEU 125  17.401  -2.068 -12.262
  945   3HD2  LEU 125          3HD2      LEU 125  16.130  -1.104 -11.510
  946    H    GLU 126           H        GLU 126  22.113  -0.598  -9.179
  947    HA   GLU 126           HA       GLU 126  23.291  -0.221 -11.891
  948   1HB   GLU 126          2HB       GLU 126  24.799  -0.765  -9.327
  949   2HB   GLU 126          1HB       GLU 126  25.416  -0.066 -10.824
  950   1HG   GLU 126          2HG       GLU 126  23.579   1.770 -10.374
  951   2HG   GLU 126          1HG       GLU 126  23.706   1.199  -8.710
  952    H    HIS 127           H        HIS 127  24.331  -1.942 -12.939
  953    HA   HIS 127           HA       HIS 127  24.723  -4.188 -13.495
  954   1HB   HIS 127          2HB       HIS 127  25.241  -4.003 -10.568
  955   2HB   HIS 127          1HB       HIS 127  25.046  -5.623 -11.237
  956    HD2  HIS 127           HD2      HIS 127  27.603  -6.512 -11.776
  957    HE1  HIS 127           HE1      HIS 127  29.148  -2.945 -13.427
  958    HE2  HIS 127           HE2      HIS 127  29.662  -5.372 -12.898
  959    H    HIS 128           H        HIS 128  22.548  -4.485 -14.301
  960    HA   HIS 128           HA       HIS 128  20.217  -5.014 -12.891
  961   1HB   HIS 128          2HB       HIS 128  21.290  -6.268 -15.424
  962   2HB   HIS 128          1HB       HIS 128  19.688  -6.660 -14.798
  963    HD2  HIS 128           HD2      HIS 128  18.007  -4.201 -14.479
  964    HE1  HIS 128           HE1      HIS 128  20.110  -2.167 -17.526
  965    HE2  HIS 128           HE2      HIS 128  18.014  -2.154 -16.095
  966    H    HIS 129           H        HIS 129  19.672  -6.533 -11.384
  967    HA   HIS 129           HA       HIS 129  20.427  -9.291 -11.557
  968   1HB   HIS 129          2HB       HIS 129  22.559  -7.814 -10.746
  969   2HB   HIS 129          1HB       HIS 129  21.801  -8.154  -9.190
  970    HD2  HIS 129           HD2      HIS 129  22.076 -10.796  -8.307
  971    HE1  HIS 129           HE1      HIS 129  23.942 -12.316 -11.777
  972    HE2  HIS 129           HE2      HIS 129  23.268 -12.849  -9.391
  973    H    HIS 130           H        HIS 130  19.825 -10.474  -9.497
  974    HA   HIS 130           HA       HIS 130  17.876  -8.921  -7.853
  975   1HB   HIS 130          2HB       HIS 130  17.248 -11.756  -8.572
  976   2HB   HIS 130          1HB       HIS 130  16.151 -10.419  -8.229
  977    HD2  HIS 130           HD2      HIS 130  14.864  -9.837 -10.600
  978    HE1  HIS 130           HE1      HIS 130  18.159 -10.281 -13.206
  979    HE2  HIS 130           HE2      HIS 130  15.702  -9.665 -13.065
  980    H    HIS 131           H        HIS 131  17.282 -11.838  -6.815
  981    HA   HIS 131           HA       HIS 131  19.778 -12.182  -5.224
  982   1HB   HIS 131          2HB       HIS 131  17.732 -10.854  -4.113
  983   2HB   HIS 131          1HB       HIS 131  17.175 -12.498  -3.800
  984    HD2  HIS 131           HD2      HIS 131  17.891 -12.560  -1.069
  985    HE1  HIS 131           HE1      HIS 131  22.011 -11.824  -1.630
  986    HE2  HIS 131           HE2      HIS 131  20.238 -12.467   0.066
  987    H    HIS 132           HN       HIS 132  18.593 -14.206  -3.533
  988    HA   HIS 132           HA       HIS 132  18.259 -16.529  -3.561
  989   1HB   HIS 132          2HB       HIS 132  16.062 -15.844  -4.488
  990   2HB   HIS 132          1HB       HIS 132  16.750 -15.880  -6.112
  991    HD2  HIS 132           HD2      HIS 132  17.884 -18.801  -3.815
  992    HE1  HIS 132           HE1      HIS 132  14.935 -20.337  -6.418
  993    HE2  HIS 132           HE2      HIS 132  16.689 -20.947  -4.691
  Start of MODEL    6
    1   1H    MET   1          1H        MET   1 -10.920  -8.767  -3.054
    2   2H    MET   1          2H        MET   1 -11.802  -7.561  -2.245
    3   3H    MET   1          3H        MET   1 -10.227  -7.950  -1.739
    4    HA   MET   1           HA       MET   1  -9.230  -6.927  -3.543
    5   1HB   MET   1          2HB       MET   1 -10.699  -6.152  -5.490
    6   2HB   MET   1          1HB       MET   1 -10.466  -7.894  -5.345
    7   1HG   MET   1          2HG       MET   1 -12.813  -6.525  -4.038
    8   2HG   MET   1          1HG       MET   1 -12.879  -7.036  -5.725
    9   1HE   MET   1          1HE       MET   1 -14.963  -8.678  -5.168
   10   2HE   MET   1          2HE       MET   1 -14.334 -10.306  -5.401
   11   3HE   MET   1          3HE       MET   1 -13.755  -8.992  -6.422
   12    H    SER   2           H        SER   2 -11.853  -5.079  -4.523
   13    HA   SER   2           HA       SER   2 -11.021  -2.692  -3.311
   14   1HB   SER   2          2HB       SER   2 -12.760  -2.974  -5.154
   15   2HB   SER   2          1HB       SER   2 -13.919  -3.362  -3.885
   16    HG   SER   2           HG       SER   2 -12.350  -1.080  -3.557
   17    H    HIS   3           H        HIS   3 -12.899  -5.313  -1.967
   18    HA   HIS   3           HA       HIS   3 -13.459  -5.713   0.289
   19   1HB   HIS   3          2HB       HIS   3 -11.290  -4.213   0.587
   20   2HB   HIS   3          1HB       HIS   3 -12.467  -3.004   1.100
   21    HD2  HIS   3           HD2      HIS   3 -10.412  -5.541   2.832
   22    HE1  HIS   3           HE1      HIS   3 -14.048  -5.603   4.979
   23    HE2  HIS   3           HE2      HIS   3 -11.615  -6.317   5.012
   24    H    GLN   4           H        GLN   4 -14.150  -2.610  -1.205
   25    HA   GLN   4           HA       GLN   4 -16.066  -1.256  -1.115
   26   1HB   GLN   4          2HB       GLN   4 -17.169  -3.987  -0.438
   27   2HB   GLN   4          1HB       GLN   4 -18.209  -2.569  -0.566
   28   1HG   GLN   4          2HG       GLN   4 -17.112  -2.190  -2.866
   29   2HG   GLN   4          1HG       GLN   4 -16.519  -3.844  -2.716
   30   1HE2  GLN   4          1HE2      GLN   4 -18.610  -5.246  -1.637
   31   2HE2  GLN   4          2HE2      GLN   4 -19.997  -5.124  -2.608
   32    H    ASP   5           H        ASP   5 -15.410   0.072   0.641
   33    HA   ASP   5           HA       ASP   5 -15.858  -0.786   3.398
   34   1HB   ASP   5          2HB       ASP   5 -14.955   1.758   2.067
   35   2HB   ASP   5          1HB       ASP   5 -15.416   1.771   3.770
   36    H    ASP   6           H        ASP   6 -16.855   2.410   3.050
   37    HA   ASP   6           HA       ASP   6 -19.684   1.882   2.548
   38   1HB   ASP   6          2HB       ASP   6 -18.608   1.901   5.278
   39   2HB   ASP   6          1HB       ASP   6 -19.906   3.071   5.041
   40    H    TYR   7           H        TYR   7 -17.077   4.033   3.465
   41    HA   TYR   7           HA       TYR   7 -18.500   6.244   2.092
   42   1HB   TYR   7          2HB       TYR   7 -17.567   6.255   4.956
   43   2HB   TYR   7          1HB       TYR   7 -17.606   7.754   4.027
   44    HD1  TYR   7           HD1      TYR   7 -19.582   5.213   5.726
   45    HD2  TYR   7           HD2      TYR   7 -19.763   8.553   3.030
   46    HE1  TYR   7           HE1      TYR   7 -22.026   5.390   6.109
   47    HE2  TYR   7           HE2      TYR   7 -22.206   8.729   3.413
   48    HH   TYR   7           HH       TYR   7 -23.860   6.610   5.744
   49    H    LEU   8           H        LEU   8 -16.570   5.070   0.770
   50    HA   LEU   8           HA       LEU   8 -13.877   5.455   1.247
   51   1HB   LEU   8          2HB       LEU   8 -14.682   6.335  -1.454
   52   2HB   LEU   8          1HB       LEU   8 -13.604   5.024  -0.972
   53    HG   LEU   8           HG       LEU   8 -15.813   3.870  -0.153
   54   1HD1  LEU   8          1HD1      LEU   8 -17.820   4.581  -1.118
   55   2HD1  LEU   8          2HD1      LEU   8 -17.001   5.479  -2.397
   56   3HD1  LEU   8          3HD1      LEU   8 -17.033   6.118  -0.753
   57   1HD2  LEU   8          1HD2      LEU   8 -14.289   3.234  -2.101
   58   2HD2  LEU   8          2HD2      LEU   8 -15.380   4.156  -3.137
   59   3HD2  LEU   8          3HD2      LEU   8 -15.975   2.743  -2.263
   60    H    SER   9           H        SER   9 -13.627   7.364   2.561
   61    HA   SER   9           HA       SER   9 -14.359   9.982   1.507
   62   1HB   SER   9          2HB       SER   9 -13.521   8.920   4.009
   63   2HB   SER   9          1HB       SER   9 -12.353  10.157   3.557
   64    HG   SER   9           HG       SER   9 -13.820  11.588   3.975
   65    H    VAL  10           H        VAL  10 -13.255  10.743  -0.244
   66    HA   VAL  10           HA       VAL  10 -10.657   9.907  -1.050
   67    HB   VAL  10           HB       VAL  10 -10.690  11.826  -2.558
   68   1HG1  VAL  10          1HG1      VAL  10 -13.453  10.641  -2.148
   69   2HG1  VAL  10          2HG1      VAL  10 -12.160   9.941  -3.121
   70   3HG1  VAL  10          3HG1      VAL  10 -12.908  11.461  -3.610
   71   1HG2  VAL  10          1HG2      VAL  10 -12.258  12.967  -0.409
   72   2HG2  VAL  10          2HG2      VAL  10 -13.142  13.093  -1.931
   73   3HG2  VAL  10          3HG2      VAL  10 -11.524  13.779  -1.792
   74    H    GLU  11           H        GLU  11 -11.659  12.018   1.458
   75    HA   GLU  11           HA       GLU  11  -9.318  13.705   1.568
   76   1HB   GLU  11          2HB       GLU  11 -11.417  12.951   3.614
   77   2HB   GLU  11          1HB       GLU  11 -10.103  14.074   3.967
   78   1HG   GLU  11          2HG       GLU  11 -11.089  15.747   2.810
   79   2HG   GLU  11          1HG       GLU  11 -11.454  14.691   1.446
   80    H    GLU  12           H        GLU  12 -10.300  10.947   3.647
   81    HA   GLU  12           HA       GLU  12  -7.838  10.707   5.022
   82   1HB   GLU  12          2HB       GLU  12  -8.652   8.683   5.837
   83   2HB   GLU  12          1HB       GLU  12 -10.150   9.467   5.337
   84   1HG   GLU  12          2HG       GLU  12  -9.819   8.318   3.071
   85   2HG   GLU  12          1HG       GLU  12  -8.583   7.341   3.867
   86    H    LEU  13           H        LEU  13  -8.833   9.462   1.865
   87    HA   LEU  13           HA       LEU  13  -6.522   7.768   1.492
   88   1HB   LEU  13          2HB       LEU  13  -8.425   9.048  -0.494
   89   2HB   LEU  13          1HB       LEU  13  -7.181   7.877  -0.933
   90    HG   LEU  13           HG       LEU  13  -9.303   7.323   1.153
   91   1HD1  LEU  13          1HD1      LEU  13 -10.393   7.698  -1.012
   92   2HD1  LEU  13          2HD1      LEU  13 -10.413   5.979  -0.620
   93   3HD1  LEU  13          3HD1      LEU  13  -9.253   6.603  -1.794
   94   1HD2  LEU  13          1HD2      LEU  13  -8.596   4.927   0.382
   95   2HD2  LEU  13          2HD2      LEU  13  -7.528   5.813   1.470
   96   3HD2  LEU  13          3HD2      LEU  13  -7.162   5.736  -0.252
   97    H    ILE  14           H        ILE  14  -7.305  11.107   0.536
   98    HA   ILE  14           HA       ILE  14  -4.912  11.614  -0.927
   99    HB   ILE  14           HB       ILE  14  -6.780  13.427   0.615
  100   1HG1  ILE  14          2HG1      ILE  14  -6.309  13.417  -2.353
  101   2HG1  ILE  14          1HG1      ILE  14  -7.321  12.162  -1.638
  102   1HG2  ILE  14          1HG2      ILE  14  -4.136  13.975  -0.581
  103   2HG2  ILE  14          2HG2      ILE  14  -5.045  14.900   0.614
  104   3HG2  ILE  14          3HG2      ILE  14  -5.418  15.068  -1.101
  105   1HD1  ILE  14          1HD1      ILE  14  -8.664  13.976  -0.524
  106   2HD1  ILE  14          2HD1      ILE  14  -8.761  13.999  -2.285
  107   3HD1  ILE  14          3HD1      ILE  14  -7.732  15.158  -1.444
  108    H    GLU  15           H        GLU  15  -5.661  11.867   2.530
  109    HA   GLU  15           HA       GLU  15  -3.231  13.146   3.321
  110   1HB   GLU  15          2HB       GLU  15  -5.456  11.759   4.628
  111   2HB   GLU  15          1HB       GLU  15  -3.915  11.501   5.450
  112   1HG   GLU  15          2HG       GLU  15  -4.828  14.252   4.594
  113   2HG   GLU  15          1HG       GLU  15  -5.260  13.569   6.162
  114    H    ILE  16           H        ILE  16  -4.103   9.671   3.476
  115    HA   ILE  16           HA       ILE  16  -1.650   8.633   4.289
  116    HB   ILE  16           HB       ILE  16  -3.703   7.556   2.351
  117   1HG1  ILE  16          2HG1      ILE  16  -2.977   6.374   5.007
  118   2HG1  ILE  16          1HG1      ILE  16  -3.928   7.860   4.982
  119   1HG2  ILE  16          1HG2      ILE  16  -2.439   5.331   2.882
  120   2HG2  ILE  16          2HG2      ILE  16  -1.071   6.388   3.229
  121   3HG2  ILE  16          3HG2      ILE  16  -1.801   6.389   1.624
  122   1HD1  ILE  16          1HD1      ILE  16  -5.544   6.746   3.433
  123   2HD1  ILE  16          2HD1      ILE  16  -5.444   5.954   5.006
  124   3HD1  ILE  16          3HD1      ILE  16  -4.629   5.248   3.610
  125    H    GLN  17           H        GLN  17  -2.608   8.706   0.837
  126    HA   GLN  17           HA       GLN  17  -0.134   8.175  -0.299
  127   1HB   GLN  17          2HB       GLN  17  -2.251  10.126  -1.246
  128   2HB   GLN  17          1HB       GLN  17  -0.891   9.594  -2.236
  129   1HG   GLN  17          2HG       GLN  17  -1.763   7.505  -2.552
  130   2HG   GLN  17          1HG       GLN  17  -2.451   7.436  -0.929
  131   1HE2  GLN  17          1HE2      GLN  17  -3.109  10.234  -2.962
  132   2HE2  GLN  17          2HE2      GLN  17  -4.734   9.856  -3.277
  133    H    LYS  18           H        LYS  18  -1.284  11.304   0.940
  134    HA   LYS  18           HA       LYS  18   0.877  12.905   0.038
  135   1HB   LYS  18          2HB       LYS  18  -1.371  13.301   1.621
  136   2HB   LYS  18          1HB       LYS  18  -0.033  13.593   2.733
  137   1HG   LYS  18          2HG       LYS  18   0.973  15.051   0.861
  138   2HG   LYS  18          1HG       LYS  18  -0.627  14.985   0.122
  139   1HD   LYS  18          2HD       LYS  18  -0.132  15.878   2.975
  140   2HD   LYS  18          1HD       LYS  18  -0.269  16.989   1.611
  141   1HE   LYS  18          2HE       LYS  18  -2.525  16.050   1.116
  142   2HE   LYS  18          1HE       LYS  18  -2.390  15.039   2.556
  143   1HZ   LYS  18          1HZ       LYS  18  -2.876  16.748   3.870
  144   2HZ   LYS  18          2HZ       LYS  18  -3.372  17.575   2.472
  145   3HZ   LYS  18          3HZ       LYS  18  -1.800  17.791   3.077
  146    H    GLU  19           H        GLU  19   0.566  10.868   2.931
  147    HA   GLU  19           HA       GLU  19   3.140  11.657   4.016
  148   1HB   GLU  19          2HB       GLU  19   1.169   9.456   4.603
  149   2HB   GLU  19          1HB       GLU  19   2.762   9.452   5.358
  150   1HG   GLU  19          2HG       GLU  19   2.369  11.489   6.480
  151   2HG   GLU  19          1HG       GLU  19   1.025  11.915   5.421
  152    H    GLU  20           H        GLU  20   2.011   8.599   2.519
  153    HA   GLU  20           HA       GLU  20   4.463   7.278   2.342
  154   1HB   GLU  20          2HB       GLU  20   2.383   7.310   0.137
  155   2HB   GLU  20          1HB       GLU  20   3.530   6.019   0.500
  156   1HG   GLU  20          2HG       GLU  20   1.109   6.881   2.073
  157   2HG   GLU  20          1HG       GLU  20   1.543   5.267   1.514
  158    H    THR  21           H        THR  21   3.067   9.248  -0.314
  159    HA   THR  21           HA       THR  21   5.284   9.307  -2.003
  160    HB   THR  21           HB       THR  21   3.401  11.606  -1.392
  161    HG1  THR  21           HG1      THR  21   2.686  10.577  -3.579
  162   1HG2  THR  21          1HG2      THR  21   3.995  12.332  -3.699
  163   2HG2  THR  21          2HG2      THR  21   5.207  11.052  -3.762
  164   3HG2  THR  21          3HG2      THR  21   5.377  12.371  -2.603
  165    H    ARG  22           H        ARG  22   4.557  11.914   0.349
  166    HA   ARG  22           HA       ARG  22   6.854  13.396   0.236
  167   1HB   ARG  22          2HB       ARG  22   4.818  13.390   1.958
  168   2HB   ARG  22          1HB       ARG  22   5.998  12.574   2.982
  169   1HG   ARG  22          2HG       ARG  22   7.459  14.417   2.985
  170   2HG   ARG  22          1HG       ARG  22   6.728  15.120   1.541
  171   1HD   ARG  22          2HD       ARG  22   6.168  15.966   4.062
  172   2HD   ARG  22          1HD       ARG  22   5.039  16.107   2.714
  173    HE   ARG  22           HE       ARG  22   4.540  13.579   3.740
  174   1HH1  ARG  22          1HH2      ARG  22   4.699  16.801   4.960
  175   2HH1  ARG  22          2HH2      ARG  22   3.530  16.527   6.209
  176   1HH2  ARG  22          2HH1      ARG  22   3.014  13.204   5.364
  177   2HH2  ARG  22          1HH1      ARG  22   2.576  14.490   6.437
  178    H    ASP  23           H        ASP  23   6.549  10.213   1.771
  179    HA   ASP  23           HA       ASP  23   9.192  10.174   2.904
  180   1HB   ASP  23          2HB       ASP  23   6.956   8.365   2.659
  181   2HB   ASP  23          1HB       ASP  23   8.448   7.520   2.250
  182    H    ILE  24           H        ILE  24   7.884   8.869  -0.156
  183    HA   ILE  24           HA       ILE  24  10.367   7.815  -1.107
  184    HB   ILE  24           HB       ILE  24   8.139   8.916  -2.837
  185   1HG1  ILE  24          2HG1      ILE  24   8.287   6.106  -1.732
  186   2HG1  ILE  24          1HG1      ILE  24   7.401   7.383  -0.898
  187   1HG2  ILE  24          1HG2      ILE  24  10.421   8.035  -3.744
  188   2HG2  ILE  24          2HG2      ILE  24   8.934   7.432  -4.478
  189   3HG2  ILE  24          3HG2      ILE  24   9.799   6.446  -3.300
  190   1HD1  ILE  24          1HD1      ILE  24   6.692   7.462  -3.673
  191   2HD1  ILE  24          2HD1      ILE  24   5.659   7.102  -2.289
  192   3HD1  ILE  24          3HD1      ILE  24   6.528   5.802  -3.102
  193    H    ILE  25           H        ILE  25   8.706  10.818  -2.156
  194    HA   ILE  25           HA       ILE  25  10.621  11.972  -3.740
  195    HB   ILE  25           HB       ILE  25   9.318  13.568  -1.527
  196   1HG1  ILE  25          2HG1      ILE  25   7.555  12.179  -2.380
  197   2HG1  ILE  25          1HG1      ILE  25   7.384  13.744  -3.179
  198   1HG2  ILE  25          1HG2      ILE  25   9.164  14.755  -4.112
  199   2HG2  ILE  25          2HG2      ILE  25  10.816  14.175  -3.900
  200   3HG2  ILE  25          3HG2      ILE  25  10.116  15.294  -2.730
  201   1HD1  ILE  25          1HD1      ILE  25   7.204  12.217  -4.961
  202   2HD1  ILE  25          2HD1      ILE  25   8.459  11.165  -4.306
  203   3HD1  ILE  25          3HD1      ILE  25   8.895  12.714  -5.028
  204    H    GLN  26           H        GLN  26  10.646  12.097  -0.161
  205    HA   GLN  26           HA       GLN  26  13.078  13.553   0.088
  206   1HB   GLN  26          2HB       GLN  26  11.928  11.441   1.938
  207   2HB   GLN  26          1HB       GLN  26  13.185  12.600   2.370
  208   1HG   GLN  26          2HG       GLN  26  10.642  13.665   1.214
  209   2HG   GLN  26          1HG       GLN  26  10.617  13.098   2.884
  210   1HE2  GLN  26          1HE2      GLN  26  10.921  14.854   4.258
  211   2HE2  GLN  26          2HE2      GLN  26  12.015  16.124   3.992
  212    H    ALA  27           H        ALA  27  12.477  10.045  -0.119
  213    HA   ALA  27           HA       ALA  27  15.182   9.217   0.236
  214   1HB   ALA  27          1HB       ALA  27  12.702   8.023  -0.876
  215   2HB   ALA  27          2HB       ALA  27  13.842   7.362   0.297
  216   3HB   ALA  27          3HB       ALA  27  14.216   7.303  -1.425
  217    H    LEU  28           H        LEU  28  13.396   9.336  -2.868
  218    HA   LEU  28           HA       LEU  28  15.508   9.041  -4.628
  219   1HB   LEU  28          2HB       LEU  28  13.421  11.175  -5.086
  220   2HB   LEU  28          1HB       LEU  28  14.186  10.120  -6.275
  221    HG   LEU  28           HG       LEU  28  12.238   9.279  -4.108
  222   1HD1  LEU  28          1HD1      LEU  28  10.773   9.905  -5.727
  223   2HD1  LEU  28          2HD1      LEU  28  11.280   8.422  -6.536
  224   3HD1  LEU  28          3HD1      LEU  28  12.026   9.960  -6.967
  225   1HD2  LEU  28          1HD2      LEU  28  13.865   7.522  -4.358
  226   2HD2  LEU  28          2HD2      LEU  28  13.852   7.681  -6.115
  227   3HD2  LEU  28          3HD2      LEU  28  12.441   7.034  -5.278
  228    H    LEU  29           H        LEU  29  14.407  12.170  -3.272
  229    HA   LEU  29           HA       LEU  29  16.345  13.837  -4.414
  230   1HB   LEU  29          2HB       LEU  29  14.936  13.893  -1.751
  231   2HB   LEU  29          1HB       LEU  29  16.135  15.121  -2.156
  232    HG   LEU  29           HG       LEU  29  13.845  14.449  -4.009
  233   1HD1  LEU  29          1HD1      LEU  29  12.638  16.355  -3.059
  234   2HD1  LEU  29          2HD1      LEU  29  13.936  16.626  -1.898
  235   3HD1  LEU  29          3HD1      LEU  29  12.955  15.164  -1.798
  236   1HD2  LEU  29          1HD2      LEU  29  14.968  15.892  -5.331
  237   2HD2  LEU  29          2HD2      LEU  29  16.137  16.218  -4.052
  238   3HD2  LEU  29          3HD2      LEU  29  14.647  17.156  -4.144
  239    H    GLU  30           H        GLU  30  16.665  11.611  -1.692
  240    HA   GLU  30           HA       GLU  30  19.301  12.556  -0.921
  241   1HB   GLU  30          2HB       GLU  30  17.560  11.155   0.453
  242   2HB   GLU  30          1HB       GLU  30  18.305   9.775  -0.352
  243   1HG   GLU  30          2HG       GLU  30  20.501  11.235   0.454
  244   2HG   GLU  30          1HG       GLU  30  19.369  11.491   1.784
  245    H    ASP  31           H        ASP  31  18.066   9.976  -3.021
  246    HA   ASP  31           HA       ASP  31  20.859   9.634  -4.031
  247   1HB   ASP  31          2HB       ASP  31  18.957   7.613  -3.003
  248   2HB   ASP  31          1HB       ASP  31  19.749   7.191  -4.521
  249    H    GLY  32           H        GLY  32  18.950  11.389  -5.152
  250   1HA   GLY  32          2HA       GLY  32  18.972  10.573  -7.885
  251   2HA   GLY  32          1HA       GLY  32  17.358  10.290  -7.229
  252    H    SER  33           H        SER  33  19.364  12.892  -6.029
  253    HA   SER  33           HA       SER  33  17.355  14.869  -6.417
  254   1HB   SER  33          2HB       SER  33  19.727  14.777  -5.065
  255   2HB   SER  33          1HB       SER  33  20.153  15.829  -6.412
  256    HG   SER  33           HG       SER  33  18.216  17.029  -5.871
  257    H    ASP  34           H        ASP  34  16.839  14.298  -8.735
  258    HA   ASP  34           HA       ASP  34  18.473  16.016 -10.540
  259   1HB   ASP  34          2HB       ASP  34  17.726  13.126 -10.945
  260   2HB   ASP  34          1HB       ASP  34  17.952  14.191 -12.333
  261    HA   PRO  35           HA       PRO  35  13.727  16.410 -10.699
  262   1HB   PRO  35          2HB       PRO  35  13.662  19.029  -9.823
  263   2HB   PRO  35          1HB       PRO  35  13.443  17.617  -8.772
  264   1HG   PRO  35          2HG       PRO  35  15.848  19.308  -9.196
  265   2HG   PRO  35          1HG       PRO  35  15.248  18.542  -7.715
  266   1HD   PRO  35          2HD       PRO  35  17.341  17.534  -9.150
  267   2HD   PRO  35          1HD       PRO  35  16.240  16.507  -8.205
  268    H    ASP  36           H        ASP  36  16.491  18.200 -11.814
  269    HA   ASP  36           HA       ASP  36  14.934  19.808 -13.724
  270   1HB   ASP  36          2HB       ASP  36  17.103  20.563 -12.594
  271   2HB   ASP  36          1HB       ASP  36  17.936  19.444 -13.673
  272    H    ALA  37           H        ALA  37  16.020  16.641 -13.595
  273    HA   ALA  37           HA       ALA  37  16.500  16.449 -16.518
  274   1HB   ALA  37          1HB       ALA  37  17.131  14.114 -16.033
  275   2HB   ALA  37          2HB       ALA  37  16.663  14.335 -14.347
  276   3HB   ALA  37          3HB       ALA  37  18.031  15.232 -15.008
  277    H    LEU  38           H        LEU  38  13.838  16.743 -14.790
  278    HA   LEU  38           HA       LEU  38  11.609  16.109 -15.149
  279   1HB   LEU  38          2HB       LEU  38  12.891  15.902 -17.657
  280   2HB   LEU  38          1HB       LEU  38  11.965  14.413 -17.473
  281    HG   LEU  38           HG       LEU  38  10.657  16.259 -18.541
  282   1HD1  LEU  38          1HD1      LEU  38   8.732  16.131 -16.803
  283   2HD1  LEU  38          2HD1      LEU  38   9.824  15.091 -15.889
  284   3HD1  LEU  38          3HD1      LEU  38   9.312  14.624 -17.511
  285   1HD2  LEU  38          1HD2      LEU  38  11.871  17.854 -16.655
  286   2HD2  LEU  38          2HD2      LEU  38  10.254  17.652 -15.977
  287   3HD2  LEU  38          3HD2      LEU  38  10.454  18.317 -17.599
  288    H    TYR  39           H        TYR  39  10.343  14.395 -14.433
  289    HA   TYR  39           HA       TYR  39  11.771  11.791 -14.053
  290   1HB   TYR  39          2HB       TYR  39  10.240  13.498 -12.199
  291   2HB   TYR  39          1HB       TYR  39   9.784  11.795 -12.156
  292    HD1  TYR  39           HD1      TYR  39  12.762  14.057 -12.069
  293    HD2  TYR  39           HD2      TYR  39  11.116  10.233 -11.010
  294    HE1  TYR  39           HE1      TYR  39  14.804  13.541 -10.760
  295    HE2  TYR  39           HE2      TYR  39  13.158   9.716  -9.702
  296    HH   TYR  39           HH       TYR  39  15.856  12.044  -9.510
  297    H    GLU  40           H        GLU  40  10.134   9.932 -13.790
  298    HA   GLU  40           HA       GLU  40   7.813  10.378 -15.627
  299   1HB   GLU  40          2HB       GLU  40   9.675   9.061 -16.671
  300   2HB   GLU  40          1HB       GLU  40   9.481   7.855 -15.398
  301   1HG   GLU  40          2HG       GLU  40   7.148   7.484 -16.083
  302   2HG   GLU  40          1HG       GLU  40   7.316   8.711 -17.341
  303    H    ILE  41           H        ILE  41   5.974  10.171 -14.441
  304    HA   ILE  41           HA       ILE  41   5.981   8.504 -12.002
  305    HB   ILE  41           HB       ILE  41   3.620  10.019 -13.118
  306   1HG1  ILE  41          2HG1      ILE  41   5.341  11.674 -13.099
  307   2HG1  ILE  41          1HG1      ILE  41   4.468  11.892 -11.583
  308   1HG2  ILE  41          1HG2      ILE  41   3.295  10.281 -10.561
  309   2HG2  ILE  41          2HG2      ILE  41   4.507   9.008 -10.417
  310   3HG2  ILE  41          3HG2      ILE  41   2.993   8.692 -11.264
  311   1HD1  ILE  41          1HD1      ILE  41   6.176  10.444 -10.454
  312   2HD1  ILE  41          2HD1      ILE  41   6.851  11.935 -11.110
  313   3HD1  ILE  41          3HD1      ILE  41   7.084  10.411 -11.965
  314    H    GLU  42           H        GLU  42   4.400   6.797 -11.691
  315    HA   GLU  42           HA       GLU  42   3.136   5.775 -14.190
  316   1HB   GLU  42          2HB       GLU  42   5.034   4.403 -14.168
  317   2HB   GLU  42          1HB       GLU  42   5.097   4.355 -12.406
  318   1HG   GLU  42          2HG       GLU  42   3.304   2.831 -12.259
  319   2HG   GLU  42          1HG       GLU  42   2.760   3.179 -13.900
  320    H    HIS  43           H        HIS  43   1.014   5.418 -13.774
  321    HA   HIS  43           HA       HIS  43   0.241   4.752 -10.963
  322   1HB   HIS  43          2HB       HIS  43  -1.527   6.047 -13.051
  323   2HB   HIS  43          1HB       HIS  43  -1.838   5.898 -11.321
  324    HD2  HIS  43           HD2      HIS  43   0.237   8.151 -13.765
  325    HE1  HIS  43           HE1      HIS  43   0.776   9.648  -9.852
  326    HE2  HIS  43           HE2      HIS  43   1.210  10.087 -12.313
  327    H    HIS  44           H        HIS  44  -1.025   2.936 -10.654
  328    HA   HIS  44           HA       HIS  44  -1.727   1.395 -13.120
  329   1HB   HIS  44          2HB       HIS  44  -0.471   0.630 -10.569
  330   2HB   HIS  44          1HB       HIS  44  -1.790  -0.433 -11.061
  331    HD2  HIS  44           HD2      HIS  44  -1.420  -1.401 -13.874
  332    HE1  HIS  44           HE1      HIS  44   2.779  -1.021 -13.625
  333    HE2  HIS  44           HE2      HIS  44   0.869  -2.018 -14.963
  334    H    LEU  45           H        LEU  45  -3.864   0.942 -13.417
  335    HA   LEU  45           HA       LEU  45  -5.693   1.169 -11.070
  336   1HB   LEU  45          2HB       LEU  45  -6.001   2.485 -13.781
  337   2HB   LEU  45          1HB       LEU  45  -7.336   2.301 -12.644
  338    HG   LEU  45           HG       LEU  45  -5.368   3.357 -11.040
  339   1HD1  LEU  45          1HD1      LEU  45  -5.228   4.836 -13.680
  340   2HD1  LEU  45          2HD1      LEU  45  -3.999   3.684 -13.155
  341   3HD1  LEU  45          3HD1      LEU  45  -4.289   5.152 -12.222
  342   1HD2  LEU  45          1HD2      LEU  45  -7.610   4.603 -12.636
  343   2HD2  LEU  45          2HD2      LEU  45  -6.647   5.560 -11.510
  344   3HD2  LEU  45          3HD2      LEU  45  -7.584   4.188 -10.923
  345    H    PHE  46           H        PHE  46  -7.529  -0.212 -11.200
  346    HA   PHE  46           HA       PHE  46  -7.648  -1.995 -13.586
  347   1HB   PHE  46          2HB       PHE  46  -8.151  -3.884 -11.915
  348   2HB   PHE  46          1HB       PHE  46  -6.473  -3.353 -12.029
  349    HD1  PHE  46           HD1      PHE  46  -5.785  -1.397 -10.398
  350    HD2  PHE  46           HD2      PHE  46  -9.176  -3.969  -9.819
  351    HE1  PHE  46           HE1      PHE  46  -5.797  -0.837  -7.982
  352    HE2  PHE  46           HE2      PHE  46  -9.189  -3.409  -7.404
  353    HZ   PHE  46           HZ       PHE  46  -7.500  -1.842  -6.485
  354    H    ALA  47           H        ALA  47  -9.740  -2.862 -14.003
  355    HA   ALA  47           HA       ALA  47 -11.949  -1.861 -12.277
  356   1HB   ALA  47          1HB       ALA  47 -12.340  -1.629 -15.221
  357   2HB   ALA  47          2HB       ALA  47 -11.303  -0.424 -14.457
  358   3HB   ALA  47          3HB       ALA  47 -12.972  -0.620 -13.921
  359    H    GLU  48           H        GLU  48 -14.115  -2.801 -13.281
  360    HA   GLU  48           HA       GLU  48 -13.557  -5.661 -13.949
  361   1HB   GLU  48          2HB       GLU  48 -16.104  -4.574 -12.731
  362   2HB   GLU  48          1HB       GLU  48 -15.564  -6.251 -12.794
  363   1HG   GLU  48          2HG       GLU  48 -13.917  -5.916 -11.151
  364   2HG   GLU  48          1HG       GLU  48 -13.909  -4.167 -11.381
  365    H    ASP  49           H        ASP  49 -15.998  -3.092 -14.464
  366    HA   ASP  49           HA       ASP  49 -17.062  -4.464 -16.816
  367   1HB   ASP  49          2HB       ASP  49 -18.192  -2.740 -15.104
  368   2HB   ASP  49          1HB       ASP  49 -17.643  -1.581 -16.316
  369    H    PHE  50           H        PHE  50 -15.516  -4.576 -18.439
  370    HA   PHE  50           HA       PHE  50 -13.501  -2.809 -19.120
  371   1HB   PHE  50          2HB       PHE  50 -14.619  -3.536 -21.600
  372   2HB   PHE  50          1HB       PHE  50 -13.338  -4.380 -20.729
  373    HD1  PHE  50           HD1      PHE  50 -17.077  -4.020 -20.685
  374    HD2  PHE  50           HD2      PHE  50 -13.691  -6.601 -20.126
  375    HE1  PHE  50           HE1      PHE  50 -18.603  -5.934 -20.287
  376    HE2  PHE  50           HE2      PHE  50 -15.216  -8.516 -19.727
  377    HZ   PHE  50           HZ       PHE  50 -17.672  -8.183 -19.807
  378    H    ASP  51           H        ASP  51 -16.829  -2.119 -19.091
  379    HA   ASP  51           HA       ASP  51 -16.859  -0.115 -21.190
  380   1HB   ASP  51          2HB       ASP  51 -18.747  -1.310 -19.403
  381   2HB   ASP  51          1HB       ASP  51 -18.848   0.441 -19.212
  382    H    LYS  52           H        LYS  52 -17.228   0.334 -17.652
  383    HA   LYS  52           HA       LYS  52 -16.593   3.105 -17.697
  384   1HB   LYS  52          2HB       LYS  52 -16.663   3.005 -15.376
  385   2HB   LYS  52          1HB       LYS  52 -17.575   1.553 -15.792
  386   1HG   LYS  52          2HG       LYS  52 -15.392   0.270 -15.663
  387   2HG   LYS  52          1HG       LYS  52 -14.662   1.725 -14.984
  388   1HD   LYS  52          2HD       LYS  52 -15.507   1.256 -12.953
  389   2HD   LYS  52          1HD       LYS  52 -17.138   1.161 -13.618
  390   1HE   LYS  52          2HE       LYS  52 -16.600  -1.180 -14.389
  391   2HE   LYS  52          1HE       LYS  52 -15.087  -1.064 -13.493
  392   1HZ   LYS  52          1HZ       LYS  52 -16.567  -2.058 -12.018
  393   2HZ   LYS  52          2HZ       LYS  52 -17.851  -1.031 -12.448
  394   3HZ   LYS  52          3HZ       LYS  52 -16.552  -0.433 -11.531
  395    H    LEU  53           H        LEU  53 -14.562   0.330 -17.974
  396    HA   LEU  53           HA       LEU  53 -12.130   1.538 -16.972
  397   1HB   LEU  53          2HB       LEU  53 -12.640  -0.970 -17.365
  398   2HB   LEU  53          1HB       LEU  53 -12.230  -0.648 -19.050
  399    HG   LEU  53           HG       LEU  53 -10.433  -0.062 -16.677
  400   1HD1  LEU  53          1HD1      LEU  53  -9.777  -2.061 -18.800
  401   2HD1  LEU  53          2HD1      LEU  53 -10.949  -2.529 -17.568
  402   3HD1  LEU  53          3HD1      LEU  53  -9.321  -2.043 -17.096
  403   1HD2  LEU  53          1HD2      LEU  53  -8.776   0.086 -18.720
  404   2HD2  LEU  53          2HD2      LEU  53  -9.788   1.473 -18.320
  405   3HD2  LEU  53          3HD2      LEU  53 -10.246   0.400 -19.642
  406    H    GLU  54           H        GLU  54 -13.046   0.718 -20.345
  407    HA   GLU  54           HA       GLU  54 -11.019   2.311 -21.547
  408   1HB   GLU  54          2HB       GLU  54 -12.508   0.535 -22.652
  409   2HB   GLU  54          1HB       GLU  54 -13.728   1.802 -22.789
  410   1HG   GLU  54          2HG       GLU  54 -12.296   3.157 -24.152
  411   2HG   GLU  54          1HG       GLU  54 -10.901   2.132 -23.816
  412    H    LYS  55           H        LYS  55 -14.008   3.201 -20.054
  413    HA   LYS  55           HA       LYS  55 -14.289   5.754 -21.432
  414   1HB   LYS  55          2HB       LYS  55 -15.528   4.574 -18.938
  415   2HB   LYS  55          1HB       LYS  55 -15.870   6.221 -19.468
  416   1HG   LYS  55          2HG       LYS  55 -16.075   4.238 -21.624
  417   2HG   LYS  55          1HG       LYS  55 -17.229   3.975 -20.316
  418   1HD   LYS  55          2HD       LYS  55 -18.275   6.028 -20.641
  419   2HD   LYS  55          1HD       LYS  55 -16.847   6.753 -21.383
  420   1HE   LYS  55          2HE       LYS  55 -18.406   6.396 -23.163
  421   2HE   LYS  55          1HE       LYS  55 -17.186   5.132 -23.321
  422   1HZ   LYS  55          1HZ       LYS  55 -18.720   3.584 -23.007
  423   2HZ   LYS  55          2HZ       LYS  55 -19.911   4.794 -23.069
  424   3HZ   LYS  55          3HZ       LYS  55 -19.262   4.310 -21.574
  425    H    ALA  56           H        ALA  56 -13.329   4.860 -18.095
  426    HA   ALA  56           HA       ALA  56 -12.464   7.487 -17.371
  427   1HB   ALA  56          1HB       ALA  56 -11.869   6.528 -15.378
  428   2HB   ALA  56          2HB       ALA  56 -11.033   5.186 -16.159
  429   3HB   ALA  56          3HB       ALA  56 -12.790   5.161 -16.006
  430    H    ALA  57           H        ALA  57 -10.871   4.837 -19.050
  431    HA   ALA  57           HA       ALA  57  -8.191   5.873 -18.862
  432   1HB   ALA  57          1HB       ALA  57  -8.197   4.464 -21.209
  433   2HB   ALA  57          2HB       ALA  57  -9.596   3.770 -20.387
  434   3HB   ALA  57          3HB       ALA  57  -8.010   3.731 -19.615
  435    H    VAL  58           H        VAL  58 -10.622   6.048 -21.492
  436    HA   VAL  58           HA       VAL  58  -9.181   7.624 -23.304
  437    HB   VAL  58           HB       VAL  58 -12.101   7.414 -22.635
  438   1HG1  VAL  58          1HG1      VAL  58 -10.817   9.409 -24.519
  439   2HG1  VAL  58          2HG1      VAL  58 -11.900   9.753 -23.170
  440   3HG1  VAL  58          3HG1      VAL  58 -12.515   8.943 -24.611
  441   1HG2  VAL  58          1HG2      VAL  58 -10.370   6.841 -25.058
  442   2HG2  VAL  58          2HG2      VAL  58 -12.125   6.669 -25.045
  443   3HG2  VAL  58          3HG2      VAL  58 -11.132   5.658 -23.995
  444    H    GLU  59           H        GLU  59 -11.396   8.857 -20.766
  445    HA   GLU  59           HA       GLU  59 -10.923  11.590 -21.070
  446   1HB   GLU  59          2HB       GLU  59 -12.309  10.120 -19.270
  447   2HB   GLU  59          1HB       GLU  59 -10.940  10.603 -18.266
  448   1HG   GLU  59          2HG       GLU  59 -12.551  12.335 -17.994
  449   2HG   GLU  59          1HG       GLU  59 -11.357  12.986 -19.118
  450    H    ALA  60           H        ALA  60  -9.063   9.357 -18.972
  451    HA   ALA  60           HA       ALA  60  -7.138  11.111 -17.996
  452   1HB   ALA  60          1HB       ALA  60  -5.721   8.778 -18.785
  453   2HB   ALA  60          2HB       ALA  60  -7.356   8.263 -18.372
  454   3HB   ALA  60          3HB       ALA  60  -6.384   9.145 -17.192
  455    H    PHE  61           H        PHE  61  -7.059   9.410 -21.138
  456    HA   PHE  61           HA       PHE  61  -4.603  10.378 -22.098
  457   1HB   PHE  61          2HB       PHE  61  -5.927   8.723 -23.328
  458   2HB   PHE  61          1HB       PHE  61  -7.178   9.928 -23.640
  459    HD1  PHE  61           HD1      PHE  61  -3.427   9.838 -23.882
  460    HD2  PHE  61           HD2      PHE  61  -7.155  10.731 -25.818
  461    HE1  PHE  61           HE1      PHE  61  -2.198  10.594 -25.898
  462    HE2  PHE  61           HE2      PHE  61  -5.927  11.488 -27.835
  463    HZ   PHE  61           HZ       PHE  61  -3.448  11.419 -27.876
  464    H    LYS  62           H        LYS  62  -7.827  11.871 -22.592
  465    HA   LYS  62           HA       LYS  62  -7.067  14.179 -23.946
  466   1HB   LYS  62          2HB       LYS  62  -9.418  13.467 -23.167
  467   2HB   LYS  62          1HB       LYS  62  -9.029  14.281 -21.650
  468   1HG   LYS  62          2HG       LYS  62  -9.926  16.085 -22.749
  469   2HG   LYS  62          1HG       LYS  62  -8.281  16.211 -23.375
  470   1HD   LYS  62          2HD       LYS  62  -9.301  14.440 -25.147
  471   2HD   LYS  62          1HD       LYS  62 -10.765  15.340 -24.749
  472   1HE   LYS  62          2HE       LYS  62  -9.632  16.394 -26.650
  473   2HE   LYS  62          1HE       LYS  62  -9.574  17.462 -25.248
  474   1HZ   LYS  62          1HZ       LYS  62  -7.400  15.630 -26.110
  475   2HZ   LYS  62          2HZ       LYS  62  -7.347  16.677 -24.773
  476   3HZ   LYS  62          3HZ       LYS  62  -7.423  17.309 -26.348
  477    H    MET  63           H        MET  63  -6.876  13.573 -20.443
  478    HA   MET  63           HA       MET  63  -5.971  16.190 -19.715
  479   1HB   MET  63          2HB       MET  63  -5.356  13.534 -18.380
  480   2HB   MET  63          1HB       MET  63  -5.190  15.126 -17.640
  481   1HG   MET  63          2HG       MET  63  -7.585  15.521 -17.841
  482   2HG   MET  63          1HG       MET  63  -7.792  14.004 -18.717
  483   1HE   MET  63          1HE       MET  63  -9.607  14.411 -16.888
  484   2HE   MET  63          2HE       MET  63  -9.565  13.538 -15.358
  485   3HE   MET  63          3HE       MET  63  -9.527  12.643 -16.876
  486    H    GLY  64           H        GLY  64  -4.063  13.181 -20.159
  487   1HA   GLY  64          2HA       GLY  64  -2.068  13.821 -21.801
  488   2HA   GLY  64          1HA       GLY  64  -1.627  14.850 -20.438
  489    H    PHE  65           H        PHE  65  -2.998  11.560 -20.403
  490    HA   PHE  65           HA       PHE  65  -0.573  10.712 -18.871
  491   1HB   PHE  65          2HB       PHE  65  -3.481  10.008 -18.650
  492   2HB   PHE  65          1HB       PHE  65  -2.278   8.808 -18.181
  493    HD1  PHE  65           HD1      PHE  65  -0.532   9.424 -16.449
  494    HD2  PHE  65           HD2      PHE  65  -3.964  11.875 -17.260
  495    HE1  PHE  65           HE1      PHE  65  -0.212  10.588 -14.283
  496    HE2  PHE  65           HE2      PHE  65  -3.644  13.041 -15.095
  497    HZ   PHE  65           HZ       PHE  65  -1.768  12.396 -13.606
  498    H    GLU  66           H        GLU  66   0.419   8.738 -19.467
  499    HA   GLU  66           HA       GLU  66  -0.186   7.864 -22.223
  500   1HB   GLU  66          2HB       GLU  66   2.078   7.411 -20.293
  501   2HB   GLU  66          1HB       GLU  66   1.886   6.355 -21.692
  502   1HG   GLU  66          2HG       GLU  66   3.365   8.168 -22.321
  503   2HG   GLU  66          1HG       GLU  66   1.824   8.408 -23.145
  504    H    VAL  67           H        VAL  67  -2.325   6.974 -21.313
  505    HA   VAL  67           HA       VAL  67  -2.587   4.857 -19.531
  506    HB   VAL  67           HB       VAL  67  -4.409   5.996 -20.936
  507   1HG1  VAL  67          1HG1      VAL  67  -3.073   5.172 -23.074
  508   2HG1  VAL  67          2HG1      VAL  67  -4.833   5.278 -23.099
  509   3HG1  VAL  67          3HG1      VAL  67  -4.047   3.719 -22.847
  510   1HG2  VAL  67          1HG2      VAL  67  -4.489   2.967 -20.750
  511   2HG2  VAL  67          2HG2      VAL  67  -5.874   4.059 -20.757
  512   3HG2  VAL  67          3HG2      VAL  67  -4.764   4.052 -19.388
  513    H    LEU  68           H        LEU  68  -2.407   2.566 -19.710
  514    HA   LEU  68           HA       LEU  68  -0.925   1.587 -22.110
  515   1HB   LEU  68          2HB       LEU  68   0.066   1.816 -19.425
  516   2HB   LEU  68          1HB       LEU  68  -0.060   0.105 -19.837
  517    HG   LEU  68           HG       LEU  68   1.218   2.124 -21.692
  518   1HD1  LEU  68          1HD1      LEU  68   3.188   2.018 -20.570
  519   2HD1  LEU  68          2HD1      LEU  68   2.999   0.299 -20.228
  520   3HD1  LEU  68          3HD1      LEU  68   2.216   1.494 -19.195
  521   1HD2  LEU  68          1HD2      LEU  68   2.350  -0.065 -22.441
  522   2HD2  LEU  68          2HD2      LEU  68   0.640   0.118 -22.837
  523   3HD2  LEU  68          3HD2      LEU  68   1.129  -0.891 -21.474
  524    H    GLU  69           H        GLU  69  -1.328  -0.626 -22.626
  525    HA   GLU  69           HA       GLU  69  -3.948  -1.578 -22.154
  526   1HB   GLU  69          2HB       GLU  69  -1.481  -3.195 -22.866
  527   2HB   GLU  69          1HB       GLU  69  -3.153  -3.715 -23.087
  528   1HG   GLU  69          2HG       GLU  69  -3.198  -1.297 -24.352
  529   2HG   GLU  69          1HG       GLU  69  -1.543  -1.815 -24.681
  530    H    ALA  70           H        ALA  70  -4.349  -3.835 -21.104
  531    HA   ALA  70           HA       ALA  70  -2.947  -3.905 -18.460
  532   1HB   ALA  70          1HB       ALA  70  -5.830  -4.625 -19.074
  533   2HB   ALA  70          2HB       ALA  70  -5.300  -3.141 -18.284
  534   3HB   ALA  70          3HB       ALA  70  -5.064  -4.697 -17.489
  535    H    GLU  71           H        GLU  71  -3.528  -6.235 -17.428
  536    HA   GLU  71           HA       GLU  71  -3.393  -8.348 -19.503
  537   1HB   GLU  71          2HB       GLU  71  -1.058  -7.906 -19.199
  538   2HB   GLU  71          1HB       GLU  71  -1.239  -7.805 -17.448
  539   1HG   GLU  71          2HG       GLU  71  -1.709 -10.160 -17.280
  540   2HG   GLU  71          1HG       GLU  71  -1.835 -10.316 -19.032
  541    H    GLU  72           H        GLU  72  -4.430 -10.194 -18.822
  542    HA   GLU  72           HA       GLU  72  -6.209 -10.313 -16.734
  543   1HB   GLU  72          2HB       GLU  72  -4.817 -12.869 -16.940
  544   2HB   GLU  72          1HB       GLU  72  -6.471 -12.458 -17.397
  545   1HG   GLU  72          2HG       GLU  72  -5.651 -11.475 -19.506
  546   2HG   GLU  72          1HG       GLU  72  -3.996 -11.884 -19.053
  547    H    THR  73           H        THR  73  -5.832  -9.772 -14.632
  548    HA   THR  73           HA       THR  73  -3.304 -10.764 -13.380
  549    HB   THR  73           HB       THR  73  -3.586  -8.279 -13.453
  550    HG1  THR  73           HG1      THR  73  -3.853  -9.260 -10.817
  551   1HG2  THR  73          1HG2      THR  73  -5.572  -7.350 -12.960
  552   2HG2  THR  73          2HG2      THR  73  -5.520  -8.053 -11.343
  553   3HG2  THR  73          3HG2      THR  73  -6.233  -8.961 -12.678
  554    H    GLU  74           H        GLU  74  -4.013 -10.441 -10.718
  555    HA   GLU  74           HA       GLU  74  -6.563 -11.774 -10.191
  556   1HB   GLU  74          2HB       GLU  74  -5.747 -13.860  -9.451
  557   2HB   GLU  74          1HB       GLU  74  -4.839 -13.573 -10.936
  558   1HG   GLU  74          2HG       GLU  74  -3.126 -12.400  -9.313
  559   2HG   GLU  74          1HG       GLU  74  -3.912 -13.396  -8.087
  560    H    ASP  75           H        ASP  75  -7.196 -11.365  -8.078
  561    HA   ASP  75           HA       ASP  75  -5.314  -9.746  -6.455
  562   1HB   ASP  75          2HB       ASP  75  -7.759  -9.080  -6.950
  563   2HB   ASP  75          1HB       ASP  75  -8.199 -10.326  -5.783
  564    H    GLU  76           H        GLU  76  -6.298 -10.265  -3.902
  565    HA   GLU  76           HA       GLU  76  -5.004 -12.833  -3.350
  566   1HB   GLU  76          2HB       GLU  76  -6.378 -10.886  -1.470
  567   2HB   GLU  76          1HB       GLU  76  -5.339 -12.230  -0.991
  568   1HG   GLU  76          2HG       GLU  76  -3.432 -11.109  -1.524
  569   2HG   GLU  76          1HG       GLU  76  -4.140 -10.409  -2.980
  570    H    ASP  77           H        ASP  77  -7.743 -12.576  -4.735
  571    HA   ASP  77           HA       ASP  77  -9.146 -14.500  -2.925
  572   1HB   ASP  77          2HB       ASP  77 -10.306 -12.247  -4.582
  573   2HB   ASP  77          1HB       ASP  77 -11.289 -13.566  -3.947
  574    H    GLY  78           H        GLY  78  -7.918 -13.774  -6.046
  575   1HA   GLY  78          2HA       GLY  78  -7.595 -15.394  -7.778
  576   2HA   GLY  78          1HA       GLY  78  -8.793 -16.430  -6.998
  577    H    ASN  79           H        ASN  79  -8.438 -13.477  -8.940
  578    HA   ASN  79           HA       ASN  79 -10.948 -14.136 -10.329
  579   1HB   ASN  79          2HB       ASN  79 -11.423 -12.670  -8.216
  580   2HB   ASN  79          1HB       ASN  79 -10.722 -11.365  -9.175
  581   1HD2  ASN  79          1HD2      ASN  79 -13.475 -11.286  -8.453
  582   2HD2  ASN  79          2HD2      ASN  79 -14.414 -11.497  -9.851
  583    H    LYS  80           H        LYS  80 -10.421 -13.873 -12.440
  584    HA   LYS  80           HA       LYS  80  -8.088 -12.469 -13.324
  585   1HB   LYS  80          2HB       LYS  80 -10.204 -12.720 -15.337
  586   2HB   LYS  80          1HB       LYS  80  -8.584 -13.419 -15.320
  587   1HG   LYS  80          2HG       LYS  80  -9.499 -15.047 -13.542
  588   2HG   LYS  80          1HG       LYS  80 -11.098 -14.504 -14.050
  589   1HD   LYS  80          2HD       LYS  80 -10.769 -16.336 -15.456
  590   2HD   LYS  80          1HD       LYS  80 -10.190 -15.011 -16.467
  591   1HE   LYS  80          2HE       LYS  80  -7.879 -15.462 -15.762
  592   2HE   LYS  80          1HE       LYS  80  -8.441 -16.763 -14.715
  593   1HZ   LYS  80          1HZ       LYS  80  -8.212 -18.086 -16.465
  594   2HZ   LYS  80          2HZ       LYS  80  -7.968 -16.781 -17.524
  595   3HZ   LYS  80          3HZ       LYS  80  -9.544 -17.302 -17.162
  596    H    LEU  81           H        LEU  81  -7.930 -10.286 -12.998
  597    HA   LEU  81           HA       LEU  81 -10.282  -8.614 -13.798
  598   1HB   LEU  81          2HB       LEU  81  -8.134  -7.651 -11.921
  599   2HB   LEU  81          1HB       LEU  81  -9.799  -7.091 -12.079
  600    HG   LEU  81           HG       LEU  81 -10.046  -9.799 -11.433
  601   1HD1  LEU  81          1HD1      LEU  81  -7.633  -9.802 -10.832
  602   2HD1  LEU  81          2HD1      LEU  81  -8.662 -10.069  -9.424
  603   3HD1  LEU  81          3HD1      LEU  81  -7.932  -8.487  -9.695
  604   1HD2  LEU  81          1HD2      LEU  81 -10.824  -8.881  -9.232
  605   2HD2  LEU  81          2HD2      LEU  81 -11.498  -8.019 -10.615
  606   3HD2  LEU  81          3HD2      LEU  81 -10.168  -7.311  -9.699
  607    H    LEU  82           H        LEU  82  -9.664  -6.467 -14.715
  608    HA   LEU  82           HA       LEU  82  -7.212  -6.745 -16.379
  609   1HB   LEU  82          2HB       LEU  82  -8.980  -4.465 -16.930
  610   2HB   LEU  82          1HB       LEU  82  -8.363  -5.699 -18.030
  611    HG   LEU  82           HG       LEU  82 -10.650  -6.083 -16.078
  612   1HD1  LEU  82          1HD1      LEU  82 -10.554  -5.634 -19.070
  613   2HD1  LEU  82          2HD1      LEU  82 -11.397  -4.663 -17.864
  614   3HD1  LEU  82          3HD1      LEU  82 -11.967  -6.287 -18.242
  615   1HD2  LEU  82          1HD2      LEU  82  -9.909  -8.242 -16.332
  616   2HD2  LEU  82          2HD2      LEU  82  -9.075  -7.885 -17.845
  617   3HD2  LEU  82          3HD2      LEU  82 -10.822  -8.127 -17.837
  618    H    CYS  83           H        CYS  83  -5.474  -5.462 -15.985
  619    HA   CYS  83           HA       CYS  83  -5.885  -3.067 -14.242
  620   1HB   CYS  83          2HB       CYS  83  -3.748  -3.503 -13.191
  621   2HB   CYS  83          1HB       CYS  83  -4.715  -4.975 -13.096
  622    HG   CYS  83           HG       CYS  83  -2.974  -4.969 -15.585
  623    H    PHE  84           H        PHE  84  -5.815  -1.467 -15.823
  624    HA   PHE  84           HA       PHE  84  -3.675  -1.567 -17.861
  625   1HB   PHE  84          2HB       PHE  84  -4.754   0.490 -18.745
  626   2HB   PHE  84          1HB       PHE  84  -5.902  -0.839 -18.591
  627    HD1  PHE  84           HD1      PHE  84  -7.308  -0.957 -16.427
  628    HD2  PHE  84           HD2      PHE  84  -5.156   2.546 -17.673
  629    HE1  PHE  84           HE1      PHE  84  -8.730   0.440 -14.954
  630    HE2  PHE  84           HE2      PHE  84  -6.579   3.944 -16.198
  631    HZ   PHE  84           HZ       PHE  84  -8.366   2.891 -14.841
  632    H    ASP  85           H        ASP  85  -2.176   0.286 -18.083
  633    HA   ASP  85           HA       ASP  85  -1.599   1.501 -15.414
  634   1HB   ASP  85          2HB       ASP  85   0.287   0.232 -15.900
  635   2HB   ASP  85          1HB       ASP  85   0.151   0.509 -17.637
  636    H    ALA  86           H        ALA  86  -0.324   3.633 -15.650
  637    HA   ALA  86           HA       ALA  86  -1.044   5.224 -18.028
  638   1HB   ALA  86          1HB       ALA  86  -1.807   6.385 -15.372
  639   2HB   ALA  86          2HB       ALA  86  -2.912   5.247 -16.143
  640   3HB   ALA  86          3HB       ALA  86  -2.459   6.737 -16.972
  641    H    THR  87           H        THR  87   0.951   6.035 -18.492
  642    HA   THR  87           HA       THR  87   2.699   6.871 -16.228
  643    HB   THR  87           HB       THR  87   4.231   7.109 -18.493
  644    HG1  THR  87           HG1      THR  87   3.153   6.114 -19.991
  645   1HG2  THR  87          1HG2      THR  87   5.155   4.902 -17.825
  646   2HG2  THR  87          2HG2      THR  87   3.747   4.647 -16.793
  647   3HG2  THR  87          3HG2      THR  87   4.877   5.954 -16.438
  648    H    MET  88           H        MET  88   3.872   8.929 -16.457
  649    HA   MET  88           HA       MET  88   2.954  10.868 -18.441
  650   1HB   MET  88          2HB       MET  88   1.079  10.884 -16.801
  651   2HB   MET  88          1HB       MET  88   2.226  11.295 -15.526
  652   1HG   MET  88          2HG       MET  88   2.872  13.218 -17.285
  653   2HG   MET  88          1HG       MET  88   1.188  12.978 -17.756
  654   1HE   MET  88          1HE       MET  88  -0.714  13.616 -16.689
  655   2HE   MET  88          2HE       MET  88   0.036  15.187 -16.962
  656   3HE   MET  88          3HE       MET  88  -0.786  14.864 -15.437
  657    H    GLN  89           H        GLN  89   4.837  11.891 -18.898
  658    HA   GLN  89           HA       GLN  89   7.044  11.934 -17.000
  659   1HB   GLN  89          2HB       GLN  89   6.903  13.610 -19.502
  660   2HB   GLN  89          1HB       GLN  89   8.316  12.875 -18.747
  661   1HG   GLN  89          2HG       GLN  89   6.673  10.699 -19.272
  662   2HG   GLN  89          1HG       GLN  89   6.444  11.733 -20.683
  663   1HE2  GLN  89          1HE2      GLN  89   7.982   9.145 -20.477
  664   2HE2  GLN  89          2HE2      GLN  89   9.556   9.521 -20.991
  665    H    SER  90           H        SER  90   7.318  13.445 -15.435
  666    HA   SER  90           HA       SER  90   6.589  16.244 -15.922
  667   1HB   SER  90          2HB       SER  90   4.465  15.816 -15.119
  668   2HB   SER  90          1HB       SER  90   4.993  14.438 -14.158
  669    HG   SER  90           HG       SER  90   4.731  15.934 -12.644
  670    H    ALA  91           H        ALA  91   7.558  17.655 -14.349
  671    HA   ALA  91           HA       ALA  91  10.067  16.906 -13.349
  672   1HB   ALA  91          1HB       ALA  91   8.358  18.955 -11.941
  673   2HB   ALA  91          2HB       ALA  91   9.009  19.262 -13.550
  674   3HB   ALA  91          3HB       ALA  91  10.102  18.969 -12.197
  675    H    LEU  92           H        LEU  92  10.737  16.700 -11.028
  676    HA   LEU  92           HA       LEU  92   8.904  14.836  -9.637
  677   1HB   LEU  92          2HB       LEU  92  11.280  14.201  -9.933
  678   2HB   LEU  92          1HB       LEU  92  11.768  15.626  -9.016
  679    HG   LEU  92           HG       LEU  92  10.068  14.595  -7.228
  680   1HD1  LEU  92          1HD1      LEU  92   9.915  12.649  -9.130
  681   2HD1  LEU  92          2HD1      LEU  92   9.640  12.363  -7.411
  682   3HD1  LEU  92          3HD1      LEU  92  11.217  12.019  -8.121
  683   1HD2  LEU  92          1HD2      LEU  92  12.327  15.027  -6.623
  684   2HD2  LEU  92          2HD2      LEU  92  12.945  13.847  -7.777
  685   3HD2  LEU  92          3HD2      LEU  92  12.107  13.303  -6.324
  686    H    ASP  93           H        ASP  93   7.408  15.932  -8.417
  687    HA   ASP  93           HA       ASP  93   8.423  17.667  -6.263
  688   1HB   ASP  93          2HB       ASP  93   7.116  18.708  -8.656
  689   2HB   ASP  93          1HB       ASP  93   6.237  19.133  -7.187
  690    H    ALA  94           H        ALA  94   7.385  16.969  -4.464
  691    HA   ALA  94           HA       ALA  94   5.332  15.088  -4.349
  692   1HB   ALA  94          1HB       ALA  94   4.965  15.778  -2.057
  693   2HB   ALA  94          2HB       ALA  94   5.661  17.366  -2.375
  694   3HB   ALA  94          3HB       ALA  94   6.688  15.932  -2.398
  695    H    LYS  95           H        LYS  95   4.773  18.574  -3.726
  696    HA   LYS  95           HA       LYS  95   2.029  18.666  -3.758
  697   1HB   LYS  95          2HB       LYS  95   3.440  20.671  -5.481
  698   2HB   LYS  95          1HB       LYS  95   2.194  20.927  -4.257
  699   1HG   LYS  95          2HG       LYS  95   4.035  20.028  -2.606
  700   2HG   LYS  95          1HG       LYS  95   5.144  20.505  -3.893
  701   1HD   LYS  95          2HD       LYS  95   4.185  22.783  -3.872
  702   2HD   LYS  95          1HD       LYS  95   3.093  22.307  -2.572
  703   1HE   LYS  95          2HE       LYS  95   5.576  21.510  -1.629
  704   2HE   LYS  95          1HE       LYS  95   5.926  23.034  -2.446
  705   1HZ   LYS  95          1HZ       LYS  95   4.052  22.527  -0.221
  706   2HZ   LYS  95          2HZ       LYS  95   3.901  23.906  -1.202
  707   3HZ   LYS  95          3HZ       LYS  95   5.319  23.650  -0.302
  708    H    LEU  96           H        LEU  96   3.886  19.201  -6.782
  709    HA   LEU  96           HA       LEU  96   1.846  19.046  -8.629
  710   1HB   LEU  96          2HB       LEU  96   4.543  19.042  -8.843
  711   2HB   LEU  96          1HB       LEU  96   4.213  17.368  -9.289
  712    HG   LEU  96           HG       LEU  96   2.292  18.650 -10.732
  713   1HD1  LEU  96          1HD1      LEU  96   4.724  20.458 -10.812
  714   2HD1  LEU  96          2HD1      LEU  96   3.236  20.856  -9.953
  715   3HD1  LEU  96          3HD1      LEU  96   3.217  20.662 -11.706
  716   1HD2  LEU  96          1HD2      LEU  96   4.065  18.541 -12.622
  717   2HD2  LEU  96          2HD2      LEU  96   3.674  17.042 -11.778
  718   3HD2  LEU  96          3HD2      LEU  96   5.149  17.921 -11.377
  719    H    ILE  97           H        ILE  97   3.650  16.188  -7.438
  720    HA   ILE  97           HA       ILE  97   2.067  14.209  -8.670
  721    HB   ILE  97           HB       ILE  97   3.524  14.195  -6.013
  722   1HG1  ILE  97          2HG1      ILE  97   4.309  12.686  -8.489
  723   2HG1  ILE  97          1HG1      ILE  97   4.653  14.414  -8.392
  724   1HG2  ILE  97          1HG2      ILE  97   1.956  12.445  -5.773
  725   2HG2  ILE  97          2HG2      ILE  97   3.388  11.639  -6.414
  726   3HG2  ILE  97          3HG2      ILE  97   2.038  12.020  -7.484
  727   1HD1  ILE  97          1HD1      ILE  97   6.257  14.137  -6.797
  728   2HD1  ILE  97          2HD1      ILE  97   6.310  12.483  -7.407
  729   3HD1  ILE  97          3HD1      ILE  97   5.356  12.865  -5.974
  730    H    ASP  98           H        ASP  98   1.411  16.199  -5.867
  731    HA   ASP  98           HA       ASP  98  -0.762  14.610  -4.823
  732   1HB   ASP  98          2HB       ASP  98   0.624  16.770  -3.900
  733   2HB   ASP  98          1HB       ASP  98  -0.872  17.543  -4.428
  734    H    GLU  99           H        GLU  99  -0.778  17.661  -6.712
  735    HA   GLU  99           HA       GLU  99  -3.567  17.740  -7.172
  736   1HB   GLU  99          2HB       GLU  99  -1.394  18.649  -9.085
  737   2HB   GLU  99          1HB       GLU  99  -3.060  19.226  -9.037
  738   1HG   GLU  99          2HG       GLU  99  -2.288  19.630  -6.444
  739   2HG   GLU  99          1HG       GLU  99  -0.776  19.928  -7.302
  740    H    GLN 100           H        GLN 100  -1.024  15.936  -8.830
  741    HA   GLN 100           HA       GLN 100  -2.665  15.089 -11.048
  742   1HB   GLN 100          2HB       GLN 100  -0.185  13.838  -9.827
  743   2HB   GLN 100          1HB       GLN 100  -0.904  13.352 -11.364
  744   1HG   GLN 100          2HG       GLN 100  -0.712  15.947 -11.889
  745   2HG   GLN 100          1HG       GLN 100   0.555  15.871 -10.665
  746   1HE2  GLN 100          1HE2      GLN 100   1.495  16.470 -13.148
  747   2HE2  GLN 100          2HE2      GLN 100   2.236  15.128 -13.878
  748    H    VAL 101           H        VAL 101  -1.495  13.189  -8.236
  749    HA   VAL 101           HA       VAL 101  -3.172  10.962  -8.597
  750    HB   VAL 101           HB       VAL 101  -2.086  12.247  -6.083
  751   1HG1  VAL 101          1HG1      VAL 101  -3.788   9.778  -6.435
  752   2HG1  VAL 101          2HG1      VAL 101  -3.998  11.097  -5.284
  753   3HG1  VAL 101          3HG1      VAL 101  -2.678   9.945  -5.074
  754   1HG2  VAL 101          1HG2      VAL 101  -1.391   9.692  -7.569
  755   2HG2  VAL 101          2HG2      VAL 101  -0.564  10.318  -6.142
  756   3HG2  VAL 101          3HG2      VAL 101  -0.482  11.201  -7.666
  757    H    GLU 102           H        GLU 102  -3.831  13.979  -6.826
  758    HA   GLU 102           HA       GLU 102  -6.390  13.323  -5.829
  759   1HB   GLU 102          2HB       GLU 102  -4.977  15.426  -5.387
  760   2HB   GLU 102          1HB       GLU 102  -5.668  16.063  -6.880
  761   1HG   GLU 102          2HG       GLU 102  -7.864  15.043  -5.486
  762   2HG   GLU 102          1HG       GLU 102  -6.885  15.825  -4.245
  763    H    LYS 103           H        LYS 103  -5.423  14.528  -9.028
  764    HA   LYS 103           HA       LYS 103  -8.097  14.923 -10.011
  765   1HB   LYS 103          2HB       LYS 103  -5.374  14.696 -11.213
  766   2HB   LYS 103          1HB       LYS 103  -6.754  14.439 -12.282
  767   1HG   LYS 103          2HG       LYS 103  -7.655  16.603 -11.787
  768   2HG   LYS 103          1HG       LYS 103  -6.530  16.836 -10.449
  769   1HD   LYS 103          2HD       LYS 103  -4.674  16.568 -12.245
  770   2HD   LYS 103          1HD       LYS 103  -5.963  16.878 -13.409
  771   1HE   LYS 103          2HE       LYS 103  -4.778  18.706 -11.358
  772   2HE   LYS 103          1HE       LYS 103  -5.254  19.048 -13.022
  773   1HZ   LYS 103          1HZ       LYS 103  -6.884  18.980 -10.595
  774   2HZ   LYS 103          2HZ       LYS 103  -7.611  18.475 -12.047
  775   3HZ   LYS 103          3HZ       LYS 103  -6.956  20.038 -11.919
  776    H    LEU 104           H        LEU 104  -5.851  12.158 -10.152
  777    HA   LEU 104           HA       LEU 104  -7.609  10.485 -11.712
  778   1HB   LEU 104          2HB       LEU 104  -5.486   9.574  -9.749
  779   2HB   LEU 104          1HB       LEU 104  -6.111   8.680 -11.135
  780    HG   LEU 104           HG       LEU 104  -4.361  11.142 -11.133
  781   1HD1  LEU 104          1HD1      LEU 104  -4.157   8.480 -12.577
  782   2HD1  LEU 104          2HD1      LEU 104  -3.331   8.860 -11.065
  783   3HD1  LEU 104          3HD1      LEU 104  -2.932   9.750 -12.536
  784   1HD2  LEU 104          1HD2      LEU 104  -6.010  11.701 -12.754
  785   2HD2  LEU 104          2HD2      LEU 104  -6.137  10.033 -13.316
  786   3HD2  LEU 104          3HD2      LEU 104  -4.696  10.983 -13.685
  787    H    VAL 105           H        VAL 105  -7.250  11.130  -8.273
  788    HA   VAL 105           HA       VAL 105  -8.855   8.927  -7.343
  789    HB   VAL 105           HB       VAL 105  -8.197  11.613  -6.102
  790   1HG1  VAL 105          1HG1      VAL 105 -10.044  11.032  -4.837
  791   2HG1  VAL 105          2HG1      VAL 105  -8.811  10.100  -3.988
  792   3HG1  VAL 105          3HG1      VAL 105  -9.858   9.309  -5.166
  793   1HG2  VAL 105          1HG2      VAL 105  -6.441   9.710  -6.626
  794   2HG2  VAL 105          2HG2      VAL 105  -7.160   8.940  -5.211
  795   3HG2  VAL 105          3HG2      VAL 105  -6.413  10.531  -5.065
  796    H    ASN 106           H        ASN 106  -9.613  12.281  -8.248
  797    HA   ASN 106           HA       ASN 106 -12.371  12.160  -7.426
  798   1HB   ASN 106          2HB       ASN 106 -11.448  13.895  -9.697
  799   2HB   ASN 106          1HB       ASN 106 -12.592  14.267  -8.406
  800   1HD2  ASN 106          1HD2      ASN 106 -10.518  12.949  -6.470
  801   2HD2  ASN 106          2HD2      ASN 106  -9.391  14.191  -6.212
  802    H    LEU 107           H        LEU 107 -10.862  11.882 -10.668
  803    HA   LEU 107           HA       LEU 107 -13.252  11.260 -12.071
  804   1HB   LEU 107          2HB       LEU 107 -11.124  11.832 -13.193
  805   2HB   LEU 107          1HB       LEU 107 -10.429  10.306 -12.646
  806    HG   LEU 107           HG       LEU 107 -12.785   9.497 -13.841
  807   1HD1  LEU 107          1HD1      LEU 107 -13.074  11.831 -14.702
  808   2HD1  LEU 107          2HD1      LEU 107 -12.908  10.638 -15.989
  809   3HD1  LEU 107          3HD1      LEU 107 -11.541  11.665 -15.558
  810   1HD2  LEU 107          1HD2      LEU 107 -10.022   9.785 -15.067
  811   2HD2  LEU 107          2HD2      LEU 107 -11.290   8.716 -15.666
  812   3HD2  LEU 107          3HD2      LEU 107 -10.577   8.435 -14.077
  813    H    ALA 108           H        ALA 108 -10.802   9.042 -10.695
  814    HA   ALA 108           HA       ALA 108 -11.922   6.590 -11.360
  815   1HB   ALA 108          1HB       ALA 108 -11.151   6.031  -8.837
  816   2HB   ALA 108          2HB       ALA 108 -10.349   7.589  -9.039
  817   3HB   ALA 108          3HB       ALA 108  -9.998   6.265 -10.151
  818    H    GLU 109           H        GLU 109 -12.696   8.402  -8.360
  819    HA   GLU 109           HA       GLU 109 -14.889   6.680  -7.660
  820   1HB   GLU 109          2HB       GLU 109 -14.427   9.566  -6.843
  821   2HB   GLU 109          1HB       GLU 109 -15.461   8.399  -6.019
  822   1HG   GLU 109          2HG       GLU 109 -12.448   8.324  -6.288
  823   2HG   GLU 109          1HG       GLU 109 -13.397   8.432  -4.804
  824    H    LYS 110           H        LYS 110 -14.581   9.192  -9.983
  825    HA   LYS 110           HA       LYS 110 -17.382   9.986 -10.000
  826   1HB   LYS 110          2HB       LYS 110 -15.294  11.268 -10.921
  827   2HB   LYS 110          1HB       LYS 110 -15.545  10.286 -12.365
  828   1HG   LYS 110          2HG       LYS 110 -17.979  11.058 -12.304
  829   2HG   LYS 110          1HG       LYS 110 -17.473  12.243 -11.100
  830   1HD   LYS 110          2HD       LYS 110 -15.625  12.864 -12.834
  831   2HD   LYS 110          1HD       LYS 110 -16.668  12.038 -13.992
  832   1HE   LYS 110          2HE       LYS 110 -17.250  14.504 -12.363
  833   2HE   LYS 110          1HE       LYS 110 -17.409  14.269 -14.103
  834   1HZ   LYS 110          1HZ       LYS 110 -19.450  13.456 -13.865
  835   2HZ   LYS 110          2HZ       LYS 110 -19.410  14.053 -12.274
  836   3HZ   LYS 110          3HZ       LYS 110 -19.000  12.433 -12.590
  837    H    PHE 111           H        PHE 111 -15.527   7.393 -11.400
  838    HA   PHE 111           HA       PHE 111 -17.843   6.703 -13.155
  839   1HB   PHE 111          2HB       PHE 111 -14.903   6.125 -13.287
  840   2HB   PHE 111          1HB       PHE 111 -16.030   4.995 -14.038
  841    HD1  PHE 111           HD1      PHE 111 -14.769   8.471 -14.057
  842    HD2  PHE 111           HD2      PHE 111 -17.332   5.614 -15.984
  843    HE1  PHE 111           HE1      PHE 111 -15.011   9.997 -15.998
  844    HE2  PHE 111           HE2      PHE 111 -17.575   7.138 -17.925
  845    HZ   PHE 111           HZ       PHE 111 -16.415   9.330 -17.931
  846    H    ASP 112           H        ASP 112 -15.345   4.626 -11.671
  847    HA   ASP 112           HA       ASP 112 -16.822   3.464  -9.610
  848   1HB   ASP 112          2HB       ASP 112 -17.857   2.750 -12.237
  849   2HB   ASP 112          1HB       ASP 112 -17.343   1.323 -11.337
  850    H    ILE 113           H        ILE 113 -14.076   3.914 -10.510
  851    HA   ILE 113           HA       ILE 113 -13.076   1.094 -10.399
  852    HB   ILE 113           HB       ILE 113 -11.007   1.979 -11.509
  853   1HG1  ILE 113          2HG1      ILE 113 -12.729   4.466 -11.772
  854   2HG1  ILE 113          1HG1      ILE 113 -11.221   4.331 -10.867
  855   1HG2  ILE 113          1HG2      ILE 113 -13.223   2.751 -13.338
  856   2HG2  ILE 113          2HG2      ILE 113 -13.309   1.135 -12.638
  857   3HG2  ILE 113          3HG2      ILE 113 -11.901   1.610 -13.589
  858   1HD1  ILE 113          1HD1      ILE 113 -10.405   3.430 -13.295
  859   2HD1  ILE 113          2HD1      ILE 113 -10.300   5.120 -12.803
  860   3HD1  ILE 113          3HD1      ILE 113 -11.657   4.571 -13.788
  861    H    ILE 114           H        ILE 114 -11.098   0.792  -9.127
  862    HA   ILE 114           HA       ILE 114 -10.945   2.755  -6.884
  863    HB   ILE 114           HB       ILE 114 -11.430   0.611  -6.007
  864   1HG1  ILE 114          2HG1      ILE 114  -9.413  -0.035  -4.790
  865   2HG1  ILE 114          1HG1      ILE 114  -8.398   0.801  -5.963
  866   1HG2  ILE 114          1HG2      ILE 114  -9.691  -1.285  -6.794
  867   2HG2  ILE 114          2HG2      ILE 114  -9.686  -0.286  -8.248
  868   3HG2  ILE 114          3HG2      ILE 114 -11.199  -0.973  -7.655
  869   1HD1  ILE 114          1HD1      ILE 114 -10.502   2.142  -4.238
  870   2HD1  ILE 114          2HD1      ILE 114  -9.389   2.948  -5.342
  871   3HD1  ILE 114          3HD1      ILE 114  -8.771   2.147  -3.898
  872    H    TYR 115           H        TYR 115  -9.210   4.091  -6.906
  873    HA   TYR 115           HA       TYR 115  -6.853   3.336  -8.551
  874   1HB   TYR 115          2HB       TYR 115  -7.439   5.518  -9.120
  875   2HB   TYR 115          1HB       TYR 115  -7.954   5.916  -7.482
  876    HD1  TYR 115           HD1      TYR 115  -6.325   6.511  -5.751
  877    HD2  TYR 115           HD2      TYR 115  -5.085   5.576  -9.755
  878    HE1  TYR 115           HE1      TYR 115  -4.084   7.464  -5.279
  879    HE2  TYR 115           HE2      TYR 115  -2.843   6.528  -9.284
  880    HH   TYR 115           HH       TYR 115  -1.720   7.939  -7.809
  881    H    ASP 116           H        ASP 116  -5.330   2.219  -7.421
  882    HA   ASP 116           HA       ASP 116  -4.218   3.384  -4.980
  883   1HB   ASP 116          2HB       ASP 116  -4.524   1.091  -3.780
  884   2HB   ASP 116          1HB       ASP 116  -5.884   2.212  -3.805
  885    H    GLY 117           H        GLY 117  -2.438   3.392  -6.595
  886   1HA   GLY 117          2HA       GLY 117  -0.514   1.395  -6.162
  887   2HA   GLY 117          1HA       GLY 117  -1.360   0.931  -7.639
  888    H    TRP 118           H        TRP 118   0.172   3.817  -6.170
  889    HA   TRP 118           HA       TRP 118   1.013   4.601  -8.926
  890   1HB   TRP 118          2HB       TRP 118   0.665   6.794  -8.386
  891   2HB   TRP 118          1HB       TRP 118  -0.413   6.105  -7.174
  892    HD1  TRP 118           HD1      TRP 118   0.359   6.149  -4.657
  893    HE1  TRP 118           HE1      TRP 118   2.240   7.413  -3.428
  894    HE3  TRP 118           HE3      TRP 118   3.126   7.710  -8.653
  895    HZ2  TRP 118           HZ2      TRP 118   4.608   8.893  -4.059
  896    HZ3  TRP 118           HZ3      TRP 118   5.187   9.043  -8.312
  897    HH2  TRP 118           HH2      TRP 118   5.931   9.637  -6.022
  898    H    GLY 119           H        GLY 119   3.204   5.130  -9.282
  899   1HA   GLY 119          2HA       GLY 119   5.129   5.182  -7.101
  900   2HA   GLY 119          1HA       GLY 119   5.203   3.683  -8.029
  901    H    THR 120           H        THR 120   7.452   5.130  -8.146
  902    HA   THR 120           HA       THR 120   7.404   6.175 -10.925
  903    HB   THR 120           HB       THR 120   7.322   8.246  -9.827
  904    HG1  THR 120           HG1      THR 120   9.311   9.070 -10.177
  905   1HG2  THR 120          1HG2      THR 120   9.261   7.192  -7.754
  906   2HG2  THR 120          2HG2      THR 120   7.511   7.216  -7.542
  907   3HG2  THR 120          3HG2      THR 120   8.399   8.730  -7.716
  908    H    TYR 121           H        TYR 121   9.754   6.473 -11.704
  909    HA   TYR 121           HA       TYR 121  11.524   4.444 -10.397
  910   1HB   TYR 121          2HB       TYR 121  10.520   4.601 -13.168
  911   2HB   TYR 121          1HB       TYR 121  12.260   4.349 -13.037
  912    HD1  TYR 121           HD1      TYR 121  13.016   2.157 -12.870
  913    HD2  TYR 121           HD2      TYR 121   9.095   3.136 -11.414
  914    HE1  TYR 121           HE1      TYR 121  12.631  -0.226 -12.304
  915    HE2  TYR 121           HE2      TYR 121   8.710   0.751 -10.849
  916    HH   TYR 121           HH       TYR 121  10.565  -1.323 -10.282
  917    H    TYR 122           H        TYR 122  13.603   5.148 -10.060
  918    HA   TYR 122           HA       TYR 122  14.238   7.930 -10.668
  919   1HB   TYR 122          2HB       TYR 122  15.123   7.183  -8.611
  920   2HB   TYR 122          1HB       TYR 122  15.706   5.671  -9.311
  921    HD1  TYR 122           HD1      TYR 122  16.054   9.266 -10.335
  922    HD2  TYR 122           HD2      TYR 122  18.038   5.612  -9.254
  923    HE1  TYR 122           HE1      TYR 122  18.250  10.322 -10.795
  924    HE2  TYR 122           HE2      TYR 122  20.234   6.669  -9.713
  925    HH   TYR 122           HH       TYR 122  20.446  10.017 -10.921
  926    H    GLU 123           H        GLU 123  15.585   8.683 -12.287
  927    HA   GLU 123           HA       GLU 123  16.095   6.951 -14.547
  928   1HB   GLU 123          2HB       GLU 123  16.258   9.781 -13.941
  929   2HB   GLU 123          1HB       GLU 123  17.699   9.255 -14.811
  930   1HG   GLU 123          2HG       GLU 123  15.940   9.936 -16.393
  931   2HG   GLU 123          1HG       GLU 123  16.267   8.209 -16.538
  932    H    GLY 124           H        GLY 124  17.555   5.310 -14.142
  933   1HA   GLY 124          2HA       GLY 124  20.211   5.387 -14.401
  934   2HA   GLY 124          1HA       GLY 124  20.082   5.951 -12.734
  935    H    LEU 125           H        LEU 125  20.994   4.131 -11.739
  936    HA   LEU 125           HA       LEU 125  21.071   1.942 -10.898
  937   1HB   LEU 125          2HB       LEU 125  18.332   2.814 -10.916
  938   2HB   LEU 125          1HB       LEU 125  18.379   1.094 -11.292
  939    HG   LEU 125           HG       LEU 125  19.960   2.257  -9.000
  940   1HD1  LEU 125          1HD1      LEU 125  17.906   1.114  -7.724
  941   2HD1  LEU 125          2HD1      LEU 125  17.053   1.593  -9.190
  942   3HD1  LEU 125          3HD1      LEU 125  17.864   2.810  -8.205
  943   1HD2  LEU 125          1HD2      LEU 125  18.807  -0.516  -9.318
  944   2HD2  LEU 125          2HD2      LEU 125  20.140   0.003  -8.287
  945   3HD2  LEU 125          3HD2      LEU 125  20.358  -0.083 -10.035
  946    H    GLU 126           H        GLU 126  22.102   1.890 -13.327
  947    HA   GLU 126           HA       GLU 126  20.663  -0.276 -14.804
  948   1HB   GLU 126          2HB       GLU 126  22.222   2.082 -15.668
  949   2HB   GLU 126          1HB       GLU 126  22.579   0.593 -16.546
  950   1HG   GLU 126          2HG       GLU 126  20.411   0.399 -17.372
  951   2HG   GLU 126          1HG       GLU 126  19.717   1.350 -16.058
  952    H    HIS 127           H        HIS 127  22.536  -0.485 -12.445
  953    HA   HIS 127           HA       HIS 127  24.823  -1.910 -13.706
  954   1HB   HIS 127          2HB       HIS 127  24.527  -0.340 -11.341
  955   2HB   HIS 127          1HB       HIS 127  24.914  -1.985 -10.837
  956    HD2  HIS 127           HD2      HIS 127  26.420  -0.197 -14.054
  957    HE1  HIS 127           HE1      HIS 127  29.580  -1.232 -11.450
  958    HE2  HIS 127           HE2      HIS 127  29.005  -0.264 -13.723
  959    H    HIS 128           H        HIS 128  23.362  -3.663 -14.422
  960    HA   HIS 128           HA       HIS 128  22.148  -5.320 -12.305
  961   1HB   HIS 128          2HB       HIS 128  21.726  -6.798 -14.469
  962   2HB   HIS 128          1HB       HIS 128  20.761  -5.352 -14.167
  963    HD2  HIS 128           HD2      HIS 128  23.196  -6.704 -16.830
  964    HE1  HIS 128           HE1      HIS 128  22.671  -2.596 -17.659
  965    HE2  HIS 128           HE2      HIS 128  23.605  -4.782 -18.544
  966    H    HIS 129           H        HIS 129  24.694  -5.382 -11.642
  967    HA   HIS 129           HA       HIS 129  25.486  -8.124 -12.036
  968   1HB   HIS 129          2HB       HIS 129  26.716  -6.020 -13.751
  969   2HB   HIS 129          1HB       HIS 129  27.800  -7.226 -13.058
  970    HD2  HIS 129           HD2      HIS 129  26.517 -10.011 -13.509
  971    HE1  HIS 129           HE1      HIS 129  25.189  -8.762 -17.319
  972    HE2  HIS 129           HE2      HIS 129  25.604 -10.773 -15.831
  973    H    HIS 130           H        HIS 130  25.784  -8.234  -9.821
  974    HA   HIS 130           HA       HIS 130  28.079  -6.664  -8.746
  975   1HB   HIS 130          2HB       HIS 130  26.857  -6.344  -6.623
  976   2HB   HIS 130          1HB       HIS 130  25.992  -5.590  -7.964
  977    HD2  HIS 130           HD2      HIS 130  24.417  -6.882  -5.218
  978    HE1  HIS 130           HE1      HIS 130  22.911  -9.627  -8.053
  979    HE2  HIS 130           HE2      HIS 130  22.589  -8.673  -5.725
  980    H    HIS 131           H        HIS 131  26.819  -9.617  -9.424
  981    HA   HIS 131           HA       HIS 131  27.644 -11.024  -6.984
  982   1HB   HIS 131          2HB       HIS 131  25.781 -11.945  -8.222
  983   2HB   HIS 131          1HB       HIS 131  26.727 -11.984  -9.710
  984    HD2  HIS 131           HD2      HIS 131  27.585 -14.563 -10.136
  985    HE1  HIS 131           HE1      HIS 131  28.152 -15.705  -6.110
  986    HE2  HIS 131           HE2      HIS 131  28.323 -16.474  -8.521
  987    H    HIS 132           HN       HIS 132  29.814  -9.604  -7.774
  988    HA   HIS 132           HA       HIS 132  32.026  -9.751  -8.587
  989   1HB   HIS 132          2HB       HIS 132  31.466 -12.521  -7.500
  990   2HB   HIS 132          1HB       HIS 132  33.070 -11.997  -8.010
  991    HD2  HIS 132           HD2      HIS 132  31.454  -8.992  -6.415
  992    HE1  HIS 132           HE1      HIS 132  33.415 -10.971  -3.242
  993    HE2  HIS 132           HE2      HIS 132  32.271  -8.819  -3.945
  Start of MODEL    7
    1   1H    MET   1          1H        MET   1 -31.394  -2.118  -1.114
    2   2H    MET   1          2H        MET   1 -30.154  -3.258  -0.892
    3   3H    MET   1          3H        MET   1 -31.019  -3.213  -2.353
    4    HA   MET   1           HA       MET   1 -28.984  -2.182  -2.830
    5   1HB   MET   1          2HB       MET   1 -31.297  -0.933  -3.283
    6   2HB   MET   1          1HB       MET   1 -30.600   0.247  -2.172
    7   1HG   MET   1          2HG       MET   1 -29.575   1.073  -4.025
    8   2HG   MET   1          1HG       MET   1 -28.468  -0.284  -3.812
    9   1HE   MET   1          1HE       MET   1 -28.506  -1.659  -7.142
   10   2HE   MET   1          2HE       MET   1 -28.056  -2.037  -5.480
   11   3HE   MET   1          3HE       MET   1 -27.726  -0.434  -6.133
   12    H    SER   2           H        SER   2 -28.618  -2.846  -0.114
   13    HA   SER   2           HA       SER   2 -27.015  -0.515   0.745
   14   1HB   SER   2          2HB       SER   2 -29.351  -1.641   2.256
   15   2HB   SER   2          1HB       SER   2 -27.967  -1.022   3.152
   16    HG   SER   2           HG       SER   2 -29.870   0.300   1.651
   17    H    HIS   3           H        HIS   3 -25.903  -2.741  -0.278
   18    HA   HIS   3           HA       HIS   3 -25.390  -4.779   1.738
   19   1HB   HIS   3          2HB       HIS   3 -23.764  -4.227  -0.756
   20   2HB   HIS   3          1HB       HIS   3 -23.901  -5.749   0.124
   21    HD2  HIS   3           HD2      HIS   3 -26.976  -6.410   0.217
   22    HE1  HIS   3           HE1      HIS   3 -27.243  -5.231  -3.830
   23    HE2  HIS   3           HE2      HIS   3 -28.404  -6.497  -1.963
   24    H    GLN   4           H        GLN   4 -22.741  -5.209   1.843
   25    HA   GLN   4           HA       GLN   4 -21.555  -2.630   2.789
   26   1HB   GLN   4          2HB       GLN   4 -20.433  -4.027   4.587
   27   2HB   GLN   4          1HB       GLN   4 -22.179  -3.853   4.770
   28   1HG   GLN   4          2HG       GLN   4 -22.573  -6.058   4.361
   29   2HG   GLN   4          1HG       GLN   4 -21.325  -6.151   3.117
   30   1HE2  GLN   4          1HE2      GLN   4 -19.079  -5.256   4.652
   31   2HE2  GLN   4          2HE2      GLN   4 -18.758  -6.410   5.856
   32    H    ASP   5           H        ASP   5 -19.256  -2.473   2.512
   33    HA   ASP   5           HA       ASP   5 -17.726  -4.681   1.404
   34   1HB   ASP   5          2HB       ASP   5 -17.300  -3.070  -0.722
   35   2HB   ASP   5          1HB       ASP   5 -18.521  -4.343  -0.721
   36    H    ASP   6           H        ASP   6 -16.788  -3.623   3.493
   37    HA   ASP   6           HA       ASP   6 -15.320  -2.050   4.520
   38   1HB   ASP   6          2HB       ASP   6 -13.984  -3.151   2.052
   39   2HB   ASP   6          1HB       ASP   6 -13.128  -2.040   3.121
   40    H    TYR   7           H        TYR   7 -17.142  -0.407   3.566
   41    HA   TYR   7           HA       TYR   7 -16.844   1.293   1.453
   42   1HB   TYR   7          2HB       TYR   7 -17.975   1.508   4.067
   43   2HB   TYR   7          1HB       TYR   7 -17.099   3.003   3.741
   44    HD1  TYR   7           HD1      TYR   7 -17.777   4.503   1.962
   45    HD2  TYR   7           HD2      TYR   7 -19.823   0.781   2.604
   46    HE1  TYR   7           HE1      TYR   7 -19.605   5.249   0.462
   47    HE2  TYR   7           HE2      TYR   7 -21.652   1.527   1.104
   48    HH   TYR   7           HH       TYR   7 -21.376   4.096  -0.992
   49    H    LEU   8           H        LEU   8 -15.148   2.398   0.610
   50    HA   LEU   8           HA       LEU   8 -12.871   3.056   2.427
   51   1HB   LEU   8          2HB       LEU   8 -11.508   3.161   0.366
   52   2HB   LEU   8          1HB       LEU   8 -12.300   1.594   0.526
   53    HG   LEU   8           HG       LEU   8 -14.205   2.962  -0.850
   54   1HD1  LEU   8          1HD1      LEU   8 -12.453   4.884  -0.927
   55   2HD1  LEU   8          2HD1      LEU   8 -13.270   4.444  -2.427
   56   3HD1  LEU   8          3HD1      LEU   8 -11.629   3.880  -2.120
   57   1HD2  LEU   8          1HD2      LEU   8 -11.918   1.198  -1.619
   58   2HD2  LEU   8          2HD2      LEU   8 -12.845   1.946  -2.920
   59   3HD2  LEU   8          3HD2      LEU   8 -13.651   0.904  -1.747
   60    H    SER   9           H        SER   9 -12.192   5.186   2.604
   61    HA   SER   9           HA       SER   9 -13.878   7.201   1.181
   62   1HB   SER   9          2HB       SER   9 -13.185   6.908   3.920
   63   2HB   SER   9          1HB       SER   9 -12.343   8.339   3.333
   64    HG   SER   9           HG       SER   9 -15.024   7.877   3.708
   65    H    VAL  10           H        VAL  10 -12.824   8.136  -0.496
   66    HA   VAL  10           HA       VAL  10 -10.114   7.882  -1.143
   67    HB   VAL  10           HB       VAL  10 -10.422   9.919  -2.541
   68   1HG1  VAL  10          1HG1      VAL  10 -12.478   7.733  -2.447
   69   2HG1  VAL  10          2HG1      VAL  10 -11.220   8.028  -3.646
   70   3HG1  VAL  10          3HG1      VAL  10 -12.664   9.040  -3.616
   71   1HG2  VAL  10          1HG2      VAL  10 -12.631  11.056  -2.460
   72   2HG2  VAL  10          2HG2      VAL  10 -11.751  11.231  -0.941
   73   3HG2  VAL  10          3HG2      VAL  10 -13.073  10.069  -1.067
   74    H    GLU  11           H        GLU  11 -11.627  10.042   1.158
   75    HA   GLU  11           HA       GLU  11  -9.627  12.014   1.435
   76   1HB   GLU  11          2HB       GLU  11 -11.647  12.333   2.649
   77   2HB   GLU  11          1HB       GLU  11 -11.514  10.759   3.433
   78   1HG   GLU  11          2HG       GLU  11  -9.675  11.479   4.781
   79   2HG   GLU  11          1HG       GLU  11  -9.468  12.949   3.830
   80    H    GLU  12           H        GLU  12  -9.972   9.110   3.512
   81    HA   GLU  12           HA       GLU  12  -7.472   9.326   4.795
   82   1HB   GLU  12          2HB       GLU  12  -8.393   6.585   4.100
   83   2HB   GLU  12          1HB       GLU  12  -7.933   7.255   5.666
   84   1HG   GLU  12          2HG       GLU  12 -10.122   8.696   5.349
   85   2HG   GLU  12          1HG       GLU  12 -10.572   7.394   4.248
   86    H    LEU  13           H        LEU  13  -8.226   7.233   1.979
   87    HA   LEU  13           HA       LEU  13  -5.700   6.274   1.399
   88   1HB   LEU  13          2HB       LEU  13  -7.440   7.386  -0.802
   89   2HB   LEU  13          1HB       LEU  13  -6.417   5.948  -0.832
   90    HG   LEU  13           HG       LEU  13  -9.031   6.335   0.638
   91   1HD1  LEU  13          1HD1      LEU  13  -9.890   4.828  -0.857
   92   2HD1  LEU  13          2HD1      LEU  13  -8.380   3.923  -0.970
   93   3HD1  LEU  13          3HD1      LEU  13  -8.577   5.427  -1.870
   94   1HD2  LEU  13          1HD2      LEU  13  -8.590   4.030   1.551
   95   2HD2  LEU  13          2HD2      LEU  13  -7.514   5.264   2.203
   96   3HD2  LEU  13          3HD2      LEU  13  -6.936   4.163   0.954
   97    H    ILE  14           H        ILE  14  -6.978   9.477   0.466
   98    HA   ILE  14           HA       ILE  14  -4.661  10.347  -0.948
   99    HB   ILE  14           HB       ILE  14  -6.878  11.789   0.496
  100   1HG1  ILE  14          2HG1      ILE  14  -6.100  12.123  -2.380
  101   2HG1  ILE  14          1HG1      ILE  14  -6.907  10.632  -1.893
  102   1HG2  ILE  14          1HG2      ILE  14  -5.266  13.412   0.843
  103   2HG2  ILE  14          2HG2      ILE  14  -5.740  13.818  -0.806
  104   3HG2  ILE  14          3HG2      ILE  14  -4.280  12.872  -0.516
  105   1HD1  ILE  14          1HD1      ILE  14  -8.661  12.106  -0.766
  106   2HD1  ILE  14          2HD1      ILE  14  -8.650  12.141  -2.530
  107   3HD1  ILE  14          3HD1      ILE  14  -7.929  13.467  -1.617
  108    H    GLU  15           H        GLU  15  -5.502  10.498   2.501
  109    HA   GLU  15           HA       GLU  15  -3.275  12.094   3.319
  110   1HB   GLU  15          2HB       GLU  15  -5.310  10.417   4.607
  111   2HB   GLU  15          1HB       GLU  15  -3.764  10.401   5.456
  112   1HG   GLU  15          2HG       GLU  15  -4.988  12.244   6.361
  113   2HG   GLU  15          1HG       GLU  15  -3.786  12.946   5.277
  114    H    ILE  16           H        ILE  16  -3.690   8.535   3.504
  115    HA   ILE  16           HA       ILE  16  -1.055   7.915   4.293
  116    HB   ILE  16           HB       ILE  16  -2.671   6.248   2.353
  117   1HG1  ILE  16          2HG1      ILE  16  -4.246   6.838   4.044
  118   2HG1  ILE  16          1HG1      ILE  16  -3.632   5.255   4.518
  119   1HG2  ILE  16          1HG2      ILE  16  -1.548   4.636   4.307
  120   2HG2  ILE  16          2HG2      ILE  16  -0.312   5.867   4.054
  121   3HG2  ILE  16          3HG2      ILE  16  -0.884   4.901   2.695
  122   1HD1  ILE  16          1HD1      ILE  16  -3.535   6.528   6.510
  123   2HD1  ILE  16          2HD1      ILE  16  -2.935   7.956   5.667
  124   3HD1  ILE  16          3HD1      ILE  16  -1.880   6.561   5.898
  125    H    GLN  17           H        GLN  17  -2.322   8.802   1.144
  126    HA   GLN  17           HA       GLN  17   0.033   7.966  -0.335
  127   1HB   GLN  17          2HB       GLN  17  -2.029   8.173  -1.552
  128   2HB   GLN  17          1HB       GLN  17  -2.262   9.829  -0.993
  129   1HG   GLN  17          2HG       GLN  17  -0.967  10.657  -2.642
  130   2HG   GLN  17          1HG       GLN  17   0.320   9.502  -2.296
  131   1HE2  GLN  17          1HE2      GLN  17  -2.901   8.295  -3.041
  132   2HE2  GLN  17          2HE2      GLN  17  -2.527   7.710  -4.590
  133    H    LYS  18           H        LYS  18  -1.068  10.985   1.162
  134    HA   LYS  18           HA       LYS  18   0.992  12.663   0.091
  135   1HB   LYS  18          2HB       LYS  18  -1.047  12.829   2.192
  136   2HB   LYS  18          1HB       LYS  18   0.428  13.710   2.596
  137   1HG   LYS  18          2HG       LYS  18   0.305  14.744   0.271
  138   2HG   LYS  18          1HG       LYS  18  -1.315  14.055   0.146
  139   1HD   LYS  18          2HD       LYS  18  -0.698  15.600   2.618
  140   2HD   LYS  18          1HD       LYS  18  -0.884  16.521   1.125
  141   1HE   LYS  18          2HE       LYS  18  -3.067  16.381   2.108
  142   2HE   LYS  18          1HE       LYS  18  -3.057  15.255   0.750
  143   1HZ   LYS  18          1HZ       LYS  18  -3.423  13.567   2.115
  144   2HZ   LYS  18          2HZ       LYS  18  -3.651  14.681   3.379
  145   3HZ   LYS  18          3HZ       LYS  18  -2.119  13.996   3.111
  146    H    GLU  19           H        GLU  19   0.838  10.593   2.966
  147    HA   GLU  19           HA       GLU  19   3.406  11.447   4.005
  148   1HB   GLU  19          2HB       GLU  19   1.983   8.822   4.530
  149   2HB   GLU  19          1HB       GLU  19   3.180   9.611   5.558
  150   1HG   GLU  19          2HG       GLU  19   1.477  11.616   5.515
  151   2HG   GLU  19          1HG       GLU  19   0.315  10.366   5.070
  152    H    GLU  20           H        GLU  20   2.313   8.655   2.068
  153    HA   GLU  20           HA       GLU  20   4.843   7.356   1.887
  154   1HB   GLU  20          2HB       GLU  20   2.408   6.659   1.061
  155   2HB   GLU  20          1HB       GLU  20   2.991   7.329  -0.463
  156   1HG   GLU  20          2HG       GLU  20   3.779   5.184  -0.721
  157   2HG   GLU  20          1HG       GLU  20   5.140   5.852   0.181
  158    H    THR  21           H        THR  21   3.284   9.575  -0.459
  159    HA   THR  21           HA       THR  21   5.355   9.806  -2.309
  160    HB   THR  21           HB       THR  21   3.951  12.301  -1.397
  161    HG1  THR  21           HG1      THR  21   2.714  10.033  -1.730
  162   1HG2  THR  21          1HG2      THR  21   4.802  11.069  -4.018
  163   2HG2  THR  21          2HG2      THR  21   5.316  12.602  -3.312
  164   3HG2  THR  21          3HG2      THR  21   3.681  12.430  -3.951
  165    H    ARG  22           H        ARG  22   4.916  11.952   0.530
  166    HA   ARG  22           HA       ARG  22   7.306  13.390   0.338
  167   1HB   ARG  22          2HB       ARG  22   5.292  13.099   2.248
  168   2HB   ARG  22          1HB       ARG  22   6.757  12.603   3.095
  169   1HG   ARG  22          2HG       ARG  22   7.861  14.684   2.544
  170   2HG   ARG  22          1HG       ARG  22   6.524  15.166   1.497
  171   1HD   ARG  22          2HD       ARG  22   6.528  16.205   3.829
  172   2HD   ARG  22          1HD       ARG  22   5.033  15.404   3.349
  173    HE   ARG  22           HE       ARG  22   6.476  13.416   4.641
  174   1HH1  ARG  22          1HH2      ARG  22   5.444  16.629   5.346
  175   2HH1  ARG  22          2HH2      ARG  22   5.299  16.350   7.050
  176   1HH2  ARG  22          2HH1      ARG  22   6.291  13.033   6.860
  177   2HH2  ARG  22          1HH1      ARG  22   5.779  14.314   7.907
  178    H    ASP  23           H        ASP  23   6.787  10.142   1.674
  179    HA   ASP  23           HA       ASP  23   9.442   9.802   2.709
  180   1HB   ASP  23          2HB       ASP  23   7.322   8.365   3.124
  181   2HB   ASP  23          1HB       ASP  23   7.763   7.543   1.627
  182    H    ILE  24           H        ILE  24   7.974   9.038  -0.442
  183    HA   ILE  24           HA       ILE  24  10.384   7.839  -1.511
  184    HB   ILE  24           HB       ILE  24   7.937   8.992  -2.883
  185   1HG1  ILE  24          2HG1      ILE  24   8.716   6.095  -2.486
  186   2HG1  ILE  24          1HG1      ILE  24   7.725   6.967  -1.317
  187   1HG2  ILE  24          1HG2      ILE  24   8.884   7.311  -4.701
  188   2HG2  ILE  24          2HG2      ILE  24  10.419   7.654  -3.903
  189   3HG2  ILE  24          3HG2      ILE  24   9.483   8.968  -4.617
  190   1HD1  ILE  24          1HD1      ILE  24   5.896   6.718  -2.602
  191   2HD1  ILE  24          2HD1      ILE  24   6.846   5.690  -3.675
  192   3HD1  ILE  24          3HD1      ILE  24   6.726   7.421  -3.990
  193    H    ILE  25           H        ILE  25   8.770  10.913  -2.424
  194    HA   ILE  25           HA       ILE  25  10.709  12.081  -3.970
  195    HB   ILE  25           HB       ILE  25   9.320  13.542  -1.705
  196   1HG1  ILE  25          2HG1      ILE  25   7.658  12.295  -2.959
  197   2HG1  ILE  25          1HG1      ILE  25   7.565  13.984  -3.457
  198   1HG2  ILE  25          1HG2      ILE  25  10.860  14.326  -4.121
  199   2HG2  ILE  25          2HG2      ILE  25  10.658  15.177  -2.589
  200   3HG2  ILE  25          3HG2      ILE  25   9.387  15.244  -3.810
  201   1HD1  ILE  25          1HD1      ILE  25   8.648  11.626  -4.959
  202   2HD1  ILE  25          2HD1      ILE  25   9.309  13.228  -5.286
  203   3HD1  ILE  25          3HD1      ILE  25   7.589  12.918  -5.524
  204    H    GLN  26           H        GLN  26  10.797  11.768  -0.438
  205    HA   GLN  26           HA       GLN  26  13.218  13.292  -0.081
  206   1HB   GLN  26          2HB       GLN  26  11.843  11.186   1.603
  207   2HB   GLN  26          1HB       GLN  26  13.318  12.004   2.120
  208   1HG   GLN  26          2HG       GLN  26  10.909  13.574   1.213
  209   2HG   GLN  26          1HG       GLN  26  11.054  13.013   2.879
  210   1HE2  GLN  26          1HE2      GLN  26  12.924  13.832   4.151
  211   2HE2  GLN  26          2HE2      GLN  26  13.696  15.272   3.695
  212    H    ALA  27           H        ALA  27  12.644   9.755  -0.079
  213    HA   ALA  27           HA       ALA  27  15.322   8.922   0.067
  214   1HB   ALA  27          1HB       ALA  27  14.088   7.144  -1.726
  215   2HB   ALA  27          2HB       ALA  27  12.783   7.749  -0.707
  216   3HB   ALA  27          3HB       ALA  27  14.188   6.974   0.026
  217    H    LEU  28           H        LEU  28  13.411   9.633  -2.876
  218    HA   LEU  28           HA       LEU  28  15.434   9.104  -4.778
  219   1HB   LEU  28          2HB       LEU  28  13.051  10.927  -4.713
  220   2HB   LEU  28          1HB       LEU  28  14.198  11.072  -6.044
  221    HG   LEU  28           HG       LEU  28  12.983   8.428  -5.213
  222   1HD1  LEU  28          1HD1      LEU  28  11.283   8.703  -6.829
  223   2HD1  LEU  28          2HD1      LEU  28  12.097  10.074  -7.582
  224   3HD1  LEU  28          3HD1      LEU  28  11.329  10.262  -6.004
  225   1HD2  LEU  28          1HD2      LEU  28  13.596   8.186  -7.816
  226   2HD2  LEU  28          2HD2      LEU  28  14.783   7.875  -6.549
  227   3HD2  LEU  28          3HD2      LEU  28  14.773   9.427  -7.385
  228    H    LEU  29           H        LEU  29  14.612  12.255  -3.283
  229    HA   LEU  29           HA       LEU  29  16.773  13.711  -4.399
  230   1HB   LEU  29          2HB       LEU  29  14.950  14.038  -2.075
  231   2HB   LEU  29          1HB       LEU  29  16.450  14.966  -2.025
  232    HG   LEU  29           HG       LEU  29  15.938  15.781  -4.352
  233   1HD1  LEU  29          1HD1      LEU  29  13.955  13.765  -4.180
  234   2HD1  LEU  29          2HD1      LEU  29  14.228  14.888  -5.511
  235   3HD1  LEU  29          3HD1      LEU  29  13.095  15.304  -4.225
  236   1HD2  LEU  29          1HD2      LEU  29  13.975  17.251  -3.558
  237   2HD2  LEU  29          2HD2      LEU  29  15.448  17.302  -2.590
  238   3HD2  LEU  29          3HD2      LEU  29  14.067  16.349  -2.045
  239    H    GLU  30           H        GLU  30  16.746  11.287  -1.946
  240    HA   GLU  30           HA       GLU  30  19.268  12.134  -0.714
  241   1HB   GLU  30          2HB       GLU  30  17.310  10.718   0.328
  242   2HB   GLU  30          1HB       GLU  30  18.131   9.365  -0.450
  243   1HG   GLU  30          2HG       GLU  30  20.120   9.706   0.796
  244   2HG   GLU  30          1HG       GLU  30  19.626  11.325   1.294
  245    H    ASP  31           H        ASP  31  18.228   9.906  -3.239
  246    HA   ASP  31           HA       ASP  31  21.086   9.520  -3.955
  247   1HB   ASP  31          2HB       ASP  31  19.117   7.371  -3.233
  248   2HB   ASP  31          1HB       ASP  31  20.351   7.041  -4.451
  249    H    GLY  32           H        GLY  32  18.790  11.039  -5.109
  250   1HA   GLY  32          2HA       GLY  32  19.193  10.325  -7.866
  251   2HA   GLY  32          1HA       GLY  32  17.607   9.773  -7.325
  252    H    SER  33           H        SER  33  19.304  12.701  -6.262
  253    HA   SER  33           HA       SER  33  17.013  14.365  -6.471
  254   1HB   SER  33          2HB       SER  33  19.947  15.121  -6.613
  255   2HB   SER  33          1HB       SER  33  18.626  16.261  -6.371
  256    HG   SER  33           HG       SER  33  19.150  14.011  -4.717
  257    H    ASP  34           H        ASP  34  19.155  16.176  -8.175
  258    HA   ASP  34           HA       ASP  34  19.109  16.996 -10.375
  259   1HB   ASP  34          2HB       ASP  34  18.901  14.010 -10.722
  260   2HB   ASP  34          1HB       ASP  34  18.860  15.082 -12.123
  261    HA   PRO  35           HA       PRO  35  14.386  16.381 -10.362
  262   1HB   PRO  35          2HB       PRO  35  13.703  18.760  -9.183
  263   2HB   PRO  35          1HB       PRO  35  13.953  17.254  -8.277
  264   1HG   PRO  35          2HG       PRO  35  15.781  19.572  -8.639
  265   2HG   PRO  35          1HG       PRO  35  15.496  18.569  -7.207
  266   1HD   PRO  35          2HD       PRO  35  17.685  18.262  -8.829
  267   2HD   PRO  35          1HD       PRO  35  16.973  16.929  -7.893
  268    H    ASP  36           H        ASP  36  16.724  18.433 -11.619
  269    HA   ASP  36           HA       ASP  36  14.848  20.186 -13.075
  270   1HB   ASP  36          2HB       ASP  36  17.812  19.987 -13.598
  271   2HB   ASP  36          1HB       ASP  36  16.748  21.380 -13.798
  272    H    ALA  37           H        ALA  37  16.401  17.150 -13.496
  273    HA   ALA  37           HA       ALA  37  16.547  17.164 -16.385
  274   1HB   ALA  37          1HB       ALA  37  16.800  14.716 -16.153
  275   2HB   ALA  37          2HB       ALA  37  16.350  14.832 -14.452
  276   3HB   ALA  37          3HB       ALA  37  17.848  15.570 -15.020
  277    H    LEU  38           H        LEU  38  14.549  14.813 -14.652
  278    HA   LEU  38           HA       LEU  38  11.980  15.730 -15.241
  279   1HB   LEU  38          2HB       LEU  38  13.428  14.961 -17.634
  280   2HB   LEU  38          1HB       LEU  38  12.014  13.931 -17.408
  281    HG   LEU  38           HG       LEU  38  11.836  16.931 -17.132
  282   1HD1  LEU  38          1HD1      LEU  38  10.748  16.412 -19.579
  283   2HD1  LEU  38          2HD1      LEU  38  12.099  15.278 -19.573
  284   3HD1  LEU  38          3HD1      LEU  38  12.392  17.002 -19.343
  285   1HD2  LEU  38          1HD2      LEU  38  10.066  15.066 -16.411
  286   2HD2  LEU  38          2HD2      LEU  38   9.665  15.129 -18.127
  287   3HD2  LEU  38          3HD2      LEU  38   9.547  16.585 -17.140
  288    H    TYR  39           H        TYR  39  10.388  14.114 -14.798
  289    HA   TYR  39           HA       TYR  39  11.425  11.380 -14.224
  290   1HB   TYR  39          2HB       TYR  39  10.172  13.310 -12.306
  291   2HB   TYR  39          1HB       TYR  39   9.816  11.593 -12.126
  292    HD1  TYR  39           HD1      TYR  39  11.401  10.107 -11.181
  293    HD2  TYR  39           HD2      TYR  39  12.609  14.053 -12.370
  294    HE1  TYR  39           HE1      TYR  39  13.598   9.764 -10.083
  295    HE2  TYR  39           HE2      TYR  39  14.807  13.711 -11.273
  296    HH   TYR  39           HH       TYR  39  15.985  12.383  -9.895
  297    H    GLU  40           H        GLU  40   9.677   9.770 -14.109
  298    HA   GLU  40           HA       GLU  40   7.198  10.702 -15.504
  299   1HB   GLU  40          2HB       GLU  40   8.225   7.881 -15.703
  300   2HB   GLU  40          1HB       GLU  40   7.185   8.764 -16.820
  301   1HG   GLU  40          2HG       GLU  40   9.137   8.963 -18.005
  302   2HG   GLU  40          1HG       GLU  40   9.369  10.341 -16.931
  303    H    ILE  41           H        ILE  41   5.500  10.592 -14.122
  304    HA   ILE  41           HA       ILE  41   5.604   8.799 -11.790
  305    HB   ILE  41           HB       ILE  41   3.489  10.758 -12.735
  306   1HG1  ILE  41          2HG1      ILE  41   4.342  12.088 -10.787
  307   2HG1  ILE  41          1HG1      ILE  41   5.628  10.897 -10.588
  308   1HG2  ILE  41          1HG2      ILE  41   2.180   9.525 -11.336
  309   2HG2  ILE  41          2HG2      ILE  41   3.070  10.360 -10.063
  310   3HG2  ILE  41          3HG2      ILE  41   3.565   8.746 -10.573
  311   1HD1  ILE  41          1HD1      ILE  41   6.715  11.539 -12.529
  312   2HD1  ILE  41          2HD1      ILE  41   6.015  13.085 -12.046
  313   3HD1  ILE  41          3HD1      ILE  41   5.232  12.112 -13.293
  314    H    GLU  42           H        GLU  42   4.441   6.902 -11.598
  315    HA   GLU  42           HA       GLU  42   2.794   6.123 -13.969
  316   1HB   GLU  42          2HB       GLU  42   3.945   4.135 -12.032
  317   2HB   GLU  42          1HB       GLU  42   3.538   3.920 -13.735
  318   1HG   GLU  42          2HG       GLU  42   5.397   5.577 -14.263
  319   2HG   GLU  42          1HG       GLU  42   5.890   5.428 -12.576
  320    H    HIS  43           H        HIS  43   0.657   5.834 -13.587
  321    HA   HIS  43           HA       HIS  43  -0.209   5.412 -10.752
  322   1HB   HIS  43          2HB       HIS  43  -1.543   6.915 -13.020
  323   2HB   HIS  43          1HB       HIS  43  -2.380   6.483 -11.529
  324    HD2  HIS  43           HD2      HIS  43  -0.713   9.531 -12.738
  325    HE1  HIS  43           HE1      HIS  43   0.424   9.378  -8.674
  326    HE2  HIS  43           HE2      HIS  43   0.309  10.852 -10.735
  327    H    HIS  44           H        HIS  44  -1.328   3.540 -10.390
  328    HA   HIS  44           HA       HIS  44  -2.190   1.991 -12.793
  329   1HB   HIS  44          2HB       HIS  44  -1.738   0.900 -10.008
  330   2HB   HIS  44          1HB       HIS  44  -1.852  -0.004 -11.520
  331    HD2  HIS  44           HD2      HIS  44   0.456   0.379 -13.279
  332    HE1  HIS  44           HE1      HIS  44   2.923   1.894 -10.204
  333    HE2  HIS  44           HE2      HIS  44   2.890   1.004 -12.579
  334    H    LEU  45           H        LEU  45  -4.325   1.476 -13.015
  335    HA   LEU  45           HA       LEU  45  -6.120   1.824 -10.663
  336   1HB   LEU  45          2HB       LEU  45  -6.445   3.064 -13.405
  337   2HB   LEU  45          1HB       LEU  45  -7.785   2.895 -12.271
  338    HG   LEU  45           HG       LEU  45  -6.047   4.030 -10.603
  339   1HD1  LEU  45          1HD1      LEU  45  -4.374   5.284 -11.561
  340   2HD1  LEU  45          2HD1      LEU  45  -5.278   5.541 -13.054
  341   3HD1  LEU  45          3HD1      LEU  45  -4.458   4.005 -12.771
  342   1HD2  LEU  45          1HD2      LEU  45  -7.064   6.200 -11.170
  343   2HD2  LEU  45          2HD2      LEU  45  -8.271   4.917 -11.255
  344   3HD2  LEU  45          3HD2      LEU  45  -7.568   5.565 -12.737
  345    H    PHE  46           H        PHE  46  -7.845   0.351 -10.636
  346    HA   PHE  46           HA       PHE  46  -7.892  -1.600 -12.904
  347   1HB   PHE  46          2HB       PHE  46  -8.986  -2.769 -10.541
  348   2HB   PHE  46          1HB       PHE  46  -7.518  -3.231 -11.401
  349    HD1  PHE  46           HD1      PHE  46  -5.513  -1.419 -11.038
  350    HD2  PHE  46           HD2      PHE  46  -8.720  -2.225  -8.298
  351    HE1  PHE  46           HE1      PHE  46  -4.139  -0.537  -9.171
  352    HE2  PHE  46           HE2      PHE  46  -7.347  -1.344  -6.431
  353    HZ   PHE  46           HZ       PHE  46  -5.056  -0.501  -6.868
  354    H    ALA  47           H        ALA  47 -10.005  -2.578 -13.331
  355    HA   ALA  47           HA       ALA  47 -12.317  -1.062 -12.221
  356   1HB   ALA  47          1HB       ALA  47 -12.329  -1.692 -15.141
  357   2HB   ALA  47          2HB       ALA  47 -11.365  -0.317 -14.603
  358   3HB   ALA  47          3HB       ALA  47 -13.098  -0.360 -14.278
  359    H    GLU  48           H        GLU  48 -14.429  -2.190 -13.059
  360    HA   GLU  48           HA       GLU  48 -13.978  -5.137 -12.851
  361   1HB   GLU  48          2HB       GLU  48 -16.378  -3.442 -12.095
  362   2HB   GLU  48          1HB       GLU  48 -16.338  -5.204 -12.016
  363   1HG   GLU  48          2HG       GLU  48 -14.232  -4.908 -10.553
  364   2HG   GLU  48          1HG       GLU  48 -14.733  -3.223 -10.401
  365    H    ASP  49           H        ASP  49 -15.516  -2.589 -14.713
  366    HA   ASP  49           HA       ASP  49 -16.451  -4.676 -16.644
  367   1HB   ASP  49          2HB       ASP  49 -18.144  -3.074 -15.408
  368   2HB   ASP  49          1HB       ASP  49 -17.594  -1.901 -16.606
  369    H    PHE  50           H        PHE  50 -15.648  -4.527 -18.699
  370    HA   PHE  50           HA       PHE  50 -13.424  -2.847 -19.293
  371   1HB   PHE  50          2HB       PHE  50 -13.582  -3.705 -21.541
  372   2HB   PHE  50          1HB       PHE  50 -14.041  -5.017 -20.454
  373    HD1  PHE  50           HD1      PHE  50 -16.320  -5.827 -20.340
  374    HD2  PHE  50           HD2      PHE  50 -15.300  -2.479 -22.831
  375    HE1  PHE  50           HE1      PHE  50 -18.531  -5.984 -21.456
  376    HE2  PHE  50           HE2      PHE  50 -17.508  -2.637 -23.946
  377    HZ   PHE  50           HZ       PHE  50 -19.124  -4.387 -23.258
  378    H    ASP  51           H        ASP  51 -16.860  -2.334 -19.577
  379    HA   ASP  51           HA       ASP  51 -16.893  -0.268 -21.529
  380   1HB   ASP  51          2HB       ASP  51 -18.816  -1.514 -20.116
  381   2HB   ASP  51          1HB       ASP  51 -18.714  -0.018 -19.186
  382    H    LYS  52           H        LYS  52 -17.352   0.378 -18.047
  383    HA   LYS  52           HA       LYS  52 -16.573   3.092 -18.190
  384   1HB   LYS  52          2HB       LYS  52 -16.531   3.073 -15.818
  385   2HB   LYS  52          1HB       LYS  52 -17.713   1.837 -16.249
  386   1HG   LYS  52          2HG       LYS  52 -15.820   0.143 -16.114
  387   2HG   LYS  52          1HG       LYS  52 -14.838   1.421 -15.397
  388   1HD   LYS  52          2HD       LYS  52 -16.038   1.434 -13.433
  389   2HD   LYS  52          1HD       LYS  52 -17.544   0.971 -14.228
  390   1HE   LYS  52          2HE       LYS  52 -16.802  -1.322 -14.441
  391   2HE   LYS  52          1HE       LYS  52 -15.189  -0.902 -13.867
  392   1HZ   LYS  52          1HZ       LYS  52 -16.007  -1.509 -11.889
  393   2HZ   LYS  52          2HZ       LYS  52 -17.625  -1.340 -12.377
  394   3HZ   LYS  52          3HZ       LYS  52 -16.737   0.021 -11.885
  395    H    LEU  53           H        LEU  53 -14.633   0.190 -18.072
  396    HA   LEU  53           HA       LEU  53 -12.188   1.364 -17.148
  397   1HB   LEU  53          2HB       LEU  53 -12.853  -1.155 -17.581
  398   2HB   LEU  53          1HB       LEU  53 -12.187  -0.842 -19.185
  399    HG   LEU  53           HG       LEU  53 -10.667  -0.136 -16.672
  400   1HD1  LEU  53          1HD1      LEU  53  -9.678  -2.259 -16.596
  401   2HD1  LEU  53          2HD1      LEU  53 -10.178  -2.656 -18.240
  402   3HD1  LEU  53          3HD1      LEU  53 -11.365  -2.644 -16.936
  403   1HD2  LEU  53          1HD2      LEU  53  -9.757   0.920 -18.598
  404   2HD2  LEU  53          2HD2      LEU  53 -10.013  -0.509 -19.600
  405   3HD2  LEU  53          3HD2      LEU  53  -8.759  -0.515 -18.360
  406    H    GLU  54           H        GLU  54 -13.295   0.678 -20.489
  407    HA   GLU  54           HA       GLU  54 -11.106   2.027 -21.751
  408   1HB   GLU  54          2HB       GLU  54 -13.855   1.175 -22.615
  409   2HB   GLU  54          1HB       GLU  54 -12.904   2.223 -23.669
  410   1HG   GLU  54          2HG       GLU  54 -11.909  -0.405 -22.530
  411   2HG   GLU  54          1HG       GLU  54 -12.577  -0.214 -24.152
  412    H    LYS  55           H        LYS  55 -14.121   3.148 -20.370
  413    HA   LYS  55           HA       LYS  55 -14.156   5.737 -21.631
  414   1HB   LYS  55          2HB       LYS  55 -15.320   4.822 -18.982
  415   2HB   LYS  55          1HB       LYS  55 -15.702   6.347 -19.780
  416   1HG   LYS  55          2HG       LYS  55 -15.981   3.891 -21.431
  417   2HG   LYS  55          1HG       LYS  55 -17.167   4.109 -20.144
  418   1HD   LYS  55          2HD       LYS  55 -17.529   6.463 -21.018
  419   2HD   LYS  55          1HD       LYS  55 -16.546   6.014 -22.412
  420   1HE   LYS  55          2HE       LYS  55 -18.092   4.282 -23.045
  421   2HE   LYS  55          1HE       LYS  55 -18.993   4.460 -21.540
  422   1HZ   LYS  55          1HZ       LYS  55 -20.007   6.333 -22.256
  423   2HZ   LYS  55          2HZ       LYS  55 -19.728   5.633 -23.780
  424   3HZ   LYS  55          3HZ       LYS  55 -18.688   6.842 -23.192
  425    H    ALA  56           H        ALA  56 -13.447   5.015 -18.193
  426    HA   ALA  56           HA       ALA  56 -12.221   7.437 -17.542
  427   1HB   ALA  56          1HB       ALA  56 -10.825   6.015 -15.910
  428   2HB   ALA  56          2HB       ALA  56 -11.671   4.623 -16.586
  429   3HB   ALA  56          3HB       ALA  56 -12.579   5.894 -15.768
  430    H    ALA  57           H        ALA  57 -10.637   4.525 -18.884
  431    HA   ALA  57           HA       ALA  57  -8.001   5.509 -19.001
  432   1HB   ALA  57          1HB       ALA  57  -7.614   3.885 -20.763
  433   2HB   ALA  57          2HB       ALA  57  -9.339   3.801 -21.123
  434   3HB   ALA  57          3HB       ALA  57  -8.725   3.173 -19.593
  435    H    VAL  58           H        VAL  58 -10.330   5.534 -21.732
  436    HA   VAL  58           HA       VAL  58  -8.895   7.205 -23.456
  437    HB   VAL  58           HB       VAL  58 -11.880   7.013 -22.973
  438   1HG1  VAL  58          1HG1      VAL  58 -11.746   7.993 -25.458
  439   2HG1  VAL  58          2HG1      VAL  58 -10.280   8.735 -24.817
  440   3HG1  VAL  58          3HG1      VAL  58 -11.837   9.053 -24.052
  441   1HG2  VAL  58          1HG2      VAL  58 -10.675   4.999 -23.838
  442   2HG2  VAL  58          2HG2      VAL  58 -10.104   5.964 -25.201
  443   3HG2  VAL  58          3HG2      VAL  58 -11.829   5.651 -25.000
  444    H    GLU  59           H        GLU  59 -10.895   8.088 -20.672
  445    HA   GLU  59           HA       GLU  59 -10.901  10.912 -21.090
  446   1HB   GLU  59          2HB       GLU  59 -11.565   9.061 -18.937
  447   2HB   GLU  59          1HB       GLU  59 -10.822  10.536 -18.320
  448   1HG   GLU  59          2HG       GLU  59 -13.215  10.895 -18.457
  449   2HG   GLU  59          1HG       GLU  59 -12.439  11.859 -19.714
  450    H    ALA  60           H        ALA  60  -8.725   8.890 -19.088
  451    HA   ALA  60           HA       ALA  60  -6.970  11.022 -18.354
  452   1HB   ALA  60          1HB       ALA  60  -5.880   8.264 -18.741
  453   2HB   ALA  60          2HB       ALA  60  -7.159   8.485 -17.546
  454   3HB   ALA  60          3HB       ALA  60  -5.648   9.383 -17.398
  455    H    PHE  61           H        PHE  61  -6.838   8.678 -21.040
  456    HA   PHE  61           HA       PHE  61  -4.375   9.422 -22.168
  457   1HB   PHE  61          2HB       PHE  61  -5.501   7.568 -23.143
  458   2HB   PHE  61          1HB       PHE  61  -6.965   8.508 -23.429
  459    HD1  PHE  61           HD1      PHE  61  -3.380   8.200 -24.422
  460    HD2  PHE  61           HD2      PHE  61  -7.267   9.721 -25.439
  461    HE1  PHE  61           HE1      PHE  61  -2.547   8.823 -26.673
  462    HE2  PHE  61           HE2      PHE  61  -6.434  10.344 -27.689
  463    HZ   PHE  61           HZ       PHE  61  -4.074   9.895 -28.307
  464    H    LYS  62           H        LYS  62  -7.521  11.024 -22.386
  465    HA   LYS  62           HA       LYS  62  -6.697  12.953 -24.378
  466   1HB   LYS  62          2HB       LYS  62  -9.088  12.351 -23.823
  467   2HB   LYS  62          1HB       LYS  62  -8.899  13.251 -22.318
  468   1HG   LYS  62          2HG       LYS  62  -7.929  15.005 -24.245
  469   2HG   LYS  62          1HG       LYS  62  -9.312  14.248 -25.036
  470   1HD   LYS  62          2HD       LYS  62 -10.802  14.922 -23.303
  471   2HD   LYS  62          1HD       LYS  62  -9.473  15.358 -22.228
  472   1HE   LYS  62          2HE       LYS  62 -10.136  16.740 -24.844
  473   2HE   LYS  62          1HE       LYS  62 -10.495  17.368 -23.236
  474   1HZ   LYS  62          1HZ       LYS  62  -7.950  17.186 -24.634
  475   2HZ   LYS  62          2HZ       LYS  62  -7.916  16.859 -22.967
  476   3HZ   LYS  62          3HZ       LYS  62  -8.502  18.350 -23.531
  477    H    MET  63           H        MET  63  -7.181  13.219 -20.835
  478    HA   MET  63           HA       MET  63  -6.374  15.820 -20.385
  479   1HB   MET  63          2HB       MET  63  -5.884  13.283 -18.849
  480   2HB   MET  63          1HB       MET  63  -5.156  14.788 -18.289
  481   1HG   MET  63          2HG       MET  63  -7.555  15.776 -18.556
  482   2HG   MET  63          1HG       MET  63  -8.074  14.090 -18.549
  483   1HE   MET  63          1HE       MET  63  -7.746  12.776 -15.193
  484   2HE   MET  63          2HE       MET  63  -6.541  12.425 -16.431
  485   3HE   MET  63          3HE       MET  63  -8.227  12.647 -16.892
  486    H    GLY  64           H        GLY  64  -4.165  13.030 -20.752
  487   1HA   GLY  64          2HA       GLY  64  -2.222  13.848 -22.358
  488   2HA   GLY  64          1HA       GLY  64  -1.894  14.926 -21.000
  489    H    PHE  65           H        PHE  65  -3.069  11.617 -20.665
  490    HA   PHE  65           HA       PHE  65  -0.515  10.972 -19.257
  491   1HB   PHE  65          2HB       PHE  65  -3.326   9.891 -18.984
  492   2HB   PHE  65          1HB       PHE  65  -1.931   9.081 -18.271
  493    HD1  PHE  65           HD1      PHE  65  -3.776  12.320 -18.362
  494    HD2  PHE  65           HD2      PHE  65  -0.971   9.851 -16.245
  495    HE1  PHE  65           HE1      PHE  65  -3.850  13.885 -16.440
  496    HE2  PHE  65           HE2      PHE  65  -1.043  11.417 -14.322
  497    HZ   PHE  65           HZ       PHE  65  -2.483  13.433 -14.419
  498    H    GLU  66           H        GLU  66   0.428   8.861 -19.641
  499    HA   GLU  66           HA       GLU  66  -0.112   7.892 -22.394
  500   1HB   GLU  66          2HB       GLU  66   2.238   8.175 -20.764
  501   2HB   GLU  66          1HB       GLU  66   2.052   6.474 -21.196
  502   1HG   GLU  66          2HG       GLU  66   1.784   8.673 -23.249
  503   2HG   GLU  66          1HG       GLU  66   3.345   7.952 -22.856
  504    H    VAL  67           H        VAL  67  -2.182   6.920 -21.544
  505    HA   VAL  67           HA       VAL  67  -2.444   4.942 -19.611
  506    HB   VAL  67           HB       VAL  67  -4.422   5.543 -20.756
  507   1HG1  VAL  67          1HG1      VAL  67  -4.685   5.467 -23.158
  508   2HG1  VAL  67          2HG1      VAL  67  -3.142   4.636 -23.349
  509   3HG1  VAL  67          3HG1      VAL  67  -3.178   6.315 -22.813
  510   1HG2  VAL  67          1HG2      VAL  67  -3.870   2.957 -20.397
  511   2HG2  VAL  67          2HG2      VAL  67  -3.975   2.937 -22.157
  512   3HG2  VAL  67          3HG2      VAL  67  -5.355   3.470 -21.197
  513    H    LEU  68           H        LEU  68  -2.025   2.710 -19.514
  514    HA   LEU  68           HA       LEU  68  -0.424   1.586 -21.776
  515   1HB   LEU  68          2HB       LEU  68   0.458   2.121 -19.116
  516   2HB   LEU  68          1HB       LEU  68   0.352   0.370 -19.297
  517    HG   LEU  68           HG       LEU  68   1.629   0.617 -21.472
  518   1HD1  LEU  68          1HD1      LEU  68   2.996   3.009 -20.982
  519   2HD1  LEU  68          2HD1      LEU  68   1.300   3.415 -20.726
  520   3HD1  LEU  68          3HD1      LEU  68   1.819   2.723 -22.264
  521   1HD2  LEU  68          1HD2      LEU  68   3.230   1.739 -19.179
  522   2HD2  LEU  68          2HD2      LEU  68   3.707   0.534 -20.374
  523   3HD2  LEU  68          3HD2      LEU  68   2.577   0.102 -19.092
  524    H    GLU  69           H        GLU  69  -1.036  -0.462 -22.393
  525    HA   GLU  69           HA       GLU  69  -3.495  -1.567 -21.898
  526   1HB   GLU  69          2HB       GLU  69  -1.828  -2.477 -23.520
  527   2HB   GLU  69          1HB       GLU  69  -0.955  -3.204 -22.170
  528   1HG   GLU  69          2HG       GLU  69  -2.939  -4.528 -21.578
  529   2HG   GLU  69          1HG       GLU  69  -3.843  -3.779 -22.894
  530    H    ALA  70           H        ALA  70  -4.172  -3.428 -20.522
  531    HA   ALA  70           HA       ALA  70  -2.962  -3.175 -17.808
  532   1HB   ALA  70          1HB       ALA  70  -5.129  -4.126 -17.013
  533   2HB   ALA  70          2HB       ALA  70  -5.691  -4.168 -18.684
  534   3HB   ALA  70          3HB       ALA  70  -5.342  -2.623 -17.911
  535    H    GLU  71           H        GLU  71  -3.371  -5.344 -16.505
  536    HA   GLU  71           HA       GLU  71  -2.646  -7.663 -18.243
  537   1HB   GLU  71          2HB       GLU  71  -0.547  -7.291 -17.356
  538   2HB   GLU  71          1HB       GLU  71  -1.182  -6.505 -15.911
  539   1HG   GLU  71          2HG       GLU  71  -1.719  -8.571 -14.884
  540   2HG   GLU  71          1HG       GLU  71  -1.591  -9.455 -16.406
  541    H    GLU  72           H        GLU  72  -4.120  -9.254 -17.927
  542    HA   GLU  72           HA       GLU  72  -6.147  -9.186 -15.943
  543   1HB   GLU  72          2HB       GLU  72  -5.845 -11.883 -16.600
  544   2HB   GLU  72          1HB       GLU  72  -6.888 -10.722 -17.420
  545   1HG   GLU  72          2HG       GLU  72  -5.213 -10.219 -19.047
  546   2HG   GLU  72          1HG       GLU  72  -3.964 -11.049 -18.118
  547    H    THR  73           H        THR  73  -5.120  -8.848 -13.893
  548    HA   THR  73           HA       THR  73  -3.565 -11.193 -12.883
  549    HB   THR  73           HB       THR  73  -2.270  -9.155 -12.712
  550    HG1  THR  73           HG1      THR  73  -2.204 -10.521 -10.902
  551   1HG2  THR  73          1HG2      THR  73  -4.493  -7.757 -12.755
  552   2HG2  THR  73          2HG2      THR  73  -3.079  -7.117 -11.916
  553   3HG2  THR  73          3HG2      THR  73  -4.379  -7.878 -10.999
  554    H    GLU  74           H        GLU  74  -4.117  -9.895 -10.129
  555    HA   GLU  74           HA       GLU  74  -6.969 -10.182  -9.707
  556   1HB   GLU  74          2HB       GLU  74  -6.904 -12.260  -8.398
  557   2HB   GLU  74          1HB       GLU  74  -6.361 -12.563 -10.049
  558   1HG   GLU  74          2HG       GLU  74  -4.010 -12.390  -9.307
  559   2HG   GLU  74          1HG       GLU  74  -4.558 -12.108  -7.654
  560    H    ASP  75           H        ASP  75  -7.539  -9.485  -7.617
  561    HA   ASP  75           HA       ASP  75  -5.438  -8.070  -6.159
  562   1HB   ASP  75          2HB       ASP  75  -7.325  -7.422  -4.644
  563   2HB   ASP  75          1HB       ASP  75  -7.646  -7.048  -6.338
  564    H    GLU  76           H        GLU  76  -4.758 -10.724  -6.128
  565    HA   GLU  76           HA       GLU  76  -4.324 -12.551  -4.710
  566   1HB   GLU  76          2HB       GLU  76  -4.620 -10.382  -2.609
  567   2HB   GLU  76          1HB       GLU  76  -3.786 -11.921  -2.400
  568   1HG   GLU  76          2HG       GLU  76  -2.069 -10.343  -2.886
  569   2HG   GLU  76          1HG       GLU  76  -2.326 -11.226  -4.391
  570    H    ASP  77           H        ASP  77  -7.260 -11.438  -5.102
  571    HA   ASP  77           HA       ASP  77  -8.456 -12.989  -2.842
  572   1HB   ASP  77          2HB       ASP  77  -9.021 -10.437  -3.434
  573   2HB   ASP  77          1HB       ASP  77 -10.136 -11.217  -4.557
  574    H    GLY  78           H        GLY  78  -7.659 -13.248  -6.055
  575   1HA   GLY  78          2HA       GLY  78  -8.191 -15.000  -7.554
  576   2HA   GLY  78          1HA       GLY  78  -9.395 -15.575  -6.399
  577    H    ASN  79           H        ASN  79  -9.096 -12.360  -7.906
  578    HA   ASN  79           HA       ASN  79 -11.717 -12.861  -9.254
  579   1HB   ASN  79          2HB       ASN  79 -10.994 -10.807  -7.264
  580   2HB   ASN  79          1HB       ASN  79 -11.792 -10.173  -8.704
  581   1HD2  ASN  79          1HD2      ASN  79 -12.637 -10.971  -5.712
  582   2HD2  ASN  79          2HD2      ASN  79 -14.136 -11.724  -5.971
  583    H    LYS  80           H        LYS  80 -10.664 -13.124 -11.281
  584    HA   LYS  80           HA       LYS  80  -8.597 -11.678 -12.414
  585   1HB   LYS  80          2HB       LYS  80 -11.152 -12.726 -13.630
  586   2HB   LYS  80          1HB       LYS  80  -9.942 -11.906 -14.618
  587   1HG   LYS  80          2HG       LYS  80  -8.242 -13.519 -13.969
  588   2HG   LYS  80          1HG       LYS  80  -9.356 -14.289 -12.838
  589   1HD   LYS  80          2HD       LYS  80 -10.774 -15.050 -14.627
  590   2HD   LYS  80          1HD       LYS  80  -9.899 -14.079 -15.810
  591   1HE   LYS  80          2HE       LYS  80  -8.485 -15.791 -16.162
  592   2HE   LYS  80          1HE       LYS  80  -7.992 -15.725 -14.469
  593   1HZ   LYS  80          1HZ       LYS  80  -8.882 -17.897 -15.069
  594   2HZ   LYS  80          2HZ       LYS  80 -10.358 -17.184 -15.516
  595   3HZ   LYS  80          3HZ       LYS  80  -9.847 -17.144 -13.896
  596    H    LEU  81           H        LEU  81  -8.286  -9.511 -12.489
  597    HA   LEU  81           HA       LEU  81 -10.600  -7.786 -13.237
  598   1HB   LEU  81          2HB       LEU  81  -9.856  -6.103 -11.573
  599   2HB   LEU  81          1HB       LEU  81 -10.333  -7.614 -10.798
  600    HG   LEU  81           HG       LEU  81  -7.644  -8.011 -11.348
  601   1HD1  LEU  81          1HD1      LEU  81  -6.443  -6.061 -10.738
  602   2HD1  LEU  81          2HD1      LEU  81  -7.892  -5.255 -10.139
  603   3HD1  LEU  81          3HD1      LEU  81  -7.662  -5.482 -11.872
  604   1HD2  LEU  81          1HD2      LEU  81  -8.670  -8.711  -9.294
  605   2HD2  LEU  81          2HD2      LEU  81  -9.093  -7.053  -8.866
  606   3HD2  LEU  81          3HD2      LEU  81  -7.405  -7.565  -8.850
  607    H    LEU  82           H        LEU  82 -10.037  -6.086 -14.609
  608    HA   LEU  82           HA       LEU  82  -7.403  -6.285 -15.870
  609   1HB   LEU  82          2HB       LEU  82  -9.875  -4.631 -16.374
  610   2HB   LEU  82          1HB       LEU  82  -8.366  -4.296 -17.224
  611    HG   LEU  82           HG       LEU  82  -8.326  -6.466 -18.214
  612   1HD1  LEU  82          1HD1      LEU  82  -8.915  -7.880 -16.386
  613   2HD1  LEU  82          2HD1      LEU  82 -10.177  -8.127 -17.593
  614   3HD1  LEU  82          3HD1      LEU  82 -10.485  -7.099 -16.193
  615   1HD2  LEU  82          1HD2      LEU  82  -9.988  -4.841 -19.167
  616   2HD2  LEU  82          2HD2      LEU  82 -11.234  -5.601 -18.179
  617   3HD2  LEU  82          3HD2      LEU  82 -10.426  -6.528 -19.443
  618    H    CYS  83           H        CYS  83  -5.674  -5.003 -15.437
  619    HA   CYS  83           HA       CYS  83  -6.133  -2.565 -13.765
  620   1HB   CYS  83          2HB       CYS  83  -3.821  -3.031 -12.835
  621   2HB   CYS  83          1HB       CYS  83  -5.052  -4.205 -12.369
  622    HG   CYS  83           HG       CYS  83  -3.857  -5.974 -13.642
  623    H    PHE  84           H        PHE  84  -5.977  -1.000 -15.371
  624    HA   PHE  84           HA       PHE  84  -3.777  -1.192 -17.341
  625   1HB   PHE  84          2HB       PHE  84  -4.832   0.856 -18.315
  626   2HB   PHE  84          1HB       PHE  84  -5.950  -0.502 -18.198
  627    HD1  PHE  84           HD1      PHE  84  -5.210   2.878 -17.112
  628    HD2  PHE  84           HD2      PHE  84  -7.585  -0.602 -16.277
  629    HE1  PHE  84           HE1      PHE  84  -6.735   4.253 -15.724
  630    HE2  PHE  84           HE2      PHE  84  -9.111   0.773 -14.886
  631    HZ   PHE  84           HZ       PHE  84  -8.686   3.201 -14.611
  632    H    ASP  85           H        ASP  85  -2.093   0.346 -17.466
  633    HA   ASP  85           HA       ASP  85  -1.710   1.926 -14.959
  634   1HB   ASP  85          2HB       ASP  85   0.491   1.353 -16.925
  635   2HB   ASP  85          1HB       ASP  85   0.597   1.620 -15.185
  636    H    ALA  86           H        ALA  86  -0.530   4.027 -15.266
  637    HA   ALA  86           HA       ALA  86  -0.911   5.258 -17.943
  638   1HB   ALA  86          1HB       ALA  86  -2.956   5.654 -16.447
  639   2HB   ALA  86          2HB       ALA  86  -2.186   7.095 -17.111
  640   3HB   ALA  86          3HB       ALA  86  -1.895   6.632 -15.435
  641    H    THR  87           H        THR  87   0.865   6.473 -18.434
  642    HA   THR  87           HA       THR  87   2.693   7.182 -16.182
  643    HB   THR  87           HB       THR  87   4.015   7.527 -18.663
  644    HG1  THR  87           HG1      THR  87   3.718   5.303 -19.407
  645   1HG2  THR  87          1HG2      THR  87   5.206   5.399 -17.821
  646   2HG2  THR  87          2HG2      THR  87   4.105   5.485 -16.446
  647   3HG2  THR  87          3HG2      THR  87   5.226   6.809 -16.763
  648    H    MET  88           H        MET  88   3.315   9.308 -15.904
  649    HA   MET  88           HA       MET  88   2.324  11.296 -17.902
  650   1HB   MET  88          2HB       MET  88   0.817  11.231 -15.916
  651   2HB   MET  88          1HB       MET  88   2.200  11.599 -14.885
  652   1HG   MET  88          2HG       MET  88   1.183  13.704 -15.284
  653   2HG   MET  88          1HG       MET  88   2.553  13.657 -16.394
  654   1HE   MET  88          1HE       MET  88   0.011  15.671 -16.836
  655   2HE   MET  88          2HE       MET  88  -0.802  14.486 -15.819
  656   3HE   MET  88          3HE       MET  88  -1.450  14.858 -17.413
  657    H    GLN  89           H        GLN  89   4.331  11.817 -18.757
  658    HA   GLN  89           HA       GLN  89   6.733  12.038 -17.190
  659   1HB   GLN  89          2HB       GLN  89   5.929  12.919 -19.957
  660   2HB   GLN  89          1HB       GLN  89   7.487  13.399 -19.282
  661   1HG   GLN  89          2HG       GLN  89   8.267  11.198 -19.164
  662   2HG   GLN  89          1HG       GLN  89   6.640  10.517 -19.173
  663   1HE2  GLN  89          1HE2      GLN  89   7.680   9.169 -21.023
  664   2HE2  GLN  89          2HE2      GLN  89   7.613   9.830 -22.585
  665    H    SER  90           H        SER  90   7.265  13.643 -15.810
  666    HA   SER  90           HA       SER  90   6.757  16.436 -16.425
  667   1HB   SER  90          2HB       SER  90   5.282  16.911 -14.524
  668   2HB   SER  90          1HB       SER  90   4.519  15.741 -15.598
  669    HG   SER  90           HG       SER  90   5.903  15.241 -13.169
  670    H    ALA  91           H        ALA  91   7.492  17.816 -14.457
  671    HA   ALA  91           HA       ALA  91  10.093  16.943 -13.653
  672   1HB   ALA  91          1HB       ALA  91   8.375  19.275 -13.201
  673   2HB   ALA  91          2HB       ALA  91  10.127  19.191 -13.387
  674   3HB   ALA  91          3HB       ALA  91   9.392  18.891 -11.812
  675    H    LEU  92           H        LEU  92  10.568  17.142 -11.080
  676    HA   LEU  92           HA       LEU  92   8.777  15.105  -9.831
  677   1HB   LEU  92          2HB       LEU  92  11.209  14.524 -10.164
  678   2HB   LEU  92          1HB       LEU  92  11.613  15.823  -9.044
  679    HG   LEU  92           HG       LEU  92   9.800  14.571  -7.530
  680   1HD1  LEU  92          1HD1      LEU  92   9.196  12.836  -9.073
  681   2HD1  LEU  92          2HD1      LEU  92  10.207  12.076  -7.842
  682   3HD1  LEU  92          3HD1      LEU  92  10.887  12.471  -9.421
  683   1HD2  LEU  92          1HD2      LEU  92  12.199  15.022  -6.990
  684   2HD2  LEU  92          2HD2      LEU  92  12.644  13.568  -7.882
  685   3HD2  LEU  92          3HD2      LEU  92  11.666  13.441  -6.421
  686    H    ASP  93           H        ASP  93   7.254  16.393  -8.783
  687    HA   ASP  93           HA       ASP  93   8.309  18.024  -6.533
  688   1HB   ASP  93          2HB       ASP  93   6.066  19.447  -7.407
  689   2HB   ASP  93          1HB       ASP  93   7.750  19.939  -7.598
  690    H    ALA  94           H        ALA  94   7.475  16.850  -4.858
  691    HA   ALA  94           HA       ALA  94   5.374  15.104  -4.731
  692   1HB   ALA  94          1HB       ALA  94   5.182  16.864  -2.432
  693   2HB   ALA  94          2HB       ALA  94   6.869  16.548  -2.836
  694   3HB   ALA  94          3HB       ALA  94   5.772  15.204  -2.515
  695    H    LYS  95           H        LYS  95   4.784  18.428  -3.575
  696    HA   LYS  95           HA       LYS  95   2.087  18.562  -3.511
  697   1HB   LYS  95          2HB       LYS  95   3.993  20.564  -4.731
  698   2HB   LYS  95          1HB       LYS  95   2.274  20.909  -4.544
  699   1HG   LYS  95          2HG       LYS  95   3.325  19.795  -2.092
  700   2HG   LYS  95          1HG       LYS  95   4.291  21.185  -2.586
  701   1HD   LYS  95          2HD       LYS  95   2.257  22.550  -2.792
  702   2HD   LYS  95          1HD       LYS  95   1.268  21.160  -2.340
  703   1HE   LYS  95          2HE       LYS  95   2.080  21.145  -0.129
  704   2HE   LYS  95          1HE       LYS  95   3.491  22.116  -0.544
  705   1HZ   LYS  95          1HZ       LYS  95   0.933  22.974   0.290
  706   2HZ   LYS  95          2HZ       LYS  95   1.273  23.611  -1.249
  707   3HZ   LYS  95          3HZ       LYS  95   2.337  23.892   0.047
  708    H    LEU  96           H        LEU  96   3.801  19.214  -6.603
  709    HA   LEU  96           HA       LEU  96   1.562  19.276  -8.278
  710   1HB   LEU  96          2HB       LEU  96   4.247  19.375  -8.707
  711   2HB   LEU  96          1HB       LEU  96   3.880  17.778  -9.358
  712    HG   LEU  96           HG       LEU  96   1.958  18.908 -10.627
  713   1HD1  LEU  96          1HD1      LEU  96   1.653  21.139 -10.448
  714   2HD1  LEU  96          2HD1      LEU  96   3.373  21.459 -10.675
  715   3HD1  LEU  96          3HD1      LEU  96   2.749  21.086  -9.067
  716   1HD2  LEU  96          1HD2      LEU  96   4.829  19.670 -11.257
  717   2HD2  LEU  96          2HD2      LEU  96   3.494  19.706 -12.409
  718   3HD2  LEU  96          3HD2      LEU  96   4.029  18.171 -11.728
  719    H    ILE  97           H        ILE  97   3.410  16.412  -7.216
  720    HA   ILE  97           HA       ILE  97   1.923  14.475  -8.672
  721    HB   ILE  97           HB       ILE  97   3.330  14.286  -5.994
  722   1HG1  ILE  97          2HG1      ILE  97   4.219  13.059  -8.592
  723   2HG1  ILE  97          1HG1      ILE  97   4.527  14.770  -8.287
  724   1HG2  ILE  97          1HG2      ILE  97   3.269  11.745  -6.978
  725   2HG2  ILE  97          2HG2      ILE  97   1.697  12.340  -7.514
  726   3HG2  ILE  97          3HG2      ILE  97   2.112  12.366  -5.799
  727   1HD1  ILE  97          1HD1      ILE  97   5.191  13.097  -5.984
  728   2HD1  ILE  97          2HD1      ILE  97   6.174  14.308  -6.809
  729   3HD1  ILE  97          3HD1      ILE  97   6.113  12.655  -7.422
  730    H    ASP  98           H        ASP  98   1.148  16.304  -5.806
  731    HA   ASP  98           HA       ASP  98  -1.006  14.562  -4.921
  732   1HB   ASP  98          2HB       ASP  98   0.293  16.402  -3.584
  733   2HB   ASP  98          1HB       ASP  98  -0.881  17.506  -4.303
  734    H    GLU  99           H        GLU  99  -0.808  17.537  -6.869
  735    HA   GLU  99           HA       GLU  99  -3.631  17.853  -7.233
  736   1HB   GLU  99          2HB       GLU  99  -1.238  18.738  -8.855
  737   2HB   GLU  99          1HB       GLU  99  -2.891  19.129  -9.333
  738   1HG   GLU  99          2HG       GLU  99  -3.068  20.734  -7.754
  739   2HG   GLU  99          1HG       GLU  99  -2.406  19.678  -6.506
  740    H    GLN 100           H        GLN 100  -1.167  16.046  -9.038
  741    HA   GLN 100           HA       GLN 100  -2.974  15.228 -11.147
  742   1HB   GLN 100          2HB       GLN 100  -0.410  13.894 -10.227
  743   2HB   GLN 100          1HB       GLN 100  -1.202  13.681 -11.788
  744   1HG   GLN 100          2HG       GLN 100  -0.887  16.105 -12.251
  745   2HG   GLN 100          1HG       GLN 100  -0.023  16.263 -10.721
  746   1HE2  GLN 100          1HE2      GLN 100   1.066  16.659 -13.483
  747   2HE2  GLN 100          2HE2      GLN 100   2.350  15.559 -13.632
  748    H    VAL 101           H        VAL 101  -1.702  13.579  -8.235
  749    HA   VAL 101           HA       VAL 101  -3.121  11.146  -8.567
  750    HB   VAL 101           HB       VAL 101  -2.119  12.626  -6.136
  751   1HG1  VAL 101          1HG1      VAL 101  -4.025  10.359  -6.285
  752   2HG1  VAL 101          2HG1      VAL 101  -3.752  11.516  -4.983
  753   3HG1  VAL 101          3HG1      VAL 101  -2.667  10.139  -5.182
  754   1HG2  VAL 101          1HG2      VAL 101  -0.409  11.558  -7.458
  755   2HG2  VAL 101          2HG2      VAL 101  -1.366  10.085  -7.607
  756   3HG2  VAL 101          3HG2      VAL 101  -0.678  10.533  -6.048
  757    H    GLU 102           H        GLU 102  -4.074  14.096  -6.778
  758    HA   GLU 102           HA       GLU 102  -6.630  13.200  -5.944
  759   1HB   GLU 102          2HB       GLU 102  -5.461  15.368  -5.287
  760   2HB   GLU 102          1HB       GLU 102  -6.002  16.027  -6.831
  761   1HG   GLU 102          2HG       GLU 102  -8.322  15.681  -6.243
  762   2HG   GLU 102          1HG       GLU 102  -7.869  14.804  -4.780
  763    H    LYS 103           H        LYS 103  -5.632  14.803  -8.966
  764    HA   LYS 103           HA       LYS 103  -8.195  15.017 -10.160
  765   1HB   LYS 103          2HB       LYS 103  -5.421  14.662 -11.300
  766   2HB   LYS 103          1HB       LYS 103  -6.833  14.761 -12.351
  767   1HG   LYS 103          2HG       LYS 103  -7.018  16.855 -10.406
  768   2HG   LYS 103          1HG       LYS 103  -5.408  16.907 -11.122
  769   1HD   LYS 103          2HD       LYS 103  -6.308  17.059 -13.343
  770   2HD   LYS 103          1HD       LYS 103  -7.939  16.709 -12.769
  771   1HE   LYS 103          2HE       LYS 103  -8.001  19.035 -12.981
  772   2HE   LYS 103          1HE       LYS 103  -7.577  18.839 -11.279
  773   1HZ   LYS 103          1HZ       LYS 103  -5.414  19.438 -11.650
  774   2HZ   LYS 103          2HZ       LYS 103  -6.198  20.410 -12.802
  775   3HZ   LYS 103          3HZ       LYS 103  -5.434  18.971 -13.281
  776    H    LEU 104           H        LEU 104  -5.854  12.332 -10.189
  777    HA   LEU 104           HA       LEU 104  -7.442  10.603 -11.851
  778   1HB   LEU 104          2HB       LEU 104  -5.230  10.089  -9.850
  779   2HB   LEU 104          1HB       LEU 104  -6.003   8.786 -10.756
  780    HG   LEU 104           HG       LEU 104  -4.862  11.209 -12.149
  781   1HD1  LEU 104          1HD1      LEU 104  -2.918  10.425 -11.104
  782   2HD1  LEU 104          2HD1      LEU 104  -2.918   9.512 -12.612
  783   3HD1  LEU 104          3HD1      LEU 104  -3.469   8.750 -11.121
  784   1HD2  LEU 104          1HD2      LEU 104  -5.461  10.100 -14.028
  785   2HD2  LEU 104          2HD2      LEU 104  -6.389   9.024 -12.983
  786   3HD2  LEU 104          3HD2      LEU 104  -4.742   8.597 -13.450
  787    H    VAL 105           H        VAL 105  -7.478  11.398  -8.450
  788    HA   VAL 105           HA       VAL 105  -9.049   9.117  -7.599
  789    HB   VAL 105           HB       VAL 105  -8.305  11.774  -6.410
  790   1HG1  VAL 105          1HG1      VAL 105 -10.506   9.919  -5.490
  791   2HG1  VAL 105          2HG1      VAL 105 -10.575  11.667  -5.713
  792   3HG1  VAL 105          3HG1      VAL 105  -9.659  10.985  -4.369
  793   1HG2  VAL 105          1HG2      VAL 105  -7.051   9.412  -6.373
  794   2HG2  VAL 105          2HG2      VAL 105  -8.148   9.129  -5.022
  795   3HG2  VAL 105          3HG2      VAL 105  -7.024  10.487  -4.976
  796    H    ASN 106           H        ASN 106 -10.026  12.565  -7.707
  797    HA   ASN 106           HA       ASN 106 -12.772  12.248  -7.562
  798   1HB   ASN 106          2HB       ASN 106 -11.215  14.166  -9.322
  799   2HB   ASN 106          1HB       ASN 106 -12.946  14.301  -9.010
  800   1HD2  ASN 106          1HD2      ASN 106  -9.792  14.968  -7.717
  801   2HD2  ASN 106          2HD2      ASN 106 -10.306  15.576  -6.219
  802    H    LEU 107           H        LEU 107 -10.697  11.703 -10.369
  803    HA   LEU 107           HA       LEU 107 -12.850  11.293 -12.248
  804   1HB   LEU 107          2HB       LEU 107 -10.447  11.798 -12.845
  805   2HB   LEU 107          1HB       LEU 107 -10.051  10.144 -12.379
  806    HG   LEU 107           HG       LEU 107 -12.069   9.570 -14.013
  807   1HD1  LEU 107          1HD1      LEU 107 -12.385  11.108 -15.780
  808   2HD1  LEU 107          2HD1      LEU 107 -10.940  12.026 -15.356
  809   3HD1  LEU 107          3HD1      LEU 107 -12.378  12.124 -14.340
  810   1HD2  LEU 107          1HD2      LEU 107  -9.761   8.778 -14.288
  811   2HD2  LEU 107          2HD2      LEU 107  -9.279  10.352 -14.922
  812   3HD2  LEU 107          3HD2      LEU 107 -10.391   9.335 -15.838
  813    H    ALA 108           H        ALA 108 -10.679   8.961 -10.598
  814    HA   ALA 108           HA       ALA 108 -11.792   6.573 -11.438
  815   1HB   ALA 108          1HB       ALA 108 -11.338   5.798  -8.980
  816   2HB   ALA 108          2HB       ALA 108 -10.686   7.424  -8.772
  817   3HB   ALA 108          3HB       ALA 108  -9.980   6.336  -9.968
  818    H    GLU 109           H        GLU 109 -12.937   8.451  -8.606
  819    HA   GLU 109           HA       GLU 109 -15.256   6.793  -8.195
  820   1HB   GLU 109          2HB       GLU 109 -14.654   9.642  -7.342
  821   2HB   GLU 109          1HB       GLU 109 -16.047   8.714  -6.784
  822   1HG   GLU 109          2HG       GLU 109 -13.606   7.169  -6.506
  823   2HG   GLU 109          1HG       GLU 109 -13.472   8.711  -5.660
  824    H    LYS 110           H        LYS 110 -14.548   9.419 -10.357
  825    HA   LYS 110           HA       LYS 110 -17.215  10.324 -10.864
  826   1HB   LYS 110          2HB       LYS 110 -14.960  11.352 -11.630
  827   2HB   LYS 110          1HB       LYS 110 -15.061  10.215 -12.975
  828   1HG   LYS 110          2HG       LYS 110 -17.443  11.134 -13.337
  829   2HG   LYS 110          1HG       LYS 110 -16.958  12.457 -12.276
  830   1HD   LYS 110          2HD       LYS 110 -16.366  13.329 -14.349
  831   2HD   LYS 110          1HD       LYS 110 -14.855  12.554 -13.875
  832   1HE   LYS 110          2HE       LYS 110 -14.999  11.474 -15.862
  833   2HE   LYS 110          1HE       LYS 110 -16.222  10.481 -15.070
  834   1HZ   LYS 110          1HZ       LYS 110 -17.701  12.551 -15.777
  835   2HZ   LYS 110          2HZ       LYS 110 -17.455  11.213 -16.793
  836   3HZ   LYS 110          3HZ       LYS 110 -16.540  12.629 -17.010
  837    H    PHE 111           H        PHE 111 -15.348   7.598 -12.109
  838    HA   PHE 111           HA       PHE 111 -17.632   6.872 -13.880
  839   1HB   PHE 111          2HB       PHE 111 -14.715   6.309 -13.876
  840   2HB   PHE 111          1HB       PHE 111 -15.757   4.998 -14.427
  841    HD1  PHE 111           HD1      PHE 111 -17.503   5.515 -16.233
  842    HD2  PHE 111           HD2      PHE 111 -14.252   8.155 -15.279
  843    HE1  PHE 111           HE1      PHE 111 -17.789   6.657 -18.417
  844    HE2  PHE 111           HE2      PHE 111 -14.538   9.298 -17.462
  845    HZ   PHE 111           HZ       PHE 111 -16.306   8.548 -19.030
  846    H    ASP 112           H        ASP 112 -15.303   4.804 -12.152
  847    HA   ASP 112           HA       ASP 112 -16.912   3.821 -10.096
  848   1HB   ASP 112          2HB       ASP 112 -17.793   2.912 -12.740
  849   2HB   ASP 112          1HB       ASP 112 -17.438   1.578 -11.641
  850    H    ILE 113           H        ILE 113 -14.125   4.154 -10.958
  851    HA   ILE 113           HA       ILE 113 -13.175   1.337 -10.616
  852    HB   ILE 113           HB       ILE 113 -11.060   2.114 -11.690
  853   1HG1  ILE 113          2HG1      ILE 113 -12.672   4.660 -12.046
  854   2HG1  ILE 113          1HG1      ILE 113 -11.180   4.481 -11.124
  855   1HG2  ILE 113          1HG2      ILE 113 -13.421   1.405 -12.882
  856   2HG2  ILE 113          2HG2      ILE 113 -11.905   1.636 -13.751
  857   3HG2  ILE 113          3HG2      ILE 113 -13.085   2.945 -13.674
  858   1HD1  ILE 113          1HD1      ILE 113 -11.480   5.041 -13.917
  859   2HD1  ILE 113          2HD1      ILE 113 -10.694   3.472 -13.745
  860   3HD1  ILE 113          3HD1      ILE 113  -9.989   4.898 -12.985
  861    H    ILE 114           H        ILE 114 -10.756   1.521  -9.638
  862    HA   ILE 114           HA       ILE 114 -10.923   3.418  -7.330
  863    HB   ILE 114           HB       ILE 114 -11.338   1.351  -6.312
  864   1HG1  ILE 114          2HG1      ILE 114  -8.307   1.407  -6.364
  865   2HG1  ILE 114          1HG1      ILE 114  -9.275   2.545  -5.424
  866   1HG2  ILE 114          1HG2      ILE 114 -11.054  -0.039  -8.304
  867   2HG2  ILE 114          2HG2      ILE 114 -10.133  -0.732  -6.969
  868   3HG2  ILE 114          3HG2      ILE 114  -9.304   0.175  -8.233
  869   1HD1  ILE 114          1HD1      ILE 114  -8.916  -0.406  -5.040
  870   2HD1  ILE 114          2HD1      ILE 114 -10.435   0.337  -4.540
  871   3HD1  ILE 114          3HD1      ILE 114  -8.911   0.885  -3.839
  872    H    TYR 115           H        TYR 115  -8.903   4.231  -6.566
  873    HA   TYR 115           HA       TYR 115  -6.589   3.735  -8.398
  874   1HB   TYR 115          2HB       TYR 115  -7.166   5.914  -8.993
  875   2HB   TYR 115          1HB       TYR 115  -7.760   6.305  -7.379
  876    HD1  TYR 115           HD1      TYR 115  -6.349   7.321  -5.776
  877    HD2  TYR 115           HD2      TYR 115  -4.650   5.570  -9.311
  878    HE1  TYR 115           HE1      TYR 115  -4.141   8.287  -5.192
  879    HE2  TYR 115           HE2      TYR 115  -2.441   6.536  -8.727
  880    HH   TYR 115           HH       TYR 115  -1.258   7.598  -7.155
  881    H    ASP 116           H        ASP 116  -5.619   2.263  -6.925
  882    HA   ASP 116           HA       ASP 116  -4.464   3.572  -4.515
  883   1HB   ASP 116          2HB       ASP 116  -6.572   2.066  -4.074
  884   2HB   ASP 116          1HB       ASP 116  -5.442   0.736  -4.327
  885    H    GLY 117           H        GLY 117  -2.778   3.459  -6.447
  886   1HA   GLY 117          2HA       GLY 117  -0.743   1.627  -5.713
  887   2HA   GLY 117          1HA       GLY 117  -1.574   0.955  -7.116
  888    H    TRP 118           H        TRP 118   0.315   3.717  -5.970
  889    HA   TRP 118           HA       TRP 118   0.889   4.372  -8.834
  890   1HB   TRP 118          2HB       TRP 118   0.790   6.634  -8.385
  891   2HB   TRP 118          1HB       TRP 118  -0.360   6.069  -7.173
  892    HD1  TRP 118           HD1      TRP 118   0.436   6.009  -4.638
  893    HE1  TRP 118           HE1      TRP 118   2.373   7.191  -3.413
  894    HE3  TRP 118           HE3      TRP 118   3.232   7.498  -8.642
  895    HZ2  TRP 118           HZ2      TRP 118   4.792   8.583  -4.051
  896    HZ3  TRP 118           HZ3      TRP 118   5.344   8.747  -8.307
  897    HH2  TRP 118           HH2      TRP 118   6.127   9.292  -6.018
  898    H    GLY 119           H        GLY 119   3.105   4.798  -9.337
  899   1HA   GLY 119          2HA       GLY 119   5.122   4.778  -7.225
  900   2HA   GLY 119          1HA       GLY 119   5.087   3.285  -8.162
  901    H    THR 120           H        THR 120   7.234   5.277  -8.056
  902    HA   THR 120           HA       THR 120   7.342   5.894 -10.973
  903    HB   THR 120           HB       THR 120   6.840   7.997  -9.809
  904    HG1  THR 120           HG1      THR 120   9.600   7.989 -10.397
  905   1HG2  THR 120          1HG2      THR 120   8.906   8.738  -8.279
  906   2HG2  THR 120          2HG2      THR 120   9.002   6.997  -8.016
  907   3HG2  THR 120          3HG2      THR 120   7.524   7.869  -7.615
  908    H    TYR 121           H        TYR 121   9.585   6.037 -11.779
  909    HA   TYR 121           HA       TYR 121  11.567   4.737  -9.960
  910   1HB   TYR 121          2HB       TYR 121  11.084   4.074 -12.881
  911   2HB   TYR 121          1HB       TYR 121  12.364   3.392 -11.877
  912    HD1  TYR 121           HD1      TYR 121   9.264   2.663 -13.190
  913    HD2  TYR 121           HD2      TYR 121  11.337   2.603  -9.428
  914    HE1  TYR 121           HE1      TYR 121   7.689   0.943 -12.348
  915    HE2  TYR 121           HE2      TYR 121   9.761   0.883  -8.586
  916    HH   TYR 121           HH       TYR 121   8.252  -0.947  -9.742
  917    H    TYR 122           H        TYR 122  13.829   5.164 -10.607
  918    HA   TYR 122           HA       TYR 122  14.078   7.884 -11.751
  919   1HB   TYR 122          2HB       TYR 122  15.261   7.547  -9.677
  920   2HB   TYR 122          1HB       TYR 122  16.024   6.080 -10.289
  921    HD1  TYR 122           HD1      TYR 122  18.193   6.245 -11.117
  922    HD2  TYR 122           HD2      TYR 122  15.635   9.695 -11.233
  923    HE1  TYR 122           HE1      TYR 122  20.056   7.596 -12.042
  924    HE2  TYR 122           HE2      TYR 122  17.500  11.045 -12.156
  925    HH   TYR 122           HH       TYR 122  20.688  10.065 -12.085
  926    H    GLU 123           H        GLU 123  16.376   8.041 -13.009
  927    HA   GLU 123           HA       GLU 123  16.001   6.346 -15.382
  928   1HB   GLU 123          2HB       GLU 123  18.149   8.430 -14.917
  929   2HB   GLU 123          1HB       GLU 123  17.561   7.819 -16.463
  930   1HG   GLU 123          2HG       GLU 123  15.560   9.007 -16.327
  931   2HG   GLU 123          1HG       GLU 123  15.627   9.117 -14.569
  932    H    GLY 124           H        GLY 124  18.164   5.525 -16.416
  933   1HA   GLY 124          2HA       GLY 124  19.707   3.741 -16.203
  934   2HA   GLY 124          1HA       GLY 124  20.507   4.902 -15.143
  935    H    LEU 125           H        LEU 125  17.673   2.709 -14.950
  936    HA   LEU 125           HA       LEU 125  18.772   1.757 -12.341
  937   1HB   LEU 125          2HB       LEU 125  16.873   3.356 -11.995
  938   2HB   LEU 125          1HB       LEU 125  15.840   2.265 -12.921
  939    HG   LEU 125           HG       LEU 125  17.372   0.974 -10.751
  940   1HD1  LEU 125          1HD1      LEU 125  16.845   3.048  -9.601
  941   2HD1  LEU 125          2HD1      LEU 125  15.749   1.794  -9.020
  942   3HD1  LEU 125          3HD1      LEU 125  15.181   2.992 -10.183
  943   1HD2  LEU 125          1HD2      LEU 125  14.410   0.966 -11.390
  944   2HD2  LEU 125          2HD2      LEU 125  15.316  -0.251 -10.490
  945   3HD2  LEU 125          3HD2      LEU 125  15.578  -0.059 -12.224
  946    H    GLU 126           H        GLU 126  19.173  -0.383 -12.543
  947    HA   GLU 126           HA       GLU 126  17.770  -1.943 -14.621
  948   1HB   GLU 126          2HB       GLU 126  20.235  -2.250 -12.996
  949   2HB   GLU 126          1HB       GLU 126  19.393  -3.744 -13.410
  950   1HG   GLU 126          2HG       GLU 126  19.812  -1.708 -15.563
  951   2HG   GLU 126          1HG       GLU 126  21.186  -2.696 -15.066
  952    H    HIS 127           H        HIS 127  18.259  -2.084 -11.079
  953    HA   HIS 127           HA       HIS 127  15.570  -3.075 -10.662
  954   1HB   HIS 127          2HB       HIS 127  17.074  -5.082 -11.517
  955   2HB   HIS 127          1HB       HIS 127  17.648  -5.078  -9.849
  956    HD2  HIS 127           HD2      HIS 127  14.219  -4.069  -9.193
  957    HE1  HIS 127           HE1      HIS 127  13.819  -8.236  -9.756
  958    HE2  HIS 127           HE2      HIS 127  12.679  -6.150  -8.871
  959    H    HIS 128           H        HIS 128  15.015  -2.330  -8.671
  960    HA   HIS 128           HA       HIS 128  17.057  -1.255  -6.891
  961   1HB   HIS 128          2HB       HIS 128  14.621  -0.407  -7.265
  962   2HB   HIS 128          1HB       HIS 128  14.173  -1.674  -6.122
  963    HD2  HIS 128           HD2      HIS 128  16.944  -1.181  -4.179
  964    HE1  HIS 128           HE1      HIS 128  15.179   2.609  -3.587
  965    HE2  HIS 128           HE2      HIS 128  16.893   0.964  -2.697
  966    H    HIS 129           H        HIS 129  14.420  -3.554  -6.127
  967    HA   HIS 129           HA       HIS 129  15.733  -4.638  -3.843
  968   1HB   HIS 129          2HB       HIS 129  13.759  -6.119  -5.598
  969   2HB   HIS 129          1HB       HIS 129  14.043  -6.344  -3.872
  970    HD2  HIS 129           HD2      HIS 129  11.218  -4.978  -5.588
  971    HE1  HIS 129           HE1      HIS 129  11.984  -1.927  -2.771
  972    HE2  HIS 129           HE2      HIS 129  10.270  -2.864  -4.388
  973    H    HIS 130           H        HIS 130  17.059  -6.463  -3.602
  974    HA   HIS 130           HA       HIS 130  18.328  -7.414  -6.121
  975   1HB   HIS 130          2HB       HIS 130  19.194  -7.457  -3.223
  976   2HB   HIS 130          1HB       HIS 130  20.045  -8.363  -4.474
  977    HD2  HIS 130           HD2      HIS 130  21.191  -6.653  -6.565
  978    HE1  HIS 130           HE1      HIS 130  21.021  -3.161  -4.194
  979    HE2  HIS 130           HE2      HIS 130  21.971  -4.176  -6.316
  980    H    HIS 131           H        HIS 131  17.115  -9.132  -6.863
  981    HA   HIS 131           HA       HIS 131  16.445 -11.276  -4.889
  982   1HB   HIS 131          2HB       HIS 131  14.569 -10.135  -6.220
  983   2HB   HIS 131          1HB       HIS 131  15.228 -10.954  -7.637
  984    HD2  HIS 131           HD2      HIS 131  14.178 -12.254  -3.999
  985    HE1  HIS 131           HE1      HIS 131  12.978 -15.070  -6.907
  986    HE2  HIS 131           HE2      HIS 131  12.995 -14.538  -4.427
  987    H    HIS 132           HN       HIS 132  16.235 -13.486  -6.293
  988    HA   HIS 132           HA       HIS 132  18.669 -13.680  -8.014
  989   1HB   HIS 132          2HB       HIS 132  18.952 -16.005  -6.908
  990   2HB   HIS 132          1HB       HIS 132  19.438 -14.591  -5.970
  991    HD2  HIS 132           HD2      HIS 132  15.604 -15.264  -6.154
  992    HE1  HIS 132           HE1      HIS 132  16.918 -16.480  -2.329
  993    HE2  HIS 132           HE2      HIS 132  14.879 -16.053  -3.776
  Start of MODEL    8
    1   1H    MET   1          1H        MET   1 -33.228   1.662   1.680
    2   2H    MET   1          2H        MET   1 -34.372   0.443   1.988
    3   3H    MET   1          3H        MET   1 -32.758   0.033   1.647
    4    HA   MET   1           HA       MET   1 -32.822   1.810   3.836
    5   1HB   MET   1          2HB       MET   1 -35.036   1.057   4.348
    6   2HB   MET   1          1HB       MET   1 -34.629  -0.614   3.958
    7   1HG   MET   1          2HG       MET   1 -33.128  -0.750   5.865
    8   2HG   MET   1          1HG       MET   1 -33.360   0.963   6.213
    9   1HE   MET   1          1HE       MET   1 -34.753  -0.847   9.109
   10   2HE   MET   1          2HE       MET   1 -34.935   0.889   8.863
   11   3HE   MET   1          3HE       MET   1 -33.462   0.081   8.333
   12    H    SER   2           H        SER   2 -30.909   1.358   4.819
   13    HA   SER   2           HA       SER   2 -29.923  -1.443   4.836
   14   1HB   SER   2          2HB       SER   2 -29.011   0.052   2.856
   15   2HB   SER   2          1HB       SER   2 -27.993   0.742   4.117
   16    HG   SER   2           HG       SER   2 -27.168  -1.169   2.949
   17    H    HIS   3           H        HIS   3 -27.272   0.104   5.619
   18    HA   HIS   3           HA       HIS   3 -28.021   1.217   8.228
   19   1HB   HIS   3          2HB       HIS   3 -26.355  -1.315   8.123
   20   2HB   HIS   3          1HB       HIS   3 -26.853  -0.437   9.569
   21    HD2  HIS   3           HD2      HIS   3 -28.184  -3.239   7.314
   22    HE1  HIS   3           HE1      HIS   3 -31.477  -1.906   9.598
   23    HE2  HIS   3           HE2      HIS   3 -30.646  -3.718   8.030
   24    H    GLN   4           H        GLN   4 -24.966  -0.424   7.714
   25    HA   GLN   4           HA       GLN   4 -23.698   2.241   7.214
   26   1HB   GLN   4          2HB       GLN   4 -22.377   0.017   8.773
   27   2HB   GLN   4          1HB       GLN   4 -21.936   1.724   8.715
   28   1HG   GLN   4          2HG       GLN   4 -24.281   2.163   9.715
   29   2HG   GLN   4          1HG       GLN   4 -24.286   0.442  10.106
   30   1HE2  GLN   4          1HE2      GLN   4 -23.743   0.253  12.287
   31   2HE2  GLN   4          2HE2      GLN   4 -22.474   1.085  13.048
   32    H    ASP   5           H        ASP   5 -23.718   1.679   4.922
   33    HA   ASP   5           HA       ASP   5 -22.373  -0.719   3.985
   34   1HB   ASP   5          2HB       ASP   5 -23.967   0.178   2.481
   35   2HB   ASP   5          1HB       ASP   5 -23.329   1.814   2.651
   36    H    ASP   6           H        ASP   6 -20.476  -0.279   2.296
   37    HA   ASP   6           HA       ASP   6 -18.333   0.987   3.863
   38   1HB   ASP   6          2HB       ASP   6 -18.188  -0.360   1.148
   39   2HB   ASP   6          1HB       ASP   6 -16.830   0.017   2.209
   40    H    TYR   7           H        TYR   7 -18.014   3.148   3.646
   41    HA   TYR   7           HA       TYR   7 -18.334   4.327   0.914
   42   1HB   TYR   7          2HB       TYR   7 -20.143   5.208   2.196
   43   2HB   TYR   7          1HB       TYR   7 -19.118   5.454   3.610
   44    HD1  TYR   7           HD1      TYR   7 -17.751   7.409   3.840
   45    HD2  TYR   7           HD2      TYR   7 -19.825   6.630   0.160
   46    HE1  TYR   7           HE1      TYR   7 -17.207   9.697   3.050
   47    HE2  TYR   7           HE2      TYR   7 -19.282   8.919  -0.631
   48    HH   TYR   7           HH       TYR   7 -18.188  10.802  -0.194
   49    H    LEU   8           H        LEU   8 -16.077   4.137   0.494
   50    HA   LEU   8           HA       LEU   8 -13.980   4.861   2.245
   51   1HB   LEU   8          2HB       LEU   8 -14.252   4.845  -0.754
   52   2HB   LEU   8          1HB       LEU   8 -12.778   5.450   0.002
   53    HG   LEU   8           HG       LEU   8 -13.907   2.797   0.850
   54   1HD1  LEU   8          1HD1      LEU   8 -13.752   2.735  -1.625
   55   2HD1  LEU   8          2HD1      LEU   8 -12.541   1.696  -0.874
   56   3HD1  LEU   8          3HD1      LEU   8 -12.074   3.268  -1.523
   57   1HD2  LEU   8          1HD2      LEU   8 -11.797   2.463   1.744
   58   2HD2  LEU   8          2HD2      LEU   8 -11.884   4.221   1.848
   59   3HD2  LEU   8          3HD2      LEU   8 -11.007   3.459   0.522
   60    H    SER   9           H        SER   9 -12.488   6.890   1.317
   61    HA   SER   9           HA       SER   9 -14.100   9.290   0.846
   62   1HB   SER   9          2HB       SER   9 -13.205   8.526   3.544
   63   2HB   SER   9          1HB       SER   9 -12.725  10.153   3.070
   64    HG   SER   9           HG       SER   9 -14.715  10.552   3.698
   65    H    VAL  10           H        VAL  10 -12.813   9.986  -0.826
   66    HA   VAL  10           HA       VAL  10 -10.075   9.580  -1.200
   67    HB   VAL  10           HB       VAL  10 -10.113  11.434  -2.734
   68   1HG1  VAL  10          1HG1      VAL  10 -11.586   9.418  -3.213
   69   2HG1  VAL  10          2HG1      VAL  10 -12.040  10.896  -4.062
   70   3HG1  VAL  10          3HG1      VAL  10 -12.950  10.379  -2.642
   71   1HG2  VAL  10          1HG2      VAL  10 -11.012  13.140  -1.227
   72   2HG2  VAL  10          2HG2      VAL  10 -12.578  12.329  -1.203
   73   3HG2  VAL  10          3HG2      VAL  10 -11.995  13.077  -2.690
   74    H    GLU  11           H        GLU  11 -11.626  11.590   1.135
   75    HA   GLU  11           HA       GLU  11  -9.554  13.515   1.570
   76   1HB   GLU  11          2HB       GLU  11 -11.463  12.343   3.616
   77   2HB   GLU  11          1HB       GLU  11 -10.601  13.877   3.745
   78   1HG   GLU  11          2HG       GLU  11 -12.209  13.527   1.281
   79   2HG   GLU  11          1HG       GLU  11 -13.133  13.661   2.777
   80    H    GLU  12           H        GLU  12 -10.165  10.325   3.052
   81    HA   GLU  12           HA       GLU  12  -7.765  10.449   4.691
   82   1HB   GLU  12          2HB       GLU  12  -8.995   7.825   3.979
   83   2HB   GLU  12          1HB       GLU  12  -8.456   8.424   5.548
   84   1HG   GLU  12          2HG       GLU  12 -10.448  10.152   5.175
   85   2HG   GLU  12          1HG       GLU  12 -11.063   8.852   4.152
   86    H    LEU  13           H        LEU  13  -8.648   8.380   1.894
   87    HA   LEU  13           HA       LEU  13  -6.194   7.182   1.408
   88   1HB   LEU  13          2HB       LEU  13  -7.825   8.359  -0.847
   89   2HB   LEU  13          1HB       LEU  13  -6.883   6.868  -0.845
   90    HG   LEU  13           HG       LEU  13  -9.433   7.402   0.704
   91   1HD1  LEU  13          1HD1      LEU  13  -9.221   6.698  -1.889
   92   2HD1  LEU  13          2HD1      LEU  13 -10.505   6.086  -0.846
   93   3HD1  LEU  13          3HD1      LEU  13  -9.074   5.102  -1.153
   94   1HD2  LEU  13          1HD2      LEU  13  -7.493   5.075   0.745
   95   2HD2  LEU  13          2HD2      LEU  13  -9.149   4.952   1.337
   96   3HD2  LEU  13          3HD2      LEU  13  -8.016   6.062   2.109
   97    H    ILE  14           H        ILE  14  -7.185  10.472   0.495
   98    HA   ILE  14           HA       ILE  14  -4.805  11.125  -0.961
   99    HB   ILE  14           HB       ILE  14  -6.877  12.786   0.479
  100   1HG1  ILE  14          2HG1      ILE  14  -6.129  12.659  -2.454
  101   2HG1  ILE  14          1HG1      ILE  14  -7.337  11.595  -1.732
  102   1HG2  ILE  14          1HG2      ILE  14  -5.544  14.579  -1.082
  103   2HG2  ILE  14          2HG2      ILE  14  -4.207  13.566  -0.538
  104   3HG2  ILE  14          3HG2      ILE  14  -5.241  14.370   0.643
  105   1HD1  ILE  14          1HD1      ILE  14  -7.572  14.397  -2.501
  106   2HD1  ILE  14          2HD1      ILE  14  -8.036  14.141  -0.819
  107   3HD1  ILE  14          3HD1      ILE  14  -8.841  13.238  -2.103
  108    H    GLU  15           H        GLU  15  -5.701  12.392   2.267
  109    HA   GLU  15           HA       GLU  15  -3.336  13.424   3.135
  110   1HB   GLU  15          2HB       GLU  15  -5.270  11.651   4.632
  111   2HB   GLU  15          1HB       GLU  15  -3.877  12.379   5.433
  112   1HG   GLU  15          2HG       GLU  15  -5.382  14.284   3.786
  113   2HG   GLU  15          1HG       GLU  15  -6.337  13.596   5.100
  114    H    ILE  16           H        ILE  16  -4.064   9.939   2.999
  115    HA   ILE  16           HA       ILE  16  -1.537   9.103   4.095
  116    HB   ILE  16           HB       ILE  16  -3.468   7.648   2.262
  117   1HG1  ILE  16          2HG1      ILE  16  -3.106   7.121   5.195
  118   2HG1  ILE  16          1HG1      ILE  16  -4.085   8.499   4.693
  119   1HG2  ILE  16          1HG2      ILE  16  -2.319   5.607   3.167
  120   2HG2  ILE  16          2HG2      ILE  16  -1.117   6.665   3.909
  121   3HG2  ILE  16          3HG2      ILE  16  -1.274   6.604   2.154
  122   1HD1  ILE  16          1HD1      ILE  16  -5.293   6.235   5.026
  123   2HD1  ILE  16          2HD1      ILE  16  -4.526   5.759   3.512
  124   3HD1  ILE  16          3HD1      ILE  16  -5.634   7.132   3.546
  125    H    GLN  17           H        GLN  17  -2.684   8.915   0.697
  126    HA   GLN  17           HA       GLN  17  -0.272   8.281  -0.534
  127   1HB   GLN  17          2HB       GLN  17  -2.431  10.187  -1.485
  128   2HB   GLN  17          1HB       GLN  17  -1.122   9.600  -2.510
  129   1HG   GLN  17          2HG       GLN  17  -3.162   7.869  -1.083
  130   2HG   GLN  17          1HG       GLN  17  -3.135   8.218  -2.812
  131   1HE2  GLN  17          1HE2      GLN  17  -0.621   7.819  -3.663
  132   2HE2  GLN  17          2HE2      GLN  17  -0.030   6.282  -3.250
  133    H    LYS  18           H        LYS  18  -1.336  11.442   0.657
  134    HA   LYS  18           HA       LYS  18   0.787  13.004  -0.435
  135   1HB   LYS  18          2HB       LYS  18  -1.140  13.283   1.821
  136   2HB   LYS  18          1HB       LYS  18   0.295  14.305   1.874
  137   1HG   LYS  18          2HG       LYS  18  -0.225  14.978  -0.517
  138   2HG   LYS  18          1HG       LYS  18  -1.773  14.150  -0.333
  139   1HD   LYS  18          2HD       LYS  18  -2.211  15.583   1.694
  140   2HD   LYS  18          1HD       LYS  18  -0.757  16.496   1.294
  141   1HE   LYS  18          2HE       LYS  18  -2.986  17.433   0.418
  142   2HE   LYS  18          1HE       LYS  18  -1.676  17.276  -0.752
  143   1HZ   LYS  18          1HZ       LYS  18  -3.877  16.404  -1.499
  144   2HZ   LYS  18          2HZ       LYS  18  -3.736  15.187  -0.322
  145   3HZ   LYS  18          3HZ       LYS  18  -2.606  15.284  -1.587
  146    H    GLU  19           H        GLU  19   0.487  11.839   2.940
  147    HA   GLU  19           HA       GLU  19   3.102  12.367   3.774
  148   1HB   GLU  19          2HB       GLU  19   0.993  11.231   4.976
  149   2HB   GLU  19          1HB       GLU  19   1.910   9.766   4.623
  150   1HG   GLU  19          2HG       GLU  19   3.929  11.135   5.609
  151   2HG   GLU  19          1HG       GLU  19   2.656  12.091   6.371
  152    H    GLU  20           H        GLU  20   1.967   9.181   2.573
  153    HA   GLU  20           HA       GLU  20   4.413   7.884   2.365
  154   1HB   GLU  20          2HB       GLU  20   2.577   6.566   1.748
  155   2HB   GLU  20          1HB       GLU  20   1.938   7.796   0.657
  156   1HG   GLU  20          2HG       GLU  20   3.690   7.383  -0.951
  157   2HG   GLU  20          1HG       GLU  20   4.541   6.324   0.173
  158    H    THR  21           H        THR  21   2.921   9.585  -0.414
  159    HA   THR  21           HA       THR  21   4.995   9.625  -2.199
  160    HB   THR  21           HB       THR  21   3.396  12.098  -1.472
  161    HG1  THR  21           HG1      THR  21   2.695  10.335  -3.518
  162   1HG2  THR  21          1HG2      THR  21   3.783  12.763  -3.763
  163   2HG2  THR  21          2HG2      THR  21   4.567  11.225  -4.124
  164   3HG2  THR  21          3HG2      THR  21   5.345  12.377  -3.040
  165    H    ARG  22           H        ARG  22   4.611  12.320   0.137
  166    HA   ARG  22           HA       ARG  22   7.065  13.552  -0.179
  167   1HB   ARG  22          2HB       ARG  22   5.181  13.234   2.071
  168   2HB   ARG  22          1HB       ARG  22   6.833  13.621   2.554
  169   1HG   ARG  22          2HG       ARG  22   6.850  15.637   1.322
  170   2HG   ARG  22          1HG       ARG  22   5.458  15.156   0.353
  171   1HD   ARG  22          2HD       ARG  22   5.489  15.963   3.267
  172   2HD   ARG  22          1HD       ARG  22   4.636  16.748   1.939
  173    HE   ARG  22           HE       ARG  22   3.587  14.186   1.973
  174   1HH1  ARG  22          1HH2      ARG  22   4.057  16.730   4.252
  175   2HH1  ARG  22          2HH2      ARG  22   2.668  16.315   5.201
  176   1HH2  ARG  22          2HH1      ARG  22   1.773  13.629   3.197
  177   2HH2  ARG  22          1HH1      ARG  22   1.374  14.559   4.603
  178    H    ASP  23           H        ASP  23   6.405  10.530   1.529
  179    HA   ASP  23           HA       ASP  23   8.944  10.196   2.770
  180   1HB   ASP  23          2HB       ASP  23   6.675   8.762   2.813
  181   2HB   ASP  23          1HB       ASP  23   7.575   7.798   1.642
  182    H    ILE  24           H        ILE  24   7.783   9.105  -0.432
  183    HA   ILE  24           HA       ILE  24  10.298   7.955  -1.219
  184    HB   ILE  24           HB       ILE  24   8.048   9.054  -2.936
  185   1HG1  ILE  24          2HG1      ILE  24   8.583   6.159  -2.278
  186   2HG1  ILE  24          1HG1      ILE  24   7.612   7.161  -1.200
  187   1HG2  ILE  24          1HG2      ILE  24  10.654   7.953  -3.571
  188   2HG2  ILE  24          2HG2      ILE  24   9.433   8.616  -4.659
  189   3HG2  ILE  24          3HG2      ILE  24   9.375   6.914  -4.199
  190   1HD1  ILE  24          1HD1      ILE  24   6.385   5.824  -3.061
  191   2HD1  ILE  24          2HD1      ILE  24   7.015   7.058  -4.152
  192   3HD1  ILE  24          3HD1      ILE  24   5.947   7.517  -2.825
  193    H    ILE  25           H        ILE  25   8.762  11.017  -2.298
  194    HA   ILE  25           HA       ILE  25  10.805  12.140  -3.757
  195    HB   ILE  25           HB       ILE  25   9.450  13.783  -1.618
  196   1HG1  ILE  25          2HG1      ILE  25   7.646  12.455  -2.442
  197   2HG1  ILE  25          1HG1      ILE  25   7.560  13.969  -3.342
  198   1HG2  ILE  25          1HG2      ILE  25   9.399  14.849  -4.288
  199   2HG2  ILE  25          2HG2      ILE  25  11.039  14.327  -3.910
  200   3HG2  ILE  25          3HG2      ILE  25  10.221  15.488  -2.866
  201   1HD1  ILE  25          1HD1      ILE  25   8.636  11.306  -4.279
  202   2HD1  ILE  25          2HD1      ILE  25   9.004  12.813  -5.120
  203   3HD1  ILE  25          3HD1      ILE  25   7.334  12.263  -4.985
  204    H    GLN  26           H        GLN  26  10.556  12.314  -0.190
  205    HA   GLN  26           HA       GLN  26  12.956  13.687   0.319
  206   1HB   GLN  26          2HB       GLN  26  11.457  11.572   1.859
  207   2HB   GLN  26          1HB       GLN  26  12.966  12.240   2.478
  208   1HG   GLN  26          2HG       GLN  26  10.832  14.121   1.530
  209   2HG   GLN  26          1HG       GLN  26  10.661  13.364   3.114
  210   1HE2  GLN  26          1HE2      GLN  26  13.224  13.318   4.122
  211   2HE2  GLN  26          2HE2      GLN  26  13.865  14.886   4.216
  212    H    ALA  27           H        ALA  27  12.480  10.147   0.081
  213    HA   ALA  27           HA       ALA  27  15.213   9.435   0.413
  214   1HB   ALA  27          1HB       ALA  27  14.573   7.293  -0.218
  215   2HB   ALA  27          2HB       ALA  27  13.462   7.878  -1.456
  216   3HB   ALA  27          3HB       ALA  27  13.012   7.970   0.247
  217    H    LEU  28           H        LEU  28  13.466   9.328  -2.714
  218    HA   LEU  28           HA       LEU  28  15.543   9.138  -4.473
  219   1HB   LEU  28          2HB       LEU  28  12.895  10.278  -4.576
  220   2HB   LEU  28          1HB       LEU  28  14.000  11.273  -5.525
  221    HG   LEU  28           HG       LEU  28  14.825   9.149  -6.622
  222   1HD1  LEU  28          1HD1      LEU  28  12.478   8.040  -5.062
  223   2HD1  LEU  28          2HD1      LEU  28  14.155   7.495  -5.018
  224   3HD1  LEU  28          3HD1      LEU  28  13.176   7.220  -6.459
  225   1HD2  LEU  28          1HD2      LEU  28  11.933   9.151  -7.212
  226   2HD2  LEU  28          2HD2      LEU  28  13.298   9.480  -8.279
  227   3HD2  LEU  28          3HD2      LEU  28  12.677  10.750  -7.224
  228    H    LEU  29           H        LEU  29  14.690  12.035  -2.625
  229    HA   LEU  29           HA       LEU  29  16.633  13.744  -3.922
  230   1HB   LEU  29          2HB       LEU  29  14.714  13.939  -1.725
  231   2HB   LEU  29          1HB       LEU  29  16.224  14.776  -1.363
  232    HG   LEU  29           HG       LEU  29  16.018  15.825  -3.699
  233   1HD1  LEU  29          1HD1      LEU  29  14.343  14.310  -4.619
  234   2HD1  LEU  29          2HD1      LEU  29  13.664  15.936  -4.541
  235   3HD1  LEU  29          3HD1      LEU  29  13.211  14.731  -3.335
  236   1HD2  LEU  29          1HD2      LEU  29  13.946  17.263  -2.725
  237   2HD2  LEU  29          2HD2      LEU  29  15.586  17.409  -2.093
  238   3HD2  LEU  29          3HD2      LEU  29  14.408  16.394  -1.262
  239    H    GLU  30           H        GLU  30  16.621  11.930  -0.843
  240    HA   GLU  30           HA       GLU  30  19.256  12.693  -0.037
  241   1HB   GLU  30          2HB       GLU  30  17.273  11.298   1.152
  242   2HB   GLU  30          1HB       GLU  30  18.305   9.959   0.649
  243   1HG   GLU  30          2HG       GLU  30  20.250  11.251   1.693
  244   2HG   GLU  30          1HG       GLU  30  19.031  12.293   2.428
  245    H    ASP  31           H        ASP  31  18.064  10.181  -2.201
  246    HA   ASP  31           HA       ASP  31  20.493   8.674  -2.402
  247   1HB   ASP  31          2HB       ASP  31  18.648   8.993  -4.748
  248   2HB   ASP  31          1HB       ASP  31  19.454   7.541  -4.153
  249    H    GLY  32           H        GLY  32  19.399  11.651  -3.914
  250   1HA   GLY  32          2HA       GLY  32  21.144  13.229  -4.686
  251   2HA   GLY  32          1HA       GLY  32  22.063  11.836  -5.257
  252    H    SER  33           H        SER  33  18.636  11.816  -5.749
  253    HA   SER  33           HA       SER  33  18.798  11.419  -8.540
  254   1HB   SER  33          2HB       SER  33  16.609  12.302  -6.687
  255   2HB   SER  33          1HB       SER  33  16.339  12.358  -8.426
  256    HG   SER  33           HG       SER  33  17.449  10.062  -7.244
  257    H    ASP  34           H        ASP  34  17.245  13.191  -9.888
  258    HA   ASP  34           HA       ASP  34  18.361  15.902  -9.422
  259   1HB   ASP  34          2HB       ASP  34  18.849  15.978 -11.958
  260   2HB   ASP  34          1HB       ASP  34  19.988  15.092 -10.943
  261    HA   PRO  35           HA       PRO  35  13.814  15.976 -10.270
  262   1HB   PRO  35          2HB       PRO  35  14.349  18.697  -9.166
  263   2HB   PRO  35          1HB       PRO  35  13.058  17.548  -8.761
  264   1HG   PRO  35          2HG       PRO  35  15.133  17.944  -7.137
  265   2HG   PRO  35          1HG       PRO  35  14.388  16.349  -7.329
  266   1HD   PRO  35          2HD       PRO  35  16.995  17.347  -8.384
  267   2HD   PRO  35          1HD       PRO  35  16.523  15.700  -7.911
  268    H    ASP  36           H        ASP  36  16.311  18.381 -11.059
  269    HA   ASP  36           HA       ASP  36  14.700  19.777 -13.018
  270   1HB   ASP  36          2HB       ASP  36  16.705  20.772 -11.906
  271   2HB   ASP  36          1HB       ASP  36  17.722  19.641 -12.799
  272    H    ALA  37           H        ALA  37  15.430  16.679 -13.106
  273    HA   ALA  37           HA       ALA  37  16.253  16.668 -15.980
  274   1HB   ALA  37          1HB       ALA  37  17.581  15.370 -14.159
  275   2HB   ALA  37          2HB       ALA  37  17.173  14.524 -15.653
  276   3HB   ALA  37          3HB       ALA  37  16.226  14.242 -14.191
  277    H    LEU  38           H        LEU  38  13.489  16.879 -14.463
  278    HA   LEU  38           HA       LEU  38  11.297  16.230 -15.002
  279   1HB   LEU  38          2HB       LEU  38  12.733  16.114 -17.398
  280   2HB   LEU  38          1HB       LEU  38  11.922  14.551 -17.302
  281    HG   LEU  38           HG       LEU  38   9.830  15.986 -16.621
  282   1HD1  LEU  38          1HD1      LEU  38  11.248  18.088 -16.499
  283   2HD1  LEU  38          2HD1      LEU  38   9.805  18.223 -17.506
  284   3HD1  LEU  38          3HD1      LEU  38  11.387  18.006 -18.255
  285   1HD2  LEU  38          1HD2      LEU  38   9.826  14.694 -18.642
  286   2HD2  LEU  38          2HD2      LEU  38  11.002  15.765 -19.406
  287   3HD2  LEU  38          3HD2      LEU  38   9.358  16.330 -19.107
  288    H    TYR  39           H        TYR  39   9.979  14.466 -14.460
  289    HA   TYR  39           HA       TYR  39  11.353  11.834 -14.128
  290   1HB   TYR  39          2HB       TYR  39  10.255  13.568 -12.071
  291   2HB   TYR  39          1HB       TYR  39   9.431  12.010 -12.083
  292    HD1  TYR  39           HD1      TYR  39  12.613  13.744 -11.519
  293    HD2  TYR  39           HD2      TYR  39  10.679   9.913 -11.722
  294    HE1  TYR  39           HE1      TYR  39  14.565  12.698 -10.402
  295    HE2  TYR  39           HE2      TYR  39  12.631   8.869 -10.605
  296    HH   TYR  39           HH       TYR  39  15.500  10.016 -10.467
  297    H    GLU  40           H        GLU  40   9.954  10.006 -14.350
  298    HA   GLU  40           HA       GLU  40   7.393  10.651 -15.740
  299   1HB   GLU  40          2HB       GLU  40   8.652   7.922 -15.741
  300   2HB   GLU  40          1HB       GLU  40   7.650   8.685 -16.976
  301   1HG   GLU  40          2HG       GLU  40   9.641   9.049 -18.024
  302   2HG   GLU  40          1HG       GLU  40   9.767  10.404 -16.904
  303    H    ILE  41           H        ILE  41   5.582  10.348 -14.538
  304    HA   ILE  41           HA       ILE  41   5.742   8.674 -12.101
  305    HB   ILE  41           HB       ILE  41   3.284  10.166 -12.982
  306   1HG1  ILE  41          2HG1      ILE  41   5.053  11.795 -13.289
  307   2HG1  ILE  41          1HG1      ILE  41   4.228  12.166 -11.775
  308   1HG2  ILE  41          1HG2      ILE  41   3.306  10.563 -10.421
  309   2HG2  ILE  41          2HG2      ILE  41   4.548   9.311 -10.379
  310   3HG2  ILE  41          3HG2      ILE  41   2.939   8.937 -10.996
  311   1HD1  ILE  41          1HD1      ILE  41   6.810  10.593 -12.032
  312   2HD1  ILE  41          2HD1      ILE  41   5.982  10.967 -10.521
  313   3HD1  ILE  41          3HD1      ILE  41   6.678  12.265 -11.489
  314    H    GLU  42           H        GLU  42   4.639   6.742 -11.880
  315    HA   GLU  42           HA       GLU  42   3.118   5.813 -14.283
  316   1HB   GLU  42          2HB       GLU  42   5.292   4.630 -12.877
  317   2HB   GLU  42          1HB       GLU  42   3.866   3.643 -12.554
  318   1HG   GLU  42          2HG       GLU  42   4.785   2.756 -14.560
  319   2HG   GLU  42          1HG       GLU  42   3.421   3.746 -15.080
  320    H    HIS  43           H        HIS  43   1.029   5.091 -13.968
  321    HA   HIS  43           HA       HIS  43   0.082   4.868 -11.140
  322   1HB   HIS  43          2HB       HIS  43  -1.570   6.033 -13.391
  323   2HB   HIS  43          1HB       HIS  43  -1.920   6.069 -11.664
  324    HD2  HIS  43           HD2      HIS  43   0.478   7.877 -14.227
  325    HE1  HIS  43           HE1      HIS  43   0.636   9.955 -10.554
  326    HE2  HIS  43           HE2      HIS  43   1.374   9.985 -12.981
  327    H    HIS  44           H        HIS  44  -0.893   2.936 -10.769
  328    HA   HIS  44           HA       HIS  44  -1.743   1.335 -13.141
  329   1HB   HIS  44          2HB       HIS  44  -1.234   0.360 -10.316
  330   2HB   HIS  44          1HB       HIS  44  -1.445  -0.628 -11.763
  331    HD2  HIS  44           HD2      HIS  44   0.709   0.149 -13.809
  332    HE1  HIS  44           HE1      HIS  44   3.482   0.796 -10.692
  333    HE2  HIS  44           HE2      HIS  44   3.224   0.455 -13.192
  334    H    LEU  45           H        LEU  45  -3.908   1.474 -13.490
  335    HA   LEU  45           HA       LEU  45  -5.692   1.580 -11.089
  336   1HB   LEU  45          2HB       LEU  45  -6.025   2.816 -13.834
  337   2HB   LEU  45          1HB       LEU  45  -7.337   2.700 -12.660
  338    HG   LEU  45           HG       LEU  45  -5.188   3.747 -11.204
  339   1HD1  LEU  45          1HD1      LEU  45  -5.441   5.177 -13.868
  340   2HD1  LEU  45          2HD1      LEU  45  -4.069   4.169 -13.404
  341   3HD1  LEU  45          3HD1      LEU  45  -4.416   5.651 -12.513
  342   1HD2  LEU  45          1HD2      LEU  45  -7.494   4.409 -10.881
  343   2HD2  LEU  45          2HD2      LEU  45  -7.588   5.057 -12.519
  344   3HD2  LEU  45          3HD2      LEU  45  -6.579   5.855 -11.312
  345    H    PHE  46           H        PHE  46  -7.566   0.255 -11.150
  346    HA   PHE  46           HA       PHE  46  -7.745  -1.643 -13.446
  347   1HB   PHE  46          2HB       PHE  46  -8.486  -2.937 -10.975
  348   2HB   PHE  46          1HB       PHE  46  -7.250  -3.410 -12.141
  349    HD1  PHE  46           HD1      PHE  46  -7.798  -2.347  -8.825
  350    HD2  PHE  46           HD2      PHE  46  -5.059  -1.891 -12.104
  351    HE1  PHE  46           HE1      PHE  46  -6.025  -1.633  -7.245
  352    HE2  PHE  46           HE2      PHE  46  -3.287  -1.176 -10.523
  353    HZ   PHE  46           HZ       PHE  46  -3.769  -1.048  -8.095
  354    H    ALA  47           H        ALA  47  -9.902  -2.666 -13.606
  355    HA   ALA  47           HA       ALA  47 -12.042  -1.278 -12.080
  356   1HB   ALA  47          1HB       ALA  47 -11.483  -0.170 -14.384
  357   2HB   ALA  47          2HB       ALA  47 -13.170  -0.481 -13.976
  358   3HB   ALA  47          3HB       ALA  47 -12.310  -1.571 -15.063
  359    H    GLU  48           H        GLU  48 -14.145  -2.408 -12.302
  360    HA   GLU  48           HA       GLU  48 -13.712  -5.326 -12.667
  361   1HB   GLU  48          2HB       GLU  48 -14.964  -3.934 -10.661
  362   2HB   GLU  48          1HB       GLU  48 -16.332  -4.385 -11.681
  363   1HG   GLU  48          2HG       GLU  48 -15.924  -6.142 -10.025
  364   2HG   GLU  48          1HG       GLU  48 -15.552  -6.747 -11.641
  365    H    ASP  49           H        ASP  49 -15.040  -2.647 -14.283
  366    HA   ASP  49           HA       ASP  49 -16.706  -4.461 -15.983
  367   1HB   ASP  49          2HB       ASP  49 -17.199  -1.772 -14.873
  368   2HB   ASP  49          1HB       ASP  49 -17.577  -1.929 -16.589
  369    H    PHE  50           H        PHE  50 -15.911  -4.736 -18.008
  370    HA   PHE  50           HA       PHE  50 -13.539  -3.472 -18.942
  371   1HB   PHE  50          2HB       PHE  50 -15.395  -4.387 -21.041
  372   2HB   PHE  50          1HB       PHE  50 -13.740  -4.898 -20.701
  373    HD1  PHE  50           HD1      PHE  50 -16.575  -6.437 -21.196
  374    HD2  PHE  50           HD2      PHE  50 -13.993  -5.705 -17.844
  375    HE1  PHE  50           HE1      PHE  50 -17.431  -8.485 -20.090
  376    HE2  PHE  50           HE2      PHE  50 -14.849  -7.752 -16.737
  377    HZ   PHE  50           HZ       PHE  50 -16.568  -9.142 -17.860
  378    H    ASP  51           H        ASP  51 -16.912  -2.568 -19.181
  379    HA   ASP  51           HA       ASP  51 -16.526  -0.566 -21.250
  380   1HB   ASP  51          2HB       ASP  51 -18.787   0.265 -20.093
  381   2HB   ASP  51          1HB       ASP  51 -18.759  -1.154 -21.140
  382    H    LYS  52           H        LYS  52 -16.821  -0.474 -17.697
  383    HA   LYS  52           HA       LYS  52 -16.498   2.367 -17.458
  384   1HB   LYS  52          2HB       LYS  52 -17.215   0.522 -15.695
  385   2HB   LYS  52          1HB       LYS  52 -15.488   0.498 -15.340
  386   1HG   LYS  52          2HG       LYS  52 -15.971   2.236 -13.956
  387   2HG   LYS  52          1HG       LYS  52 -15.975   3.191 -15.439
  388   1HD   LYS  52          2HD       LYS  52 -18.033   3.601 -14.160
  389   2HD   LYS  52          1HD       LYS  52 -18.408   2.788 -15.679
  390   1HE   LYS  52          2HE       LYS  52 -17.832   0.889 -13.540
  391   2HE   LYS  52          1HE       LYS  52 -19.186   1.944 -13.139
  392   1HZ   LYS  52          1HZ       LYS  52 -19.454   1.192 -15.810
  393   2HZ   LYS  52          2HZ       LYS  52 -20.447   0.766 -14.499
  394   3HZ   LYS  52          3HZ       LYS  52 -19.130  -0.219 -14.926
  395    H    LEU  53           H        LEU  53 -14.305  -0.200 -18.135
  396    HA   LEU  53           HA       LEU  53 -11.895   1.134 -17.209
  397   1HB   LEU  53          2HB       LEU  53 -12.185  -1.370 -17.590
  398   2HB   LEU  53          1HB       LEU  53 -12.095  -1.030 -19.318
  399    HG   LEU  53           HG       LEU  53  -9.965   0.079 -17.527
  400   1HD1  LEU  53          1HD1      LEU  53 -10.279  -2.804 -18.378
  401   2HD1  LEU  53          2HD1      LEU  53  -9.931  -2.174 -16.768
  402   3HD1  LEU  53          3HD1      LEU  53  -8.699  -2.106 -18.028
  403   1HD2  LEU  53          1HD2      LEU  53  -8.632  -0.520 -19.634
  404   2HD2  LEU  53          2HD2      LEU  53  -9.846   0.745 -19.821
  405   3HD2  LEU  53          3HD2      LEU  53 -10.183  -0.890 -20.387
  406    H    GLU  54           H        GLU  54 -13.268   0.533 -20.467
  407    HA   GLU  54           HA       GLU  54 -11.367   2.137 -21.867
  408   1HB   GLU  54          2HB       GLU  54 -14.236   1.417 -22.537
  409   2HB   GLU  54          1HB       GLU  54 -13.135   2.214 -23.661
  410   1HG   GLU  54          2HG       GLU  54 -11.537   0.203 -23.025
  411   2HG   GLU  54          1HG       GLU  54 -13.056  -0.586 -22.599
  412    H    LYS  55           H        LYS  55 -14.437   2.940 -20.298
  413    HA   LYS  55           HA       LYS  55 -14.654   5.609 -21.309
  414   1HB   LYS  55          2HB       LYS  55 -15.686   4.278 -18.797
  415   2HB   LYS  55          1HB       LYS  55 -16.045   5.961 -19.188
  416   1HG   LYS  55          2HG       LYS  55 -17.116   5.321 -21.260
  417   2HG   LYS  55          1HG       LYS  55 -16.605   3.645 -21.060
  418   1HD   LYS  55          2HD       LYS  55 -17.989   3.429 -19.052
  419   2HD   LYS  55          1HD       LYS  55 -18.459   5.126 -19.172
  420   1HE   LYS  55          2HE       LYS  55 -19.082   2.934 -21.171
  421   2HE   LYS  55          1HE       LYS  55 -20.233   3.762 -20.122
  422   1HZ   LYS  55          1HZ       LYS  55 -19.028   5.810 -21.377
  423   2HZ   LYS  55          2HZ       LYS  55 -20.497   5.111 -21.866
  424   3HZ   LYS  55          3HZ       LYS  55 -19.040   4.634 -22.600
  425    H    ALA  56           H        ALA  56 -13.649   4.636 -18.005
  426    HA   ALA  56           HA       ALA  56 -12.569   7.145 -17.280
  427   1HB   ALA  56          1HB       ALA  56 -12.475   5.945 -15.370
  428   2HB   ALA  56          2HB       ALA  56 -10.968   5.260 -15.977
  429   3HB   ALA  56          3HB       ALA  56 -12.493   4.419 -16.254
  430    H    ALA  57           H        ALA  57 -10.852   4.300 -18.622
  431    HA   ALA  57           HA       ALA  57  -8.271   5.415 -18.731
  432   1HB   ALA  57          1HB       ALA  57  -7.890   3.852 -20.658
  433   2HB   ALA  57          2HB       ALA  57  -9.621   3.513 -20.671
  434   3HB   ALA  57          3HB       ALA  57  -8.646   3.073 -19.268
  435    H    VAL  58           H        VAL  58 -10.878   5.623 -21.164
  436    HA   VAL  58           HA       VAL  58  -9.501   7.056 -23.150
  437    HB   VAL  58           HB       VAL  58 -12.357   6.902 -22.279
  438   1HG1  VAL  58          1HG1      VAL  58 -11.185   9.017 -24.089
  439   2HG1  VAL  58          2HG1      VAL  58 -12.316   9.227 -22.751
  440   3HG1  VAL  58          3HG1      VAL  58 -12.857   8.481 -24.255
  441   1HG2  VAL  58          1HG2      VAL  58 -10.840   6.439 -24.865
  442   2HG2  VAL  58          2HG2      VAL  58 -12.582   6.223 -24.686
  443   3HG2  VAL  58          3HG2      VAL  58 -11.468   5.202 -23.775
  444    H    GLU  59           H        GLU  59 -11.594   8.559 -20.651
  445    HA   GLU  59           HA       GLU  59 -10.862  11.222 -21.091
  446   1HB   GLU  59          2HB       GLU  59 -12.359   9.876 -19.184
  447   2HB   GLU  59          1HB       GLU  59 -11.052  10.589 -18.235
  448   1HG   GLU  59          2HG       GLU  59 -11.529  12.793 -19.321
  449   2HG   GLU  59          1HG       GLU  59 -12.914  12.054 -20.128
  450    H    ALA  60           H        ALA  60  -8.987   8.669 -19.629
  451    HA   ALA  60           HA       ALA  60  -7.077  10.387 -18.295
  452   1HB   ALA  60          1HB       ALA  60  -7.568   7.759 -18.117
  453   2HB   ALA  60          2HB       ALA  60  -5.993   8.440 -17.708
  454   3HB   ALA  60          3HB       ALA  60  -6.250   7.697 -19.286
  455    H    PHE  61           H        PHE  61  -7.002   8.617 -21.405
  456    HA   PHE  61           HA       PHE  61  -4.443   9.606 -22.217
  457   1HB   PHE  61          2HB       PHE  61  -5.236   7.746 -23.433
  458   2HB   PHE  61          1HB       PHE  61  -6.813   8.486 -23.707
  459    HD1  PHE  61           HD1      PHE  61  -6.905  10.617 -25.153
  460    HD2  PHE  61           HD2      PHE  61  -3.505   7.996 -25.013
  461    HE1  PHE  61           HE1      PHE  61  -6.091  11.559 -27.298
  462    HE2  PHE  61           HE2      PHE  61  -2.691   8.937 -27.157
  463    HZ   PHE  61           HZ       PHE  61  -3.984  10.718 -28.301
  464    H    LYS  62           H        LYS  62  -7.701  10.933 -22.480
  465    HA   LYS  62           HA       LYS  62  -7.023  13.031 -24.342
  466   1HB   LYS  62          2HB       LYS  62  -9.362  12.218 -23.807
  467   2HB   LYS  62          1HB       LYS  62  -9.235  13.078 -22.272
  468   1HG   LYS  62          2HG       LYS  62  -8.848  15.192 -23.465
  469   2HG   LYS  62          1HG       LYS  62  -8.924  14.345 -25.010
  470   1HD   LYS  62          2HD       LYS  62 -11.130  14.896 -24.952
  471   2HD   LYS  62          1HD       LYS  62 -11.264  13.533 -23.842
  472   1HE   LYS  62          2HE       LYS  62 -10.674  16.369 -22.953
  473   2HE   LYS  62          1HE       LYS  62 -12.292  15.667 -22.976
  474   1HZ   LYS  62          1HZ       LYS  62 -11.132  13.786 -21.634
  475   2HZ   LYS  62          2HZ       LYS  62 -11.628  15.209 -20.850
  476   3HZ   LYS  62          3HZ       LYS  62  -9.997  14.993 -21.273
  477    H    MET  63           H        MET  63  -6.911  12.743 -20.823
  478    HA   MET  63           HA       MET  63  -6.423  15.558 -20.345
  479   1HB   MET  63          2HB       MET  63  -6.464  13.069 -18.763
  480   2HB   MET  63          1HB       MET  63  -5.319  14.278 -18.183
  481   1HG   MET  63          2HG       MET  63  -7.164  15.977 -18.258
  482   2HG   MET  63          1HG       MET  63  -8.285  14.677 -18.664
  483   1HE   MET  63          1HE       MET  63  -8.766  12.605 -15.639
  484   2HE   MET  63          2HE       MET  63  -8.012  12.302 -17.203
  485   3HE   MET  63          3HE       MET  63  -9.464  13.295 -17.111
  486    H    GLY  64           H        GLY  64  -4.287  12.694 -20.524
  487   1HA   GLY  64          2HA       GLY  64  -2.176  13.530 -21.931
  488   2HA   GLY  64          1HA       GLY  64  -1.926  14.483 -20.468
  489    H    PHE  65           H        PHE  65  -3.428  11.457 -19.925
  490    HA   PHE  65           HA       PHE  65  -0.907  10.463 -18.706
  491   1HB   PHE  65          2HB       PHE  65  -3.807   9.643 -18.395
  492   2HB   PHE  65          1HB       PHE  65  -2.471   8.755 -17.661
  493    HD1  PHE  65           HD1      PHE  65  -1.316   9.595 -15.735
  494    HD2  PHE  65           HD2      PHE  65  -4.220  12.028 -17.759
  495    HE1  PHE  65           HE1      PHE  65  -1.272  11.212 -13.855
  496    HE2  PHE  65           HE2      PHE  65  -4.175  13.644 -15.878
  497    HZ   PHE  65           HZ       PHE  65  -2.701  13.237 -13.926
  498    H    GLU  66           H        GLU  66   0.293   9.207 -20.054
  499    HA   GLU  66           HA       GLU  66  -0.667   7.950 -22.417
  500   1HB   GLU  66          2HB       GLU  66   1.795   7.796 -20.761
  501   2HB   GLU  66          1HB       GLU  66   1.481   6.416 -21.814
  502   1HG   GLU  66          2HG       GLU  66   1.103   9.107 -23.019
  503   2HG   GLU  66          1HG       GLU  66   2.764   8.632 -22.667
  504    H    VAL  67           H        VAL  67  -2.634   6.880 -21.724
  505    HA   VAL  67           HA       VAL  67  -2.724   4.853 -19.711
  506    HB   VAL  67           HB       VAL  67  -4.676   6.028 -20.919
  507   1HG1  VAL  67          1HG1      VAL  67  -3.769   5.371 -23.200
  508   2HG1  VAL  67          2HG1      VAL  67  -5.479   5.026 -22.947
  509   3HG1  VAL  67          3HG1      VAL  67  -4.292   3.725 -22.845
  510   1HG2  VAL  67          1HG2      VAL  67  -4.422   3.450 -19.705
  511   2HG2  VAL  67          2HG2      VAL  67  -5.579   3.310 -21.029
  512   3HG2  VAL  67          3HG2      VAL  67  -5.843   4.494 -19.750
  513    H    LEU  68           H        LEU  68  -2.230   2.678 -19.790
  514    HA   LEU  68           HA       LEU  68  -1.121   1.662 -22.377
  515   1HB   LEU  68          2HB       LEU  68   0.292   1.911 -20.103
  516   2HB   LEU  68          1HB       LEU  68  -0.424   0.326 -19.805
  517    HG   LEU  68           HG       LEU  68   0.350   0.001 -22.378
  518   1HD1  LEU  68          1HD1      LEU  68   2.257   1.983 -21.110
  519   2HD1  LEU  68          2HD1      LEU  68   1.392   2.153 -22.637
  520   3HD1  LEU  68          3HD1      LEU  68   2.693   0.972 -22.488
  521   1HD2  LEU  68          1HD2      LEU  68   2.413  -1.086 -21.410
  522   2HD2  LEU  68          2HD2      LEU  68   0.915  -1.539 -20.595
  523   3HD2  LEU  68          3HD2      LEU  68   1.999  -0.359 -19.858
  524    H    GLU  69           H        GLU  69  -1.908  -0.297 -23.135
  525    HA   GLU  69           HA       GLU  69  -4.470  -1.179 -22.495
  526   1HB   GLU  69          2HB       GLU  69  -3.542  -2.057 -24.481
  527   2HB   GLU  69          1HB       GLU  69  -2.094  -2.631 -23.653
  528   1HG   GLU  69          2HG       GLU  69  -3.711  -4.465 -24.237
  529   2HG   GLU  69          1HG       GLU  69  -3.358  -4.357 -22.511
  530    H    ALA  70           H        ALA  70  -5.286  -2.899 -21.180
  531    HA   ALA  70           HA       ALA  70  -3.561  -3.465 -18.818
  532   1HB   ALA  70          1HB       ALA  70  -5.672  -2.433 -18.244
  533   2HB   ALA  70          2HB       ALA  70  -5.746  -4.122 -17.745
  534   3HB   ALA  70          3HB       ALA  70  -6.562  -3.601 -19.219
  535    H    GLU  71           H        GLU  71  -3.768  -5.681 -17.874
  536    HA   GLU  71           HA       GLU  71  -4.281  -7.737 -19.986
  537   1HB   GLU  71          2HB       GLU  71  -1.852  -7.444 -19.602
  538   2HB   GLU  71          1HB       GLU  71  -2.092  -7.763 -17.884
  539   1HG   GLU  71          2HG       GLU  71  -1.731  -9.936 -18.404
  540   2HG   GLU  71          1HG       GLU  71  -3.360  -9.909 -19.082
  541    H    GLU  72           H        GLU  72  -5.446  -9.528 -19.301
  542    HA   GLU  72           HA       GLU  72  -7.042  -9.325 -16.951
  543   1HB   GLU  72          2HB       GLU  72  -6.949 -12.046 -17.585
  544   2HB   GLU  72          1HB       GLU  72  -8.116 -10.872 -18.194
  545   1HG   GLU  72          2HG       GLU  72  -5.411 -11.287 -19.483
  546   2HG   GLU  72          1HG       GLU  72  -6.841 -12.197 -19.969
  547    H    THR  73           H        THR  73  -6.443  -9.638 -14.869
  548    HA   THR  73           HA       THR  73  -4.226 -11.570 -14.320
  549    HB   THR  73           HB       THR  73  -3.421  -9.260 -14.007
  550    HG1  THR  73           HG1      THR  73  -2.515  -9.738 -12.143
  551   1HG2  THR  73          1HG2      THR  73  -6.033  -8.784 -13.158
  552   2HG2  THR  73          2HG2      THR  73  -4.690  -7.643 -13.082
  553   3HG2  THR  73          3HG2      THR  73  -5.073  -8.647 -11.684
  554    H    GLU  74           H        GLU  74  -4.398 -11.533 -11.535
  555    HA   GLU  74           HA       GLU  74  -7.242 -12.150 -10.921
  556   1HB   GLU  74          2HB       GLU  74  -6.592 -14.335 -11.379
  557   2HB   GLU  74          1HB       GLU  74  -4.927 -14.055 -10.869
  558   1HG   GLU  74          2HG       GLU  74  -5.455 -14.233  -8.595
  559   2HG   GLU  74          1HG       GLU  74  -7.159 -13.867  -8.863
  560    H    ASP  75           H        ASP  75  -7.790 -11.626  -8.823
  561    HA   ASP  75           HA       ASP  75  -5.697 -10.297  -7.210
  562   1HB   ASP  75          2HB       ASP  75  -7.519  -9.392  -5.911
  563   2HB   ASP  75          1HB       ASP  75  -7.969  -9.252  -7.611
  564    H    GLU  76           H        GLU  76  -6.371 -10.705  -4.650
  565    HA   GLU  76           HA       GLU  76  -5.563 -13.460  -4.184
  566   1HB   GLU  76          2HB       GLU  76  -6.534 -11.428  -2.156
  567   2HB   GLU  76          1HB       GLU  76  -5.552 -12.858  -1.840
  568   1HG   GLU  76          2HG       GLU  76  -3.639 -11.919  -2.752
  569   2HG   GLU  76          1HG       GLU  76  -4.548 -10.846  -3.817
  570    H    ASP  77           H        ASP  77  -8.190 -13.017  -5.505
  571    HA   ASP  77           HA       ASP  77  -9.773 -14.746  -3.696
  572   1HB   ASP  77          2HB       ASP  77 -10.324 -12.142  -3.531
  573   2HB   ASP  77          1HB       ASP  77 -11.241 -12.489  -4.998
  574    H    GLY  78           H        GLY  78  -9.765 -13.038  -6.839
  575   1HA   GLY  78          2HA       GLY  78  -9.663 -14.523  -8.865
  576   2HA   GLY  78          1HA       GLY  78 -10.837 -15.557  -8.050
  577    H    ASN  79           H        ASN  79 -10.616 -12.032  -8.668
  578    HA   ASN  79           HA       ASN  79 -13.486 -12.115  -9.460
  579   1HB   ASN  79          2HB       ASN  79 -12.277 -10.440  -7.723
  580   2HB   ASN  79          1HB       ASN  79 -12.051  -9.521  -9.213
  581   1HD2  ASN  79          1HD2      ASN  79 -14.282  -9.698 -10.646
  582   2HD2  ASN  79          2HD2      ASN  79 -15.676  -9.301  -9.764
  583    H    LYS  80           H        LYS  80 -10.516 -12.286 -10.906
  584    HA   LYS  80           HA       LYS  80  -9.710 -11.718 -13.050
  585   1HB   LYS  80          2HB       LYS  80 -11.612 -13.367 -13.452
  586   2HB   LYS  80          1HB       LYS  80 -12.629 -11.972 -13.809
  587   1HG   LYS  80          2HG       LYS  80 -11.597 -11.557 -15.805
  588   2HG   LYS  80          1HG       LYS  80 -10.013 -12.048 -15.204
  589   1HD   LYS  80          2HD       LYS  80 -12.245 -14.019 -15.744
  590   2HD   LYS  80          1HD       LYS  80 -11.032 -13.591 -16.951
  591   1HE   LYS  80          2HE       LYS  80  -9.696 -15.164 -16.046
  592   2HE   LYS  80          1HE       LYS  80  -9.572 -14.141 -14.615
  593   1HZ   LYS  80          1HZ       LYS  80 -10.398 -16.495 -14.277
  594   2HZ   LYS  80          2HZ       LYS  80 -11.841 -15.994 -15.022
  595   3HZ   LYS  80          3HZ       LYS  80 -11.325 -15.259 -13.580
  596    H    LEU  81           H        LEU  81  -9.102  -9.531 -12.837
  597    HA   LEU  81           HA       LEU  81 -11.135  -7.577 -13.834
  598   1HB   LEU  81          2HB       LEU  81  -9.260  -6.198 -12.201
  599   2HB   LEU  81          1HB       LEU  81 -10.979  -6.444 -11.896
  600    HG   LEU  81           HG       LEU  81 -10.399  -8.709 -10.940
  601   1HD1  LEU  81          1HD1      LEU  81  -8.282  -9.490 -11.010
  602   2HD1  LEU  81          2HD1      LEU  81  -7.637  -7.979 -10.366
  603   3HD1  LEU  81          3HD1      LEU  81  -7.913  -8.151 -12.098
  604   1HD2  LEU  81          1HD2      LEU  81  -9.420  -6.118  -9.753
  605   2HD2  LEU  81          2HD2      LEU  81  -9.227  -7.630  -8.865
  606   3HD2  LEU  81          3HD2      LEU  81 -10.838  -7.070  -9.313
  607    H    LEU  82           H        LEU  82 -10.056  -5.590 -14.773
  608    HA   LEU  82           HA       LEU  82  -7.556  -6.407 -16.188
  609   1HB   LEU  82          2HB       LEU  82  -9.789  -4.504 -16.932
  610   2HB   LEU  82          1HB       LEU  82  -8.252  -4.545 -17.798
  611    HG   LEU  82           HG       LEU  82  -8.609  -7.009 -18.166
  612   1HD1  LEU  82          1HD1      LEU  82 -10.964  -6.363 -16.515
  613   2HD1  LEU  82          2HD1      LEU  82 -10.157  -7.911 -16.767
  614   3HD1  LEU  82          3HD1      LEU  82 -11.327  -7.324 -17.949
  615   1HD2  LEU  82          1HD2      LEU  82 -10.664  -5.044 -19.218
  616   2HD2  LEU  82          2HD2      LEU  82 -10.440  -6.664 -19.878
  617   3HD2  LEU  82          3HD2      LEU  82  -9.130  -5.485 -19.969
  618    H    CYS  83           H        CYS  83  -5.748  -5.079 -16.068
  619    HA   CYS  83           HA       CYS  83  -6.032  -2.601 -14.418
  620   1HB   CYS  83          2HB       CYS  83  -4.915  -4.104 -12.979
  621   2HB   CYS  83          1HB       CYS  83  -3.964  -4.791 -14.296
  622    HG   CYS  83           HG       CYS  83  -3.158  -2.395 -12.662
  623    H    PHE  84           H        PHE  84  -5.769  -0.972 -15.886
  624    HA   PHE  84           HA       PHE  84  -3.785  -1.298 -18.065
  625   1HB   PHE  84          2HB       PHE  84  -4.711   1.057 -18.675
  626   2HB   PHE  84          1HB       PHE  84  -5.765  -0.337 -18.909
  627    HD1  PHE  84           HD1      PHE  84  -5.513   2.881 -17.467
  628    HD2  PHE  84           HD2      PHE  84  -7.238  -0.996 -16.804
  629    HE1  PHE  84           HE1      PHE  84  -7.183   3.886 -15.933
  630    HE2  PHE  84           HE2      PHE  84  -8.907   0.008 -15.269
  631    HZ   PHE  84           HZ       PHE  84  -8.879   2.450 -14.834
  632    H    ASP  85           H        ASP  85  -2.035   0.220 -18.321
  633    HA   ASP  85           HA       ASP  85  -1.232   1.461 -15.730
  634   1HB   ASP  85          2HB       ASP  85   0.631   1.153 -18.065
  635   2HB   ASP  85          1HB       ASP  85   0.994   1.137 -16.340
  636    H    ALA  86           H        ALA  86  -0.445   3.630 -15.708
  637    HA   ALA  86           HA       ALA  86  -1.027   5.213 -18.176
  638   1HB   ALA  86          1HB       ALA  86  -1.493   6.844 -15.886
  639   2HB   ALA  86          2HB       ALA  86  -2.380   5.337 -15.647
  640   3HB   ALA  86          3HB       ALA  86  -2.666   6.310 -17.090
  641    H    THR  87           H        THR  87   0.481   6.819 -18.620
  642    HA   THR  87           HA       THR  87   2.677   7.164 -16.615
  643    HB   THR  87           HB       THR  87   3.797   7.685 -19.117
  644    HG1  THR  87           HG1      THR  87   3.051   5.231 -19.694
  645   1HG2  THR  87          1HG2      THR  87   3.858   5.243 -17.332
  646   2HG2  THR  87          2HG2      THR  87   4.992   6.593 -17.341
  647   3HG2  THR  87          3HG2      THR  87   4.948   5.469 -18.699
  648    H    MET  88           H        MET  88   3.446   9.283 -16.367
  649    HA   MET  88           HA       MET  88   2.418  11.393 -18.164
  650   1HB   MET  88          2HB       MET  88   0.725  11.026 -16.293
  651   2HB   MET  88          1HB       MET  88   1.969  11.587 -15.176
  652   1HG   MET  88          2HG       MET  88   1.485  13.724 -15.679
  653   2HG   MET  88          1HG       MET  88   1.828  13.418 -17.381
  654   1HE   MET  88          1HE       MET  88  -0.135  15.313 -15.804
  655   2HE   MET  88          2HE       MET  88  -1.707  15.272 -16.599
  656   3HE   MET  88          3HE       MET  88  -0.248  15.506 -17.559
  657    H    GLN  89           H        GLN  89   4.237  12.517 -18.644
  658    HA   GLN  89           HA       GLN  89   6.566  12.475 -16.896
  659   1HB   GLN  89          2HB       GLN  89   5.885  13.544 -19.579
  660   2HB   GLN  89          1HB       GLN  89   7.134  14.425 -18.701
  661   1HG   GLN  89          2HG       GLN  89   8.287  12.740 -19.937
  662   2HG   GLN  89          1HG       GLN  89   8.237  12.155 -18.274
  663   1HE2  GLN  89          1HE2      GLN  89   7.553  10.021 -18.094
  664   2HE2  GLN  89          2HE2      GLN  89   6.538   9.223 -19.196
  665    H    SER  90           H        SER  90   7.135  14.004 -15.391
  666    HA   SER  90           HA       SER  90   6.169  16.735 -15.492
  667   1HB   SER  90          2HB       SER  90   4.573  16.737 -13.785
  668   2HB   SER  90          1HB       SER  90   4.210  15.222 -14.608
  669    HG   SER  90           HG       SER  90   4.600  15.358 -12.151
  670    H    ALA  91           H        ALA  91   6.992  17.985 -13.599
  671    HA   ALA  91           HA       ALA  91   9.656  17.156 -12.888
  672   1HB   ALA  91          1HB       ALA  91   9.172  19.137 -11.121
  673   2HB   ALA  91          2HB       ALA  91   7.873  19.455 -12.271
  674   3HB   ALA  91          3HB       ALA  91   9.550  19.447 -12.815
  675    H    LEU  92           H        LEU  92  10.357  16.037 -11.104
  676    HA   LEU  92           HA       LEU  92   8.461  14.632  -9.461
  677   1HB   LEU  92          2HB       LEU  92  10.744  13.780  -9.934
  678   2HB   LEU  92          1HB       LEU  92  11.422  15.101  -8.982
  679    HG   LEU  92           HG       LEU  92   9.477  13.954  -7.321
  680   1HD1  LEU  92          1HD1      LEU  92  10.299  11.553  -7.276
  681   2HD1  LEU  92          2HD1      LEU  92  11.062  11.864  -8.835
  682   3HD1  LEU  92          3HD1      LEU  92   9.309  11.971  -8.674
  683   1HD2  LEU  92          1HD2      LEU  92  12.484  13.875  -7.491
  684   2HD2  LEU  92          2HD2      LEU  92  11.646  13.003  -6.208
  685   3HD2  LEU  92          3HD2      LEU  92  11.464  14.751  -6.350
  686    H    ASP  93           H        ASP  93   7.149  16.373  -8.577
  687    HA   ASP  93           HA       ASP  93   8.464  17.682  -6.238
  688   1HB   ASP  93          2HB       ASP  93   7.000  18.930  -8.494
  689   2HB   ASP  93          1HB       ASP  93   6.558  19.508  -6.887
  690    H    ALA  94           H        ALA  94   7.381  17.220  -4.383
  691    HA   ALA  94           HA       ALA  94   5.209  15.506  -4.148
  692   1HB   ALA  94          1HB       ALA  94   5.707  17.875  -2.321
  693   2HB   ALA  94          2HB       ALA  94   6.618  16.366  -2.249
  694   3HB   ALA  94          3HB       ALA  94   4.890  16.370  -1.901
  695    H    LYS  95           H        LYS  95   4.942  19.077  -3.916
  696    HA   LYS  95           HA       LYS  95   2.186  19.340  -3.883
  697   1HB   LYS  95          2HB       LYS  95   4.425  20.998  -4.717
  698   2HB   LYS  95          1HB       LYS  95   3.001  21.304  -5.711
  699   1HG   LYS  95          2HG       LYS  95   2.944  21.236  -2.683
  700   2HG   LYS  95          1HG       LYS  95   3.123  22.717  -3.623
  701   1HD   LYS  95          2HD       LYS  95   0.975  21.752  -4.875
  702   2HD   LYS  95          1HD       LYS  95   0.744  20.933  -3.331
  703   1HE   LYS  95          2HE       LYS  95  -0.415  23.022  -3.157
  704   2HE   LYS  95          1HE       LYS  95   1.066  23.198  -2.216
  705   1HZ   LYS  95          1HZ       LYS  95   0.264  24.881  -4.160
  706   2HZ   LYS  95          2HZ       LYS  95   1.354  23.884  -4.999
  707   3HZ   LYS  95          3HZ       LYS  95   1.861  24.726  -3.613
  708    H    LEU  96           H        LEU  96   4.199  18.977  -6.817
  709    HA   LEU  96           HA       LEU  96   2.075  19.018  -8.698
  710   1HB   LEU  96          2HB       LEU  96   4.887  18.273  -8.672
  711   2HB   LEU  96          1HB       LEU  96   3.949  17.191  -9.701
  712    HG   LEU  96           HG       LEU  96   2.906  19.274 -10.730
  713   1HD1  LEU  96          1HD1      LEU  96   4.237  21.359 -10.467
  714   2HD1  LEU  96          2HD1      LEU  96   5.214  20.559  -9.237
  715   3HD1  LEU  96          3HD1      LEU  96   3.500  20.851  -8.948
  716   1HD2  LEU  96          1HD2      LEU  96   5.914  19.051 -11.038
  717   2HD2  LEU  96          2HD2      LEU  96   4.755  19.587 -12.254
  718   3HD2  LEU  96          3HD2      LEU  96   4.777  17.901 -11.741
  719    H    ILE  97           H        ILE  97   3.688  16.153  -7.269
  720    HA   ILE  97           HA       ILE  97   1.943  14.218  -8.368
  721    HB   ILE  97           HB       ILE  97   3.284  14.091  -5.653
  722   1HG1  ILE  97          2HG1      ILE  97   4.389  13.199  -8.330
  723   2HG1  ILE  97          1HG1      ILE  97   4.783  14.755  -7.599
  724   1HG2  ILE  97          1HG2      ILE  97   3.415  11.604  -6.547
  725   2HG2  ILE  97          2HG2      ILE  97   2.035  12.108  -7.524
  726   3HG2  ILE  97          3HG2      ILE  97   1.947  12.191  -5.765
  727   1HD1  ILE  97          1HD1      ILE  97   5.675  12.036  -6.845
  728   2HD1  ILE  97          2HD1      ILE  97   5.238  13.084  -5.495
  729   3HD1  ILE  97          3HD1      ILE  97   6.488  13.588  -6.634
  730    H    ASP  98           H        ASP  98   1.434  16.473  -5.768
  731    HA   ASP  98           HA       ASP  98  -0.703  15.058  -4.449
  732   1HB   ASP  98          2HB       ASP  98  -0.237  18.052  -4.615
  733   2HB   ASP  98          1HB       ASP  98  -1.231  17.215  -3.422
  734    H    GLU  99           H        GLU  99  -0.782  17.770  -6.795
  735    HA   GLU  99           HA       GLU  99  -3.634  17.612  -7.170
  736   1HB   GLU  99          2HB       GLU  99  -1.360  18.934  -8.618
  737   2HB   GLU  99          1HB       GLU  99  -2.938  18.847  -9.402
  738   1HG   GLU  99          2HG       GLU  99  -3.889  19.788  -7.197
  739   2HG   GLU  99          1HG       GLU  99  -2.219  20.191  -6.795
  740    H    GLN 100           H        GLN 100  -0.869  16.124  -8.804
  741    HA   GLN 100           HA       GLN 100  -2.257  15.072 -11.056
  742   1HB   GLN 100          2HB       GLN 100   0.334  14.777  -9.845
  743   2HB   GLN 100          1HB       GLN 100  -0.295  13.177 -10.237
  744   1HG   GLN 100          2HG       GLN 100  -0.600  13.750 -12.535
  745   2HG   GLN 100          1HG       GLN 100  -0.359  15.467 -12.211
  746   1HE2  GLN 100          1HE2      GLN 100   1.920  15.974 -11.211
  747   2HE2  GLN 100          2HE2      GLN 100   3.231  15.106 -11.852
  748    H    VAL 101           H        VAL 101  -1.557  13.552  -7.894
  749    HA   VAL 101           HA       VAL 101  -3.029  11.155  -8.427
  750    HB   VAL 101           HB       VAL 101  -2.361  12.516  -5.800
  751   1HG1  VAL 101          1HG1      VAL 101  -2.598   9.821  -5.308
  752   2HG1  VAL 101          2HG1      VAL 101  -3.902  10.094  -6.463
  753   3HG1  VAL 101          3HG1      VAL 101  -3.848  11.016  -4.961
  754   1HG2  VAL 101          1HG2      VAL 101  -0.474  11.767  -7.347
  755   2HG2  VAL 101          2HG2      VAL 101  -1.061  10.120  -7.120
  756   3HG2  VAL 101          3HG2      VAL 101  -0.468  11.042  -5.739
  757    H    GLU 102           H        GLU 102  -3.959  14.199  -6.812
  758    HA   GLU 102           HA       GLU 102  -6.581  13.453  -6.054
  759   1HB   GLU 102          2HB       GLU 102  -5.326  15.623  -5.513
  760   2HB   GLU 102          1HB       GLU 102  -5.852  16.196  -7.096
  761   1HG   GLU 102          2HG       GLU 102  -8.157  16.038  -6.499
  762   2HG   GLU 102          1HG       GLU 102  -7.790  15.095  -5.053
  763    H    LYS 103           H        LYS 103  -5.272  14.332  -9.190
  764    HA   LYS 103           HA       LYS 103  -7.839  14.754 -10.466
  765   1HB   LYS 103          2HB       LYS 103  -5.012  14.392 -11.390
  766   2HB   LYS 103          1HB       LYS 103  -6.313  14.198 -12.564
  767   1HG   LYS 103          2HG       LYS 103  -7.208  16.431 -11.868
  768   2HG   LYS 103          1HG       LYS 103  -5.797  16.629 -10.830
  769   1HD   LYS 103          2HD       LYS 103  -4.900  15.831 -13.435
  770   2HD   LYS 103          1HD       LYS 103  -6.010  17.190 -13.616
  771   1HE   LYS 103          2HE       LYS 103  -3.639  17.127 -11.726
  772   2HE   LYS 103          1HE       LYS 103  -3.669  17.949 -13.286
  773   1HZ   LYS 103          1HZ       LYS 103  -4.307  19.151 -11.024
  774   2HZ   LYS 103          2HZ       LYS 103  -5.842  18.555 -11.444
  775   3HZ   LYS 103          3HZ       LYS 103  -5.002  19.577 -12.511
  776    H    LEU 104           H        LEU 104  -5.564  11.999 -10.356
  777    HA   LEU 104           HA       LEU 104  -7.237  10.264 -11.936
  778   1HB   LEU 104          2HB       LEU 104  -5.075   9.604  -9.911
  779   2HB   LEU 104          1HB       LEU 104  -5.795   8.447 -11.032
  780    HG   LEU 104           HG       LEU 104  -4.371  10.990 -11.868
  781   1HD1  LEU 104          1HD1      LEU 104  -2.522   9.568 -12.515
  782   2HD1  LEU 104          2HD1      LEU 104  -3.424   8.118 -12.074
  783   3HD1  LEU 104          3HD1      LEU 104  -2.891   9.240 -10.821
  784   1HD2  LEU 104          1HD2      LEU 104  -5.766  10.509 -13.656
  785   2HD2  LEU 104          2HD2      LEU 104  -5.818   8.786 -13.286
  786   3HD2  LEU 104          3HD2      LEU 104  -4.395   9.478 -14.063
  787    H    VAL 105           H        VAL 105  -6.917  10.831  -8.444
  788    HA   VAL 105           HA       VAL 105  -8.684   8.707  -7.643
  789    HB   VAL 105           HB       VAL 105  -7.767  11.264  -6.322
  790   1HG1  VAL 105          1HG1      VAL 105  -9.822   9.256  -5.403
  791   2HG1  VAL 105          2HG1      VAL 105  -9.919  11.017  -5.379
  792   3HG1  VAL 105          3HG1      VAL 105  -8.864  10.177  -4.243
  793   1HG2  VAL 105          1HG2      VAL 105  -7.333   8.673  -5.021
  794   2HG2  VAL 105          2HG2      VAL 105  -6.170   9.941  -5.405
  795   3HG2  VAL 105          3HG2      VAL 105  -6.618   8.756  -6.631
  796    H    ASN 106           H        ASN 106  -9.199  12.097  -8.541
  797    HA   ASN 106           HA       ASN 106 -11.970  12.212  -7.794
  798   1HB   ASN 106          2HB       ASN 106 -10.145  13.806  -9.539
  799   2HB   ASN 106          1HB       ASN 106 -11.879  14.007  -9.785
  800   1HD2  ASN 106          1HD2      ASN 106  -9.682  13.697  -6.922
  801   2HD2  ASN 106          2HD2      ASN 106 -10.393  14.977  -6.063
  802    H    LEU 107           H        LEU 107 -10.511  11.854 -11.052
  803    HA   LEU 107           HA       LEU 107 -12.925  11.189 -12.390
  804   1HB   LEU 107          2HB       LEU 107 -10.831  11.766 -13.572
  805   2HB   LEU 107          1HB       LEU 107 -10.101  10.261 -13.013
  806    HG   LEU 107           HG       LEU 107 -12.442   9.362 -14.139
  807   1HD1  LEU 107          1HD1      LEU 107 -12.920  11.636 -15.009
  808   2HD1  LEU 107          2HD1      LEU 107 -12.649  10.482 -16.314
  809   3HD1  LEU 107          3HD1      LEU 107 -11.378  11.619 -15.865
  810   1HD2  LEU 107          1HD2      LEU 107  -9.788   9.779 -15.551
  811   2HD2  LEU 107          2HD2      LEU 107 -11.007   8.572 -15.961
  812   3HD2  LEU 107          3HD2      LEU 107 -10.137   8.463 -14.432
  813    H    ALA 108           H        ALA 108 -10.630   9.186 -10.595
  814    HA   ALA 108           HA       ALA 108 -11.718   6.650 -11.359
  815   1HB   ALA 108          1HB       ALA 108 -10.687   5.957  -9.069
  816   2HB   ALA 108          2HB       ALA 108 -10.086   7.614  -9.018
  817   3HB   ALA 108          3HB       ALA 108  -9.605   6.541 -10.333
  818    H    GLU 109           H        GLU 109 -12.197   8.479  -8.305
  819    HA   GLU 109           HA       GLU 109 -14.300   6.807  -7.352
  820   1HB   GLU 109          2HB       GLU 109 -12.911   9.011  -6.386
  821   2HB   GLU 109          1HB       GLU 109 -14.561   9.610  -6.553
  822   1HG   GLU 109          2HG       GLU 109 -13.882   6.997  -5.182
  823   2HG   GLU 109          1HG       GLU 109 -14.044   8.527  -4.319
  824    H    LYS 110           H        LYS 110 -14.271   9.233  -9.807
  825    HA   LYS 110           HA       LYS 110 -17.149   9.770  -9.651
  826   1HB   LYS 110          2HB       LYS 110 -15.504  11.460 -10.500
  827   2HB   LYS 110          1HB       LYS 110 -15.206  10.415 -11.889
  828   1HG   LYS 110          2HG       LYS 110 -17.011  11.263 -12.924
  829   2HG   LYS 110          1HG       LYS 110 -18.035  10.704 -11.603
  830   1HD   LYS 110          2HD       LYS 110 -17.218  12.815 -10.343
  831   2HD   LYS 110          1HD       LYS 110 -16.692  13.384 -11.928
  832   1HE   LYS 110          2HE       LYS 110 -19.398  13.194 -10.824
  833   2HE   LYS 110          1HE       LYS 110 -18.807  14.146 -12.186
  834   1HZ   LYS 110          1HZ       LYS 110 -19.893  11.430 -12.144
  835   2HZ   LYS 110          2HZ       LYS 110 -18.681  11.779 -13.282
  836   3HZ   LYS 110          3HZ       LYS 110 -20.127  12.672 -13.275
  837    H    PHE 111           H        PHE 111 -15.054   7.488 -11.247
  838    HA   PHE 111           HA       PHE 111 -17.265   6.667 -13.062
  839   1HB   PHE 111          2HB       PHE 111 -14.335   6.477 -13.117
  840   2HB   PHE 111          1HB       PHE 111 -15.142   4.978 -13.580
  841    HD1  PHE 111           HD1      PHE 111 -13.758   7.780 -14.958
  842    HD2  PHE 111           HD2      PHE 111 -17.472   5.622 -15.004
  843    HE1  PHE 111           HE1      PHE 111 -14.297   8.752 -17.176
  844    HE2  PHE 111           HE2      PHE 111 -18.010   6.593 -17.221
  845    HZ   PHE 111           HZ       PHE 111 -16.422   8.159 -18.307
  846    H    ASP 112           H        ASP 112 -14.805   4.666 -11.428
  847    HA   ASP 112           HA       ASP 112 -16.273   3.432  -9.443
  848   1HB   ASP 112          2HB       ASP 112 -17.240   2.672 -12.131
  849   2HB   ASP 112          1HB       ASP 112 -16.924   1.317 -11.048
  850    H    ILE 113           H        ILE 113 -13.551   3.876 -10.307
  851    HA   ILE 113           HA       ILE 113 -12.561   1.051 -10.329
  852    HB   ILE 113           HB       ILE 113 -10.512   1.941 -11.436
  853   1HG1  ILE 113          2HG1      ILE 113 -12.136   4.505 -11.484
  854   2HG1  ILE 113          1HG1      ILE 113 -10.622   4.245 -10.617
  855   1HG2  ILE 113          1HG2      ILE 113 -12.774   1.206 -12.619
  856   2HG2  ILE 113          2HG2      ILE 113 -11.439   1.872 -13.560
  857   3HG2  ILE 113          3HG2      ILE 113 -12.802   2.898 -13.113
  858   1HD1  ILE 113          1HD1      ILE 113 -11.060   4.341 -13.606
  859   2HD1  ILE 113          2HD1      ILE 113  -9.593   3.669 -12.893
  860   3HD1  ILE 113          3HD1      ILE 113 -10.006   5.363 -12.629
  861    H    ILE 114           H        ILE 114 -10.226   1.003  -9.339
  862    HA   ILE 114           HA       ILE 114 -10.278   2.702  -6.876
  863    HB   ILE 114           HB       ILE 114 -10.554   0.277  -6.450
  864   1HG1  ILE 114          2HG1      ILE 114  -7.943   1.567  -5.618
  865   2HG1  ILE 114          1HG1      ILE 114  -9.455   1.517  -4.712
  866   1HG2  ILE 114          1HG2      ILE 114  -8.982  -1.325  -7.152
  867   2HG2  ILE 114          2HG2      ILE 114  -7.743  -0.109  -7.463
  868   3HG2  ILE 114          3HG2      ILE 114  -9.118  -0.267  -8.556
  869   1HD1  ILE 114          1HD1      ILE 114  -9.257  -0.950  -4.550
  870   2HD1  ILE 114          2HD1      ILE 114  -7.881  -0.133  -3.809
  871   3HD1  ILE 114          3HD1      ILE 114  -7.716  -0.871  -5.403
  872    H    TYR 115           H        TYR 115  -8.496   3.953  -6.453
  873    HA   TYR 115           HA       TYR 115  -6.239   3.748  -8.396
  874   1HB   TYR 115          2HB       TYR 115  -7.108   5.934  -8.539
  875   2HB   TYR 115          1HB       TYR 115  -7.389   6.032  -6.800
  876    HD1  TYR 115           HD1      TYR 115  -4.722   5.886  -9.397
  877    HD2  TYR 115           HD2      TYR 115  -5.708   6.820  -5.322
  878    HE1  TYR 115           HE1      TYR 115  -2.479   6.897  -9.086
  879    HE2  TYR 115           HE2      TYR 115  -3.465   7.829  -5.011
  880    HH   TYR 115           HH       TYR 115  -1.673   8.751  -6.276
  881    H    ASP 116           H        ASP 116  -5.084   2.107  -7.244
  882    HA   ASP 116           HA       ASP 116  -3.638   3.151  -4.877
  883   1HB   ASP 116          2HB       ASP 116  -5.593   1.823  -4.035
  884   2HB   ASP 116          1HB       ASP 116  -4.953   0.419  -4.891
  885    H    GLY 117           H        GLY 117  -1.975   3.235  -6.636
  886   1HA   GLY 117          2HA       GLY 117  -0.086   1.174  -6.471
  887   2HA   GLY 117          1HA       GLY 117  -1.057   0.805  -7.895
  888    H    TRP 118           H        TRP 118   0.510   3.693  -6.446
  889    HA   TRP 118           HA       TRP 118   1.337   4.442  -9.219
  890   1HB   TRP 118          2HB       TRP 118   0.974   6.654  -8.720
  891   2HB   TRP 118          1HB       TRP 118  -0.154   5.961  -7.557
  892    HD1  TRP 118           HD1      TRP 118   0.385   6.212  -5.029
  893    HE1  TRP 118           HE1      TRP 118   2.229   7.438  -3.709
  894    HE3  TRP 118           HE3      TRP 118   3.589   7.349  -8.839
  895    HZ2  TRP 118           HZ2      TRP 118   4.735   8.731  -4.205
  896    HZ3  TRP 118           HZ3      TRP 118   5.693   8.576  -8.390
  897    HH2  TRP 118           HH2      TRP 118   6.270   9.267  -6.079
  898    H    GLY 119           H        GLY 119   3.502   5.599  -9.290
  899   1HA   GLY 119          2HA       GLY 119   5.404   5.638  -7.248
  900   2HA   GLY 119          1HA       GLY 119   5.486   4.005  -7.910
  901    H    THR 120           H        THR 120   7.626   5.878  -8.084
  902    HA   THR 120           HA       THR 120   7.638   6.474 -11.017
  903    HB   THR 120           HB       THR 120   7.911   8.554  -9.931
  904    HG1  THR 120           HG1      THR 120  10.199   8.968 -10.162
  905   1HG2  THR 120          1HG2      THR 120   8.320   8.516  -7.719
  906   2HG2  THR 120          2HG2      THR 120  10.024   8.271  -8.102
  907   3HG2  THR 120          3HG2      THR 120   8.975   6.881  -7.817
  908    H    TYR 121           H        TYR 121   9.895   6.297 -11.987
  909    HA   TYR 121           HA       TYR 121  11.460   4.139 -10.629
  910   1HB   TYR 121          2HB       TYR 121   9.994   3.803 -12.951
  911   2HB   TYR 121          1HB       TYR 121  11.614   4.146 -13.562
  912    HD1  TYR 121           HD1      TYR 121  13.543   2.731 -12.879
  913    HD2  TYR 121           HD2      TYR 121   9.512   1.770 -11.747
  914    HE1  TYR 121           HE1      TYR 121  14.257   0.431 -12.289
  915    HE2  TYR 121           HE2      TYR 121  10.227  -0.530 -11.156
  916    HH   TYR 121           HH       TYR 121  12.017  -2.088 -11.672
  917    H    TYR 122           H        TYR 122  13.763   4.129 -11.225
  918    HA   TYR 122           HA       TYR 122  14.899   6.759 -11.248
  919   1HB   TYR 122          2HB       TYR 122  15.952   3.971 -11.433
  920   2HB   TYR 122          1HB       TYR 122  17.019   5.283 -11.932
  921    HD1  TYR 122           HD1      TYR 122  15.912   3.380  -9.179
  922    HD2  TYR 122           HD2      TYR 122  17.041   7.377 -10.280
  923    HE1  TYR 122           HE1      TYR 122  16.382   3.903  -6.801
  924    HE2  TYR 122           HE2      TYR 122  17.510   7.899  -7.901
  925    HH   TYR 122           HH       TYR 122  16.468   5.973  -5.358
  926    H    GLU 123           H        GLU 123  13.732   7.586 -13.196
  927    HA   GLU 123           HA       GLU 123  13.544   7.978 -15.523
  928   1HB   GLU 123          2HB       GLU 123  15.725   9.067 -14.689
  929   2HB   GLU 123          1HB       GLU 123  16.550   7.708 -15.452
  930   1HG   GLU 123          2HG       GLU 123  15.824   8.312 -17.607
  931   2HG   GLU 123          1HG       GLU 123  14.518   9.320 -16.981
  932    H    GLY 124           H        GLY 124  12.891   5.406 -15.278
  933   1HA   GLY 124          2HA       GLY 124  12.869   3.345 -16.401
  934   2HA   GLY 124          1HA       GLY 124  13.616   4.212 -17.744
  935    H    LEU 125           H        LEU 125  14.124   1.510 -16.274
  936    HA   LEU 125           HA       LEU 125  16.953   1.438 -16.745
  937   1HB   LEU 125          2HB       LEU 125  16.867   2.753 -14.582
  938   2HB   LEU 125          1HB       LEU 125  16.180   1.319 -13.817
  939    HG   LEU 125           HG       LEU 125  18.232   0.075 -14.819
  940   1HD1  LEU 125          1HD1      LEU 125  18.698   2.666 -15.825
  941   2HD1  LEU 125          2HD1      LEU 125  19.805   1.294 -15.878
  942   3HD1  LEU 125          3HD1      LEU 125  19.887   2.440 -14.542
  943   1HD2  LEU 125          1HD2      LEU 125  18.088   0.283 -12.460
  944   2HD2  LEU 125          2HD2      LEU 125  18.297   2.033 -12.518
  945   3HD2  LEU 125          3HD2      LEU 125  19.662   0.969 -12.860
  946    H    GLU 126           H        GLU 126  17.194  -0.636 -17.414
  947    HA   GLU 126           HA       GLU 126  15.923  -2.802 -15.827
  948   1HB   GLU 126          2HB       GLU 126  15.236  -2.018 -18.589
  949   2HB   GLU 126          1HB       GLU 126  15.566  -3.738 -18.378
  950   1HG   GLU 126          2HG       GLU 126  13.806  -2.357 -16.384
  951   2HG   GLU 126          1HG       GLU 126  13.133  -2.785 -17.956
  952    H    HIS 127           H        HIS 127  18.231  -3.025 -15.203
  953    HA   HIS 127           HA       HIS 127  19.547  -5.080 -16.712
  954   1HB   HIS 127          2HB       HIS 127  19.998  -2.890 -18.056
  955   2HB   HIS 127          1HB       HIS 127  21.104  -2.499 -16.739
  956    HD2  HIS 127           HD2      HIS 127  21.808  -5.991 -16.621
  957    HE1  HIS 127           HE1      HIS 127  23.858  -4.908 -20.152
  958    HE2  HIS 127           HE2      HIS 127  23.611  -6.696 -18.369
  959    H    HIS 128           H        HIS 128  19.110  -5.526 -14.282
  960    HA   HIS 128           HA       HIS 128  21.621  -4.903 -12.809
  961   1HB   HIS 128          2HB       HIS 128  18.958  -3.974 -12.139
  962   2HB   HIS 128          1HB       HIS 128  19.580  -5.022 -10.865
  963    HD2  HIS 128           HD2      HIS 128  21.112  -1.931 -12.894
  964    HE1  HIS 128           HE1      HIS 128  22.457  -1.798  -8.892
  965    HE2  HIS 128           HE2      HIS 128  22.536  -0.626 -11.140
  966    H    HIS 129           H        HIS 129  21.086  -6.297 -10.489
  967    HA   HIS 129           HA       HIS 129  20.920  -9.076 -11.525
  968   1HB   HIS 129          2HB       HIS 129  21.935  -9.700  -9.358
  969   2HB   HIS 129          1HB       HIS 129  22.902  -8.477 -10.183
  970    HD2  HIS 129           HD2      HIS 129  22.622  -8.781  -6.755
  971    HE1  HIS 129           HE1      HIS 129  20.897  -4.949  -7.162
  972    HE2  HIS 129           HE2      HIS 129  21.937  -6.585  -5.527
  973    H    HIS 130           H        HIS 130  20.251 -10.211  -8.934
  974    HA   HIS 130           HA       HIS 130  17.731  -9.096  -8.029
  975   1HB   HIS 130          2HB       HIS 130  16.898  -9.961 -10.134
  976   2HB   HIS 130          1HB       HIS 130  17.689 -11.512  -9.859
  977    HD2  HIS 130           HD2      HIS 130  15.613  -9.779  -6.985
  978    HE1  HIS 130           HE1      HIS 130  13.572 -13.276  -8.181
  979    HE2  HIS 130           HE2      HIS 130  13.620 -11.386  -6.491
  980    H    HIS 131           H        HIS 131  20.401 -11.005  -7.656
  981    HA   HIS 131           HA       HIS 131  19.256 -12.999  -5.841
  982   1HB   HIS 131          2HB       HIS 131  22.026 -12.253  -6.734
  983   2HB   HIS 131          1HB       HIS 131  21.820 -13.258  -5.300
  984    HD2  HIS 131           HD2      HIS 131  20.373 -15.760  -5.847
  985    HE1  HIS 131           HE1      HIS 131  21.164 -15.621  -9.993
  986    HE2  HIS 131           HE2      HIS 131  20.340 -17.086  -8.094
  987    H    HIS 132           HN       HIS 132  18.241 -11.814  -4.178
  988    HA   HIS 132           HA       HIS 132  19.945  -9.929  -2.628
  989   1HB   HIS 132          2HB       HIS 132  17.969  -8.995  -1.781
  990   2HB   HIS 132          1HB       HIS 132  17.492  -9.448  -3.417
  991    HD2  HIS 132           HD2      HIS 132  16.333 -10.101   0.156
  992    HE1  HIS 132           HE1      HIS 132  14.658 -13.199  -2.175
  993    HE2  HIS 132           HE2      HIS 132  14.612 -12.059   0.092
  Start of MODEL    9
    1   1H    MET   1          1H        MET   1 -29.786   9.211   0.644
    2   2H    MET   1          2H        MET   1 -28.905  10.602   1.061
    3   3H    MET   1          3H        MET   1 -29.813   9.783   2.241
    4    HA   MET   1           HA       MET   1 -27.879   8.111   0.919
    5   1HB   MET   1          2HB       MET   1 -26.667  10.290   0.963
    6   2HB   MET   1          1HB       MET   1 -26.942  10.378   2.703
    7   1HG   MET   1          2HG       MET   1 -24.917   9.329   2.811
    8   2HG   MET   1          1HG       MET   1 -25.880   7.883   2.505
    9   1HE   MET   1          1HE       MET   1 -23.298  10.353  -0.271
   10   2HE   MET   1          2HE       MET   1 -22.625   9.609   1.177
   11   3HE   MET   1          3HE       MET   1 -23.973  10.734   1.318
   12    H    SER   2           H        SER   2 -29.127   6.542   2.073
   13    HA   SER   2           HA       SER   2 -29.859   6.662   4.799
   14   1HB   SER   2          2HB       SER   2 -28.936   4.055   3.662
   15   2HB   SER   2          1HB       SER   2 -30.379   4.415   4.605
   16    HG   SER   2           HG       SER   2 -30.947   5.724   2.631
   17    H    HIS   3           H        HIS   3 -28.431   4.146   5.631
   18    HA   HIS   3           HA       HIS   3 -25.936   5.492   6.549
   19   1HB   HIS   3          2HB       HIS   3 -27.835   4.264   8.042
   20   2HB   HIS   3          1HB       HIS   3 -26.756   2.901   7.744
   21    HD2  HIS   3           HD2      HIS   3 -24.580   2.865   9.451
   22    HE1  HIS   3           HE1      HIS   3 -24.698   6.913  10.651
   23    HE2  HIS   3           HE2      HIS   3 -23.527   4.688  10.991
   24    H    GLN   4           H        GLN   4 -23.940   4.602   6.082
   25    HA   GLN   4           HA       GLN   4 -23.957   2.272   4.223
   26   1HB   GLN   4          2HB       GLN   4 -22.420   4.743   4.404
   27   2HB   GLN   4          1HB       GLN   4 -21.370   3.329   4.297
   28   1HG   GLN   4          2HG       GLN   4 -23.724   3.734   2.442
   29   2HG   GLN   4          1HG       GLN   4 -22.112   4.348   2.070
   30   1HE2  GLN   4          1HE2      GLN   4 -23.987   1.363   2.570
   31   2HE2  GLN   4          2HE2      GLN   4 -22.840   0.327   1.870
   32    H    ASP   5           H        ASP   5 -21.266   3.384   6.230
   33    HA   ASP   5           HA       ASP   5 -21.427   1.497   8.325
   34   1HB   ASP   5          2HB       ASP   5 -19.437   0.054   7.119
   35   2HB   ASP   5          1HB       ASP   5 -21.133  -0.435   7.151
   36    H    ASP   6           H        ASP   6 -18.709   2.119   6.077
   37    HA   ASP   6           HA       ASP   6 -17.082   3.063   8.337
   38   1HB   ASP   6          2HB       ASP   6 -16.576   2.545   5.413
   39   2HB   ASP   6          1HB       ASP   6 -15.410   3.461   6.370
   40    H    TYR   7           H        TYR   7 -16.607   5.200   8.764
   41    HA   TYR   7           HA       TYR   7 -18.147   7.226   7.280
   42   1HB   TYR   7          2HB       TYR   7 -16.265   7.643   9.618
   43   2HB   TYR   7          1HB       TYR   7 -17.528   8.737   9.054
   44    HD1  TYR   7           HD1      TYR   7 -19.950   7.619   8.891
   45    HD2  TYR   7           HD2      TYR   7 -16.757   6.241  11.412
   46    HE1  TYR   7           HE1      TYR   7 -21.597   6.473  10.348
   47    HE2  TYR   7           HE2      TYR   7 -18.404   5.095  12.870
   48    HH   TYR   7           HH       TYR   7 -21.669   5.721  12.802
   49    H    LEU   8           H        LEU   8 -17.261   8.673   5.854
   50    HA   LEU   8           HA       LEU   8 -15.656   9.658   4.455
   51   1HB   LEU   8          2HB       LEU   8 -13.754   9.081   6.745
   52   2HB   LEU   8          1HB       LEU   8 -13.552  10.293   5.478
   53    HG   LEU   8           HG       LEU   8 -16.050  10.399   7.110
   54   1HD1  LEU   8          1HD1      LEU   8 -13.370  11.436   8.084
   55   2HD1  LEU   8          2HD1      LEU   8 -14.227  10.057   8.772
   56   3HD1  LEU   8          3HD1      LEU   8 -14.928  11.671   8.877
   57   1HD2  LEU   8          1HD2      LEU   8 -15.329  11.911   5.124
   58   2HD2  LEU   8          2HD2      LEU   8 -14.214  12.645   6.278
   59   3HD2  LEU   8          3HD2      LEU   8 -15.953  12.698   6.574
   60    H    SER   9           H        SER   9 -13.568   9.141   3.274
   61    HA   SER   9           HA       SER   9 -12.350   6.550   3.499
   62   1HB   SER   9          2HB       SER   9 -13.653   6.330   0.954
   63   2HB   SER   9          1HB       SER   9 -13.749   5.234   2.329
   64    HG   SER   9           HG       SER   9 -15.238   7.640   2.079
   65    H    VAL  10           H        VAL  10 -13.388   8.319   0.576
   66    HA   VAL  10           HA       VAL  10 -11.030   8.282  -0.844
   67    HB   VAL  10           HB       VAL  10 -12.876  10.671  -0.534
   68   1HG1  VAL  10          1HG1      VAL  10 -10.824   9.953  -2.647
   69   2HG1  VAL  10          2HG1      VAL  10 -10.785  11.348  -1.570
   70   3HG1  VAL  10          3HG1      VAL  10 -12.020  11.237  -2.824
   71   1HG2  VAL  10          1HG2      VAL  10 -14.349   9.548  -1.828
   72   2HG2  VAL  10          2HG2      VAL  10 -13.380   8.102  -1.539
   73   3HG2  VAL  10          3HG2      VAL  10 -13.086   9.090  -2.971
   74    H    GLU  11           H        GLU  11 -11.687  10.115   2.063
   75    HA   GLU  11           HA       GLU  11  -9.375  11.861   1.826
   76   1HB   GLU  11          2HB       GLU  11 -11.428  12.318   3.244
   77   2HB   GLU  11          1HB       GLU  11 -10.843  11.084   4.360
   78   1HG   GLU  11          2HG       GLU  11  -9.809  12.885   5.331
   79   2HG   GLU  11          1HG       GLU  11  -8.589  12.545   4.103
   80    H    GLU  12           H        GLU  12  -9.990   8.670   3.165
   81    HA   GLU  12           HA       GLU  12  -7.567   8.483   4.714
   82   1HB   GLU  12          2HB       GLU  12  -9.098   6.208   3.424
   83   2HB   GLU  12          1HB       GLU  12  -8.040   6.117   4.833
   84   1HG   GLU  12          2HG       GLU  12 -10.256   8.078   5.020
   85   2HG   GLU  12          1HG       GLU  12 -10.735   6.380   5.016
   86    H    LEU  13           H        LEU  13  -8.418   7.500   1.397
   87    HA   LEU  13           HA       LEU  13  -5.893   6.310   0.770
   88   1HB   LEU  13          2HB       LEU  13  -7.772   7.721  -1.147
   89   2HB   LEU  13          1HB       LEU  13  -6.591   6.471  -1.544
   90    HG   LEU  13           HG       LEU  13  -8.875   6.026   0.392
   91   1HD1  LEU  13          1HD1      LEU  13  -9.514   6.594  -2.055
   92   2HD1  LEU  13          2HD1      LEU  13 -10.167   5.111  -1.360
   93   3HD1  LEU  13          3HD1      LEU  13  -8.789   5.037  -2.457
   94   1HD2  LEU  13          1HD2      LEU  13  -8.295   3.603  -0.423
   95   2HD2  LEU  13          2HD2      LEU  13  -7.248   4.374   0.769
   96   3HD2  LEU  13          3HD2      LEU  13  -6.767   4.325  -0.927
   97    H    ILE  14           H        ILE  14  -7.128   9.508  -0.289
   98    HA   ILE  14           HA       ILE  14  -4.739  10.528  -1.319
   99    HB   ILE  14           HB       ILE  14  -7.018  11.887   0.125
  100   1HG1  ILE  14          2HG1      ILE  14  -6.199  12.217  -2.753
  101   2HG1  ILE  14          1HG1      ILE  14  -7.108  10.788  -2.258
  102   1HG2  ILE  14          1HG2      ILE  14  -4.399  12.977  -0.775
  103   2HG2  ILE  14          2HG2      ILE  14  -5.477  13.547   0.499
  104   3HG2  ILE  14          3HG2      ILE  14  -5.830  13.922  -1.188
  105   1HD1  ILE  14          1HD1      ILE  14  -8.803  12.331  -1.202
  106   2HD1  ILE  14          2HD1      ILE  14  -8.704  12.461  -2.959
  107   3HD1  ILE  14          3HD1      ILE  14  -7.942  13.683  -1.940
  108    H    GLU  15           H        GLU  15  -5.904  10.869   2.049
  109    HA   GLU  15           HA       GLU  15  -3.822  12.297   3.180
  110   1HB   GLU  15          2HB       GLU  15  -5.432   9.978   4.231
  111   2HB   GLU  15          1HB       GLU  15  -4.191  10.735   5.228
  112   1HG   GLU  15          2HG       GLU  15  -6.105  12.555   3.849
  113   2HG   GLU  15          1HG       GLU  15  -6.737  11.608   5.194
  114    H    ILE  16           H        ILE  16  -3.845   8.709   3.191
  115    HA   ILE  16           HA       ILE  16  -1.104   8.450   3.897
  116    HB   ILE  16           HB       ILE  16  -2.799   6.533   2.265
  117   1HG1  ILE  16          2HG1      ILE  16  -2.335   6.683   5.262
  118   2HG1  ILE  16          1HG1      ILE  16  -3.807   7.215   4.450
  119   1HG2  ILE  16          1HG2      ILE  16  -0.724   5.548   4.126
  120   2HG2  ILE  16          2HG2      ILE  16  -0.102   6.413   2.721
  121   3HG2  ILE  16          3HG2      ILE  16  -1.130   4.999   2.500
  122   1HD1  ILE  16          1HD1      ILE  16  -4.193   4.970   5.249
  123   2HD1  ILE  16          2HD1      ILE  16  -2.683   4.403   4.537
  124   3HD1  ILE  16          3HD1      ILE  16  -4.021   4.887   3.496
  125    H    GLN  17           H        GLN  17  -2.551   7.956   0.649
  126    HA   GLN  17           HA       GLN  17  -0.357   7.619  -0.926
  127   1HB   GLN  17          2HB       GLN  17  -2.802   9.312  -1.337
  128   2HB   GLN  17          1HB       GLN  17  -1.525   9.331  -2.555
  129   1HG   GLN  17          2HG       GLN  17  -1.809   7.081  -3.087
  130   2HG   GLN  17          1HG       GLN  17  -2.521   6.696  -1.519
  131   1HE2  GLN  17          1HE2      GLN  17  -4.445   5.747  -2.524
  132   2HE2  GLN  17          2HE2      GLN  17  -5.616   6.722  -3.274
  133    H    LYS  18           H        LYS  18  -1.245  10.648   0.675
  134    HA   LYS  18           HA       LYS  18   0.824  12.220  -0.612
  135   1HB   LYS  18          2HB       LYS  18  -0.931  12.605   1.808
  136   2HB   LYS  18          1HB       LYS  18   0.380  13.733   1.464
  137   1HG   LYS  18          2HG       LYS  18  -0.578  14.422  -0.571
  138   2HG   LYS  18          1HG       LYS  18  -1.600  12.988  -0.681
  139   1HD   LYS  18          2HD       LYS  18  -3.071  13.767   1.005
  140   2HD   LYS  18          1HD       LYS  18  -1.918  14.979   1.566
  141   1HE   LYS  18          2HE       LYS  18  -2.158  16.199  -0.566
  142   2HE   LYS  18          1HE       LYS  18  -3.311  14.989  -1.129
  143   1HZ   LYS  18          1HZ       LYS  18  -4.891  16.155  -0.134
  144   2HZ   LYS  18          2HZ       LYS  18  -3.758  17.227   0.539
  145   3HZ   LYS  18          3HZ       LYS  18  -4.182  15.805   1.366
  146    H    GLU  19           H        GLU  19   0.565  11.300   2.844
  147    HA   GLU  19           HA       GLU  19   3.129  11.800   3.688
  148   1HB   GLU  19          2HB       GLU  19   1.332   9.451   4.301
  149   2HB   GLU  19          1HB       GLU  19   2.901   9.635   5.086
  150   1HG   GLU  19          2HG       GLU  19   2.148  11.291   6.429
  151   2HG   GLU  19          1HG       GLU  19   1.339  12.111   5.093
  152    H    GLU  20           H        GLU  20   2.095   9.105   1.644
  153    HA   GLU  20           HA       GLU  20   4.619   7.718   1.666
  154   1HB   GLU  20          2HB       GLU  20   2.240   7.716  -0.192
  155   2HB   GLU  20          1HB       GLU  20   3.691   6.785  -0.568
  156   1HG   GLU  20          2HG       GLU  20   2.355   6.555   2.126
  157   2HG   GLU  20          1HG       GLU  20   1.807   5.593   0.752
  158    H    THR  21           H        THR  21   3.154   9.600  -1.013
  159    HA   THR  21           HA       THR  21   5.275   9.856  -2.718
  160    HB   THR  21           HB       THR  21   3.625  12.240  -1.826
  161    HG1  THR  21           HG1      THR  21   2.013  11.395  -2.888
  162   1HG2  THR  21          1HG2      THR  21   5.527  11.699  -3.995
  163   2HG2  THR  21          2HG2      THR  21   4.938  13.240  -3.375
  164   3HG2  THR  21          3HG2      THR  21   3.985  12.343  -4.557
  165    H    ARG  22           H        ARG  22   4.837  11.792   0.250
  166    HA   ARG  22           HA       ARG  22   7.218  13.330   0.004
  167   1HB   ARG  22          2HB       ARG  22   5.471  12.492   2.294
  168   2HB   ARG  22          1HB       ARG  22   7.028  13.246   2.643
  169   1HG   ARG  22          2HG       ARG  22   6.386  15.119   1.091
  170   2HG   ARG  22          1HG       ARG  22   4.779  14.399   0.974
  171   1HD   ARG  22          2HD       ARG  22   5.285  14.486   3.714
  172   2HD   ARG  22          1HD       ARG  22   5.930  16.013   3.116
  173    HE   ARG  22           HE       ARG  22   3.217  15.576   3.536
  174   1HH1  ARG  22          1HH2      ARG  22   5.235  16.285   0.823
  175   2HH1  ARG  22          2HH2      ARG  22   3.967  17.036  -0.084
  176   1HH2  ARG  22          2HH1      ARG  22   1.564  16.554   2.365
  177   2HH2  ARG  22          1HH1      ARG  22   1.892  17.190   0.788
  178    H    ASP  23           H        ASP  23   6.642  10.127   1.437
  179    HA   ASP  23           HA       ASP  23   9.248   9.748   2.529
  180   1HB   ASP  23          2HB       ASP  23   7.453   8.230   3.119
  181   2HB   ASP  23          1HB       ASP  23   7.248   7.749   1.435
  182    H    ILE  24           H        ILE  24   7.924   8.964  -0.689
  183    HA   ILE  24           HA       ILE  24  10.358   7.808  -1.696
  184    HB   ILE  24           HB       ILE  24   8.128   9.166  -3.242
  185   1HG1  ILE  24          2HG1      ILE  24   8.470   6.225  -2.585
  186   2HG1  ILE  24          1HG1      ILE  24   7.418   7.307  -1.672
  187   1HG2  ILE  24          1HG2      ILE  24  10.587   7.736  -3.979
  188   2HG2  ILE  24          2HG2      ILE  24   9.555   8.777  -4.961
  189   3HG2  ILE  24          3HG2      ILE  24   9.140   7.077  -4.741
  190   1HD1  ILE  24          1HD1      ILE  24   6.740   7.795  -4.334
  191   2HD1  ILE  24          2HD1      ILE  24   5.810   6.833  -3.184
  192   3HD1  ILE  24          3HD1      ILE  24   6.965   6.047  -4.262
  193    H    ILE  25           H        ILE  25   8.881  10.957  -2.564
  194    HA   ILE  25           HA       ILE  25  11.044  12.091  -3.891
  195    HB   ILE  25           HB       ILE  25   8.839  13.211  -2.209
  196   1HG1  ILE  25          2HG1      ILE  25   8.467  14.464  -4.369
  197   2HG1  ILE  25          1HG1      ILE  25   9.833  13.580  -5.050
  198   1HG2  ILE  25          1HG2      ILE  25  10.579  14.670  -1.479
  199   2HG2  ILE  25          2HG2      ILE  25   9.766  15.529  -2.788
  200   3HG2  ILE  25          3HG2      ILE  25  11.307  14.724  -3.085
  201   1HD1  ILE  25          1HD1      ILE  25   7.838  11.877  -3.702
  202   2HD1  ILE  25          2HD1      ILE  25   8.642  11.656  -5.257
  203   3HD1  ILE  25          3HD1      ILE  25   7.234  12.711  -5.134
  204    H    GLN  26           H        GLN  26  10.558  11.810  -0.389
  205    HA   GLN  26           HA       GLN  26  12.774  13.411   0.424
  206   1HB   GLN  26          2HB       GLN  26  11.392  11.049   1.715
  207   2HB   GLN  26          1HB       GLN  26  12.697  11.934   2.507
  208   1HG   GLN  26          2HG       GLN  26  10.544  13.613   1.364
  209   2HG   GLN  26          1HG       GLN  26  10.073  12.611   2.738
  210   1HE2  GLN  26          1HE2      GLN  26  13.419  13.629   2.514
  211   2HE2  GLN  26          2HE2      GLN  26  13.352  14.784   3.756
  212    H    ALA  27           H        ALA  27  12.543   9.940  -0.347
  213    HA   ALA  27           HA       ALA  27  15.273   9.323   0.279
  214   1HB   ALA  27          1HB       ALA  27  13.066   7.865  -0.498
  215   2HB   ALA  27          2HB       ALA  27  14.705   7.224  -0.373
  216   3HB   ALA  27          3HB       ALA  27  14.092   7.782  -1.930
  217    H    LEU  28           H        LEU  28  13.691  10.047  -2.852
  218    HA   LEU  28           HA       LEU  28  15.993   9.930  -4.474
  219   1HB   LEU  28          2HB       LEU  28  13.634  11.823  -4.713
  220   2HB   LEU  28          1HB       LEU  28  14.790  11.468  -5.997
  221    HG   LEU  28           HG       LEU  28  13.348   9.210  -4.638
  222   1HD1  LEU  28          1HD1      LEU  28  11.378  10.145  -5.289
  223   2HD1  LEU  28          2HD1      LEU  28  11.872   9.641  -6.905
  224   3HD1  LEU  28          3HD1      LEU  28  12.171  11.294  -6.367
  225   1HD2  LEU  28          1HD2      LEU  28  13.936   8.017  -6.562
  226   2HD2  LEU  28          2HD2      LEU  28  15.309   9.111  -6.392
  227   3HD2  LEU  28          3HD2      LEU  28  14.033   9.472  -7.555
  228    H    LEU  29           H        LEU  29  14.567  12.938  -3.124
  229    HA   LEU  29           HA       LEU  29  16.667  14.674  -3.740
  230   1HB   LEU  29          2HB       LEU  29  14.589  14.572  -1.617
  231   2HB   LEU  29          1HB       LEU  29  15.965  15.632  -1.304
  232    HG   LEU  29           HG       LEU  29  14.128  16.817  -2.490
  233   1HD1  LEU  29          1HD1      LEU  29  15.694  18.067  -3.532
  234   2HD1  LEU  29          2HD1      LEU  29  16.086  16.763  -4.653
  235   3HD1  LEU  29          3HD1      LEU  29  16.857  16.825  -3.069
  236   1HD2  LEU  29          1HD2      LEU  29  13.487  16.189  -4.717
  237   2HD2  LEU  29          2HD2      LEU  29  13.409  14.719  -3.748
  238   3HD2  LEU  29          3HD2      LEU  29  14.781  14.996  -4.821
  239    H    GLU  30           H        GLU  30  16.325  12.687  -0.787
  240    HA   GLU  30           HA       GLU  30  18.721  13.395   0.493
  241   1HB   GLU  30          2HB       GLU  30  17.295  11.962   1.708
  242   2HB   GLU  30          1HB       GLU  30  17.161  10.817   0.374
  243   1HG   GLU  30          2HG       GLU  30  18.637  10.000   2.226
  244   2HG   GLU  30          1HG       GLU  30  19.472  10.117   0.677
  245    H    ASP  31           H        ASP  31  18.196  11.036  -2.117
  246    HA   ASP  31           HA       ASP  31  20.849   9.995  -2.195
  247   1HB   ASP  31          2HB       ASP  31  18.514  10.057  -4.010
  248   2HB   ASP  31          1HB       ASP  31  20.075   9.870  -4.808
  249    H    GLY  32           H        GLY  32  19.372  12.692  -4.025
  250   1HA   GLY  32          2HA       GLY  32  20.990  14.708  -4.084
  251   2HA   GLY  32          1HA       GLY  32  22.138  13.553  -4.760
  252    H    SER  33           H        SER  33  18.898  12.993  -5.709
  253    HA   SER  33           HA       SER  33  19.533  13.591  -8.480
  254   1HB   SER  33          2HB       SER  33  16.758  13.281  -8.286
  255   2HB   SER  33          1HB       SER  33  17.925  12.021  -8.676
  256    HG   SER  33           HG       SER  33  16.401  11.873  -6.715
  257    H    ASP  34           H        ASP  34  18.115  15.081  -9.804
  258    HA   ASP  34           HA       ASP  34  17.163  17.417  -8.205
  259   1HB   ASP  34          2HB       ASP  34  18.261  18.233 -10.758
  260   2HB   ASP  34          1HB       ASP  34  18.683  18.793  -9.140
  261    HA   PRO  35           HA       PRO  35  13.590  17.239 -10.774
  262   1HB   PRO  35          2HB       PRO  35  12.912  19.896 -10.909
  263   2HB   PRO  35          1HB       PRO  35  12.654  18.889  -9.472
  264   1HG   PRO  35          2HG       PRO  35  14.792  20.872 -10.035
  265   2HG   PRO  35          1HG       PRO  35  13.960  20.503  -8.515
  266   1HD   PRO  35          2HD       PRO  35  16.488  19.602  -9.113
  267   2HD   PRO  35          1HD       PRO  35  15.380  18.757  -8.010
  268    H    ASP  36           H        ASP  36  16.454  18.356 -11.929
  269    HA   ASP  36           HA       ASP  36  15.400  19.511 -14.441
  270   1HB   ASP  36          2HB       ASP  36  18.258  18.991 -13.562
  271   2HB   ASP  36          1HB       ASP  36  17.767  19.900 -14.991
  272    H    ALA  37           H        ALA  37  16.043  16.455 -13.212
  273    HA   ALA  37           HA       ALA  37  16.860  15.357 -15.853
  274   1HB   ALA  37          1HB       ALA  37  17.340  14.614 -13.112
  275   2HB   ALA  37          2HB       ALA  37  18.058  13.943 -14.576
  276   3HB   ALA  37          3HB       ALA  37  16.550  13.277 -13.949
  277    H    LEU  38           H        LEU  38  14.051  16.303 -14.700
  278    HA   LEU  38           HA       LEU  38  11.819  15.630 -14.997
  279   1HB   LEU  38          2HB       LEU  38  13.360  14.414 -17.234
  280   2HB   LEU  38          1HB       LEU  38  11.741  13.771 -16.955
  281    HG   LEU  38           HG       LEU  38  11.708  15.668 -18.551
  282   1HD1  LEU  38          1HD1      LEU  38   9.716  16.391 -17.721
  283   2HD1  LEU  38          2HD1      LEU  38  10.436  16.912 -16.198
  284   3HD1  LEU  38          3HD1      LEU  38  10.016  15.217 -16.440
  285   1HD2  LEU  38          1HD2      LEU  38  12.699  17.277 -16.176
  286   2HD2  LEU  38          2HD2      LEU  38  12.275  17.918 -17.763
  287   3HD2  LEU  38          3HD2      LEU  38  13.673  16.858 -17.584
  288    H    TYR  39           H        TYR  39  10.376  13.570 -15.008
  289    HA   TYR  39           HA       TYR  39  11.653  11.182 -13.856
  290   1HB   TYR  39          2HB       TYR  39  10.307  13.213 -12.217
  291   2HB   TYR  39          1HB       TYR  39   9.645  11.592 -11.999
  292    HD1  TYR  39           HD1      TYR  39  12.708  13.661 -11.780
  293    HD2  TYR  39           HD2      TYR  39  10.948   9.820 -11.004
  294    HE1  TYR  39           HE1      TYR  39  14.670  13.041 -10.396
  295    HE2  TYR  39           HE2      TYR  39  12.910   9.200  -9.620
  296    HH   TYR  39           HH       TYR  39  15.381   9.927  -9.507
  297    H    GLU  40           H        GLU  40  10.230   9.354 -13.910
  298    HA   GLU  40           HA       GLU  40   7.831   9.802 -15.622
  299   1HB   GLU  40          2HB       GLU  40   9.015   7.096 -15.062
  300   2HB   GLU  40          1HB       GLU  40   8.135   7.650 -16.486
  301   1HG   GLU  40          2HG       GLU  40  10.321   7.639 -17.291
  302   2HG   GLU  40          1HG       GLU  40  10.173   9.306 -16.734
  303    H    ILE  41           H        ILE  41   5.907   9.732 -14.588
  304    HA   ILE  41           HA       ILE  41   5.737   8.228 -12.014
  305    HB   ILE  41           HB       ILE  41   4.154  10.540 -13.151
  306   1HG1  ILE  41          2HG1      ILE  41   4.798  11.517 -10.913
  307   2HG1  ILE  41          1HG1      ILE  41   5.789  10.083 -10.638
  308   1HG2  ILE  41          1HG2      ILE  41   2.972  10.217 -10.793
  309   2HG2  ILE  41          2HG2      ILE  41   3.417   8.531 -11.058
  310   3HG2  ILE  41          3HG2      ILE  41   2.386   9.365 -12.221
  311   1HD1  ILE  41          1HD1      ILE  41   6.255  11.310 -13.260
  312   2HD1  ILE  41          2HD1      ILE  41   7.417  10.808 -12.032
  313   3HD1  ILE  41          3HD1      ILE  41   6.637  12.385 -11.916
  314    H    GLU  42           H        GLU  42   4.531   6.380 -11.997
  315    HA   GLU  42           HA       GLU  42   2.694   5.928 -14.316
  316   1HB   GLU  42          2HB       GLU  42   4.655   4.411 -14.282
  317   2HB   GLU  42          1HB       GLU  42   4.192   3.868 -12.669
  318   1HG   GLU  42          2HG       GLU  42   2.290   2.754 -13.442
  319   2HG   GLU  42          1HG       GLU  42   2.193   3.732 -14.907
  320    H    HIS  43           H        HIS  43   0.592   5.409 -13.852
  321    HA   HIS  43           HA       HIS  43  -0.102   5.028 -10.966
  322   1HB   HIS  43          2HB       HIS  43  -1.633   6.393 -13.198
  323   2HB   HIS  43          1HB       HIS  43  -2.349   5.994 -11.635
  324    HD2  HIS  43           HD2      HIS  43  -0.509   8.912 -13.176
  325    HE1  HIS  43           HE1      HIS  43   0.243   9.214  -9.032
  326    HE2  HIS  43           HE2      HIS  43   0.394  10.427 -11.255
  327    H    HIS  44           H        HIS  44  -1.725   3.439 -10.507
  328    HA   HIS  44           HA       HIS  44  -2.245   1.565 -12.782
  329   1HB   HIS  44          2HB       HIS  44  -1.841   0.974  -9.835
  330   2HB   HIS  44          1HB       HIS  44  -2.341  -0.225 -11.028
  331    HD2  HIS  44           HD2      HIS  44  -0.127   1.025 -13.367
  332    HE1  HIS  44           HE1      HIS  44   2.695  -0.406 -10.568
  333    HE2  HIS  44           HE2      HIS  44   2.361   0.351 -12.967
  334    H    LEU  45           H        LEU  45  -4.365   1.126 -13.209
  335    HA   LEU  45           HA       LEU  45  -6.387   1.615 -11.087
  336   1HB   LEU  45          2HB       LEU  45  -7.092   2.553 -13.824
  337   2HB   LEU  45          1HB       LEU  45  -7.577   3.198 -12.254
  338    HG   LEU  45           HG       LEU  45  -5.140   3.952 -11.986
  339   1HD1  LEU  45          1HD1      LEU  45  -4.738   4.199 -14.845
  340   2HD1  LEU  45          2HD1      LEU  45  -4.892   2.502 -14.390
  341   3HD1  LEU  45          3HD1      LEU  45  -3.662   3.512 -13.629
  342   1HD2  LEU  45          1HD2      LEU  45  -5.539   5.995 -13.276
  343   2HD2  LEU  45          2HD2      LEU  45  -7.048   5.469 -12.531
  344   3HD2  LEU  45          3HD2      LEU  45  -6.760   5.172 -14.246
  345    H    PHE  46           H        PHE  46  -7.929   0.024 -11.091
  346    HA   PHE  46           HA       PHE  46  -8.128  -1.679 -13.543
  347   1HB   PHE  46          2HB       PHE  46  -8.845  -3.378 -11.520
  348   2HB   PHE  46          1HB       PHE  46  -7.230  -3.297 -12.220
  349    HD1  PHE  46           HD1      PHE  46  -5.753  -1.259 -11.222
  350    HD2  PHE  46           HD2      PHE  46  -8.992  -3.234  -9.207
  351    HE1  PHE  46           HE1      PHE  46  -4.841  -0.525  -9.036
  352    HE2  PHE  46           HE2      PHE  46  -8.078  -2.502  -7.021
  353    HZ   PHE  46           HZ       PHE  46  -6.003  -1.147  -6.935
  354    H    ALA  47           H        ALA  47 -10.255  -2.845 -13.668
  355    HA   ALA  47           HA       ALA  47 -12.442  -1.644 -12.085
  356   1HB   ALA  47          1HB       ALA  47 -13.361  -0.386 -13.733
  357   2HB   ALA  47          2HB       ALA  47 -13.046  -1.613 -14.961
  358   3HB   ALA  47          3HB       ALA  47 -11.775  -0.481 -14.499
  359    H    GLU  48           H        GLU  48 -14.564  -2.745 -12.659
  360    HA   GLU  48           HA       GLU  48 -14.008  -5.604 -13.294
  361   1HB   GLU  48          2HB       GLU  48 -16.201  -4.223 -11.738
  362   2HB   GLU  48          1HB       GLU  48 -16.331  -5.908 -12.243
  363   1HG   GLU  48          2HG       GLU  48 -14.422  -6.545 -10.963
  364   2HG   GLU  48          1HG       GLU  48 -13.942  -4.866 -10.711
  365    H    ASP  49           H        ASP  49 -16.022  -2.844 -14.184
  366    HA   ASP  49           HA       ASP  49 -17.319  -4.478 -16.305
  367   1HB   ASP  49          2HB       ASP  49 -17.886  -1.699 -15.235
  368   2HB   ASP  49          1HB       ASP  49 -18.732  -2.405 -16.613
  369    H    PHE  50           H        PHE  50 -16.087  -4.558 -18.130
  370    HA   PHE  50           HA       PHE  50 -14.005  -2.846 -18.878
  371   1HB   PHE  50          2HB       PHE  50 -15.414  -3.654 -21.252
  372   2HB   PHE  50          1HB       PHE  50 -13.909  -4.297 -20.596
  373    HD1  PHE  50           HD1      PHE  50 -14.102  -5.976 -18.624
  374    HD2  PHE  50           HD2      PHE  50 -17.366  -4.961 -21.225
  375    HE1  PHE  50           HE1      PHE  50 -15.280  -8.056 -17.958
  376    HE2  PHE  50           HE2      PHE  50 -18.543  -7.040 -20.558
  377    HZ   PHE  50           HZ       PHE  50 -17.501  -8.587 -18.927
  378    H    ASP  51           H        ASP  51 -17.429  -2.274 -19.024
  379    HA   ASP  51           HA       ASP  51 -17.519  -0.277 -21.047
  380   1HB   ASP  51          2HB       ASP  51 -19.161  -0.525 -18.508
  381   2HB   ASP  51          1HB       ASP  51 -19.560   0.525 -19.869
  382    H    LYS  52           H        LYS  52 -17.593   0.369 -17.524
  383    HA   LYS  52           HA       LYS  52 -16.871   3.111 -17.776
  384   1HB   LYS  52          2HB       LYS  52 -16.554   3.088 -15.400
  385   2HB   LYS  52          1HB       LYS  52 -17.862   1.952 -15.736
  386   1HG   LYS  52          2HG       LYS  52 -15.966   0.169 -15.866
  387   2HG   LYS  52          1HG       LYS  52 -15.002   1.365 -14.999
  388   1HD   LYS  52          2HD       LYS  52 -16.533   1.397 -13.155
  389   2HD   LYS  52          1HD       LYS  52 -17.733   0.466 -14.055
  390   1HE   LYS  52          2HE       LYS  52 -15.497  -1.156 -14.174
  391   2HE   LYS  52          1HE       LYS  52 -15.391  -0.468 -12.553
  392   1HZ   LYS  52          1HZ       LYS  52 -16.984  -2.548 -13.324
  393   2HZ   LYS  52          2HZ       LYS  52 -18.057  -1.235 -13.225
  394   3HZ   LYS  52          3HZ       LYS  52 -17.116  -1.669 -11.880
  395    H    LEU  53           H        LEU  53 -14.907   0.192 -17.540
  396    HA   LEU  53           HA       LEU  53 -12.405   1.333 -16.903
  397   1HB   LEU  53          2HB       LEU  53 -12.885  -1.122 -17.119
  398   2HB   LEU  53          1HB       LEU  53 -12.883  -0.923 -18.871
  399    HG   LEU  53           HG       LEU  53 -10.534   0.218 -17.485
  400   1HD1  LEU  53          1HD1      LEU  53 -10.612  -1.725 -16.127
  401   2HD1  LEU  53          2HD1      LEU  53  -9.517  -2.156 -17.441
  402   3HD1  LEU  53          3HD1      LEU  53 -11.185  -2.731 -17.458
  403   1HD2  LEU  53          1HD2      LEU  53  -9.414  -0.551 -19.439
  404   2HD2  LEU  53          2HD2      LEU  53 -11.000  -0.032 -20.009
  405   3HD2  LEU  53          3HD2      LEU  53 -10.665  -1.748 -19.779
  406    H    GLU  54           H        GLU  54 -13.961   0.979 -20.094
  407    HA   GLU  54           HA       GLU  54 -11.755   2.174 -21.533
  408   1HB   GLU  54          2HB       GLU  54 -13.453   0.706 -22.607
  409   2HB   GLU  54          1HB       GLU  54 -14.671   1.955 -22.343
  410   1HG   GLU  54          2HG       GLU  54 -13.995   2.445 -24.517
  411   2HG   GLU  54          1HG       GLU  54 -12.929   3.497 -23.585
  412    H    LYS  55           H        LYS  55 -14.904   3.438 -20.410
  413    HA   LYS  55           HA       LYS  55 -14.628   6.065 -21.427
  414   1HB   LYS  55          2HB       LYS  55 -16.001   5.083 -18.908
  415   2HB   LYS  55          1HB       LYS  55 -16.185   6.711 -19.562
  416   1HG   LYS  55          2HG       LYS  55 -16.674   5.215 -21.788
  417   2HG   LYS  55          1HG       LYS  55 -17.313   4.156 -20.530
  418   1HD   LYS  55          2HD       LYS  55 -19.180   5.463 -20.881
  419   2HD   LYS  55          1HD       LYS  55 -18.372   6.453 -19.664
  420   1HE   LYS  55          2HE       LYS  55 -18.877   8.001 -21.367
  421   2HE   LYS  55          1HE       LYS  55 -17.192   7.585 -21.683
  422   1HZ   LYS  55          1HZ       LYS  55 -18.075   5.836 -23.224
  423   2HZ   LYS  55          2HZ       LYS  55 -18.321   7.440 -23.731
  424   3HZ   LYS  55          3HZ       LYS  55 -19.604   6.551 -23.058
  425    H    ALA  56           H        ALA  56 -13.526   4.705 -18.319
  426    HA   ALA  56           HA       ALA  56 -12.472   7.194 -17.323
  427   1HB   ALA  56          1HB       ALA  56 -12.911   5.427 -15.750
  428   2HB   ALA  56          2HB       ALA  56 -11.166   5.675 -15.769
  429   3HB   ALA  56          3HB       ALA  56 -11.872   4.308 -16.630
  430    H    ALA  57           H        ALA  57 -11.061   4.543 -19.218
  431    HA   ALA  57           HA       ALA  57  -8.353   5.482 -19.083
  432   1HB   ALA  57          1HB       ALA  57  -9.370   3.208 -19.970
  433   2HB   ALA  57          2HB       ALA  57  -7.867   3.832 -20.647
  434   3HB   ALA  57          3HB       ALA  57  -9.386   4.061 -21.513
  435    H    VAL  58           H        VAL  58 -10.885   5.941 -21.574
  436    HA   VAL  58           HA       VAL  58  -9.408   7.539 -23.359
  437    HB   VAL  58           HB       VAL  58 -12.342   7.662 -22.610
  438   1HG1  VAL  58          1HG1      VAL  58 -10.701   9.265 -24.503
  439   2HG1  VAL  58          2HG1      VAL  58 -12.201   9.688 -23.676
  440   3HG1  VAL  58          3HG1      VAL  58 -12.244   8.668 -25.115
  441   1HG2  VAL  58          1HG2      VAL  58 -12.590   6.427 -24.755
  442   2HG2  VAL  58          2HG2      VAL  58 -11.604   5.537 -23.595
  443   3HG2  VAL  58          3HG2      VAL  58 -10.836   6.403 -24.926
  444    H    GLU  59           H        GLU  59 -11.647   8.797 -20.851
  445    HA   GLU  59           HA       GLU  59 -10.998  11.497 -21.016
  446   1HB   GLU  59          2HB       GLU  59 -12.439   9.922 -19.248
  447   2HB   GLU  59          1HB       GLU  59 -11.165  10.599 -18.232
  448   1HG   GLU  59          2HG       GLU  59 -12.896  12.214 -18.147
  449   2HG   GLU  59          1HG       GLU  59 -11.751  12.863 -19.320
  450    H    ALA  60           H        ALA  60  -9.261   8.999 -19.144
  451    HA   ALA  60           HA       ALA  60  -7.318  10.699 -17.972
  452   1HB   ALA  60          1HB       ALA  60  -5.942   8.684 -17.738
  453   2HB   ALA  60          2HB       ALA  60  -6.933   7.847 -18.933
  454   3HB   ALA  60          3HB       ALA  60  -7.626   8.303 -17.377
  455    H    PHE  61           H        PHE  61  -7.261   8.993 -21.109
  456    HA   PHE  61           HA       PHE  61  -4.667   9.761 -21.926
  457   1HB   PHE  61          2HB       PHE  61  -6.090   8.145 -23.160
  458   2HB   PHE  61          1HB       PHE  61  -7.135   9.473 -23.666
  459    HD1  PHE  61           HD1      PHE  61  -6.072  11.412 -24.976
  460    HD2  PHE  61           HD2      PHE  61  -4.133   7.627 -24.372
  461    HE1  PHE  61           HE1      PHE  61  -4.550  11.889 -26.875
  462    HE2  PHE  61           HE2      PHE  61  -2.612   8.103 -26.271
  463    HZ   PHE  61           HZ       PHE  61  -2.820  10.234 -27.523
  464    H    LYS  62           H        LYS  62  -7.751  11.513 -22.209
  465    HA   LYS  62           HA       LYS  62  -6.557  13.760 -23.616
  466   1HB   LYS  62          2HB       LYS  62  -9.167  12.895 -23.007
  467   2HB   LYS  62          1HB       LYS  62  -8.980  14.438 -22.174
  468   1HG   LYS  62          2HG       LYS  62  -8.239  15.501 -24.257
  469   2HG   LYS  62          1HG       LYS  62  -8.355  13.957 -25.103
  470   1HD   LYS  62          2HD       LYS  62 -10.761  13.868 -24.690
  471   2HD   LYS  62          1HD       LYS  62 -10.677  15.355 -23.743
  472   1HE   LYS  62          2HE       LYS  62  -9.880  15.151 -26.661
  473   2HE   LYS  62          1HE       LYS  62 -11.451  15.726 -26.100
  474   1HZ   LYS  62          1HZ       LYS  62 -10.369  17.693 -26.189
  475   2HZ   LYS  62          2HZ       LYS  62  -8.835  17.006 -25.941
  476   3HZ   LYS  62          3HZ       LYS  62  -9.886  17.241 -24.626
  477    H    MET  63           H        MET  63  -6.925  12.827 -20.279
  478    HA   MET  63           HA       MET  63  -6.544  15.495 -19.184
  479   1HB   MET  63          2HB       MET  63  -6.363  12.713 -18.011
  480   2HB   MET  63          1HB       MET  63  -6.017  14.159 -17.062
  481   1HG   MET  63          2HG       MET  63  -8.211  14.836 -17.036
  482   2HG   MET  63          1HG       MET  63  -8.544  14.165 -18.632
  483   1HE   MET  63          1HE       MET  63  -7.274  13.274 -15.209
  484   2HE   MET  63          2HE       MET  63  -8.316  11.981 -14.622
  485   3HE   MET  63          3HE       MET  63  -8.960  13.613 -14.795
  486    H    GLY  64           H        GLY  64  -4.431  12.688 -19.776
  487   1HA   GLY  64          2HA       GLY  64  -2.134  13.537 -20.645
  488   2HA   GLY  64          1HA       GLY  64  -2.087  14.413 -19.114
  489    H    PHE  65           H        PHE  65  -2.388  11.113 -20.438
  490    HA   PHE  65           HA       PHE  65  -0.494  10.107 -18.468
  491   1HB   PHE  65          2HB       PHE  65  -3.415   9.314 -18.266
  492   2HB   PHE  65          1HB       PHE  65  -2.097   8.482 -17.442
  493    HD1  PHE  65           HD1      PHE  65  -4.138  11.533 -17.571
  494    HD2  PHE  65           HD2      PHE  65  -0.848   9.570 -15.630
  495    HE1  PHE  65           HE1      PHE  65  -4.232  13.195 -15.733
  496    HE2  PHE  65           HE2      PHE  65  -0.939  11.232 -13.792
  497    HZ   PHE  65           HZ       PHE  65  -2.632  13.045 -13.844
  498    H    GLU  66           H        GLU  66   0.674   8.932 -19.939
  499    HA   GLU  66           HA       GLU  66  -0.348   7.734 -22.301
  500   1HB   GLU  66          2HB       GLU  66   2.130   7.404 -20.659
  501   2HB   GLU  66          1HB       GLU  66   1.775   6.174 -21.873
  502   1HG   GLU  66          2HG       GLU  66   1.439   8.970 -22.781
  503   2HG   GLU  66          1HG       GLU  66   3.097   8.493 -22.419
  504    H    VAL  67           H        VAL  67  -2.318   6.670 -21.606
  505    HA   VAL  67           HA       VAL  67  -2.433   4.641 -19.613
  506    HB   VAL  67           HB       VAL  67  -4.500   5.515 -20.406
  507   1HG1  VAL  67          1HG1      VAL  67  -5.168   5.290 -22.803
  508   2HG1  VAL  67          2HG1      VAL  67  -3.559   4.661 -23.159
  509   3HG1  VAL  67          3HG1      VAL  67  -3.751   6.317 -22.584
  510   1HG2  VAL  67          1HG2      VAL  67  -4.030   2.814 -20.301
  511   2HG2  VAL  67          2HG2      VAL  67  -4.725   2.986 -21.912
  512   3HG2  VAL  67          3HG2      VAL  67  -5.626   3.537 -20.499
  513    H    LEU  68           H        LEU  68  -2.037   2.439 -19.686
  514    HA   LEU  68           HA       LEU  68  -0.891   1.383 -22.241
  515   1HB   LEU  68          2HB       LEU  68   0.631   1.724 -20.125
  516   2HB   LEU  68          1HB       LEU  68  -0.163   0.258 -19.551
  517    HG   LEU  68           HG       LEU  68   0.429  -0.643 -21.961
  518   1HD1  LEU  68          1HD1      LEU  68   2.068   0.451 -23.128
  519   2HD1  LEU  68          2HD1      LEU  68   2.865   1.032 -21.666
  520   3HD1  LEU  68          3HD1      LEU  68   1.427   1.855 -22.274
  521   1HD2  LEU  68          1HD2      LEU  68   2.744  -1.278 -21.009
  522   2HD2  LEU  68          2HD2      LEU  68   1.333  -1.738 -20.057
  523   3HD2  LEU  68          3HD2      LEU  68   2.286  -0.326 -19.596
  524    H    GLU  69           H        GLU  69  -1.523  -0.729 -22.832
  525    HA   GLU  69           HA       GLU  69  -4.114  -1.584 -22.282
  526   1HB   GLU  69          2HB       GLU  69  -2.827  -2.539 -24.117
  527   2HB   GLU  69          1HB       GLU  69  -1.703  -3.285 -22.979
  528   1HG   GLU  69          2HG       GLU  69  -3.167  -4.956 -22.419
  529   2HG   GLU  69          1HG       GLU  69  -4.580  -3.914 -22.582
  530    H    ALA  70           H        ALA  70  -4.910  -3.414 -20.995
  531    HA   ALA  70           HA       ALA  70  -3.518  -3.548 -18.367
  532   1HB   ALA  70          1HB       ALA  70  -5.748  -2.913 -18.000
  533   2HB   ALA  70          2HB       ALA  70  -5.805  -4.657 -17.743
  534   3HB   ALA  70          3HB       ALA  70  -6.358  -3.972 -19.271
  535    H    GLU  71           H        GLU  71  -3.760  -5.766 -17.252
  536    HA   GLU  71           HA       GLU  71  -3.568  -7.989 -19.231
  537   1HB   GLU  71          2HB       GLU  71  -1.276  -7.495 -18.803
  538   2HB   GLU  71          1HB       GLU  71  -1.572  -7.258 -17.080
  539   1HG   GLU  71          2HG       GLU  71  -1.680  -9.524 -16.645
  540   2HG   GLU  71          1HG       GLU  71  -2.265  -9.914 -18.263
  541    H    GLU  72           H        GLU  72  -5.268  -9.259 -18.642
  542    HA   GLU  72           HA       GLU  72  -6.750  -9.396 -16.365
  543   1HB   GLU  72          2HB       GLU  72  -7.008 -11.867 -16.764
  544   2HB   GLU  72          1HB       GLU  72  -7.210 -10.891 -18.220
  545   1HG   GLU  72          2HG       GLU  72  -5.724 -12.422 -19.069
  546   2HG   GLU  72          1HG       GLU  72  -4.555 -11.307 -18.361
  547    H    THR  73           H        THR  73  -6.051  -9.313 -14.279
  548    HA   THR  73           HA       THR  73  -3.832 -11.163 -13.499
  549    HB   THR  73           HB       THR  73  -2.886  -8.988 -13.343
  550    HG1  THR  73           HG1      THR  73  -3.589  -8.776 -10.791
  551   1HG2  THR  73          1HG2      THR  73  -4.638  -7.530 -11.661
  552   2HG2  THR  73          2HG2      THR  73  -5.628  -8.219 -12.946
  553   3HG2  THR  73          3HG2      THR  73  -4.246  -7.201 -13.348
  554    H    GLU  74           H        GLU  74  -4.504  -9.824 -10.718
  555    HA   GLU  74           HA       GLU  74  -7.136 -10.797 -10.045
  556   1HB   GLU  74          2HB       GLU  74  -6.543 -12.769  -8.776
  557   2HB   GLU  74          1HB       GLU  74  -5.890 -12.961 -10.404
  558   1HG   GLU  74          2HG       GLU  74  -3.821 -11.680  -9.165
  559   2HG   GLU  74          1HG       GLU  74  -4.471 -12.632  -7.832
  560    H    ASP  75           H        ASP  75  -7.730  -9.866  -8.114
  561    HA   ASP  75           HA       ASP  75  -6.188  -7.886  -6.869
  562   1HB   ASP  75          2HB       ASP  75  -8.560  -9.506  -6.056
  563   2HB   ASP  75          1HB       ASP  75  -7.726  -8.601  -4.793
  564    H    GLU  76           H        GLU  76  -7.048 -10.401  -4.618
  565    HA   GLU  76           HA       GLU  76  -4.197 -11.174  -4.296
  566   1HB   GLU  76          2HB       GLU  76  -4.815  -9.220  -2.758
  567   2HB   GLU  76          1HB       GLU  76  -5.883 -10.349  -1.924
  568   1HG   GLU  76          2HG       GLU  76  -4.142 -11.209  -0.790
  569   2HG   GLU  76          1HG       GLU  76  -3.319 -11.596  -2.301
  570    H    ASP  77           H        ASP  77  -6.747 -12.482  -5.213
  571    HA   ASP  77           HA       ASP  77  -6.591 -14.809  -3.357
  572   1HB   ASP  77          2HB       ASP  77  -9.133 -13.563  -4.447
  573   2HB   ASP  77          1HB       ASP  77  -9.061 -15.112  -3.606
  574    H    GLY  78           H        GLY  78  -7.928 -13.691  -6.489
  575   1HA   GLY  78          2HA       GLY  78  -6.591 -15.155  -8.306
  576   2HA   GLY  78          1HA       GLY  78  -7.596 -16.413  -7.588
  577    H    ASN  79           H        ASN  79  -8.446 -13.013  -8.219
  578    HA   ASN  79           HA       ASN  79 -10.789 -14.001  -9.763
  579   1HB   ASN  79          2HB       ASN  79 -10.579 -12.058  -7.808
  580   2HB   ASN  79          1HB       ASN  79 -10.593 -11.109  -9.294
  581   1HD2  ASN  79          1HD2      ASN  79 -12.275 -14.192  -8.454
  582   2HD2  ASN  79          2HD2      ASN  79 -13.829 -13.609  -8.809
  583    H    LYS  80           H        LYS  80 -11.330 -12.868 -11.799
  584    HA   LYS  80           HA       LYS  80  -8.847 -12.098 -13.261
  585   1HB   LYS  80          2HB       LYS  80 -10.452 -14.022 -14.011
  586   2HB   LYS  80          1HB       LYS  80 -11.482 -12.708 -14.580
  587   1HG   LYS  80          2HG       LYS  80  -8.982 -11.966 -15.504
  588   2HG   LYS  80          1HG       LYS  80  -8.968 -13.720 -15.699
  589   1HD   LYS  80          2HD       LYS  80 -11.305 -13.433 -16.758
  590   2HD   LYS  80          1HD       LYS  80 -10.896 -11.722 -16.881
  591   1HE   LYS  80          2HE       LYS  80  -9.953 -12.308 -18.865
  592   2HE   LYS  80          1HE       LYS  80  -8.623 -12.896 -17.868
  593   1HZ   LYS  80          1HZ       LYS  80  -9.306 -15.055 -18.061
  594   2HZ   LYS  80          2HZ       LYS  80  -9.779 -14.457 -19.580
  595   3HZ   LYS  80          3HZ       LYS  80 -10.929 -14.649 -18.343
  596    H    LEU  81           H        LEU  81  -8.651  -9.887 -13.032
  597    HA   LEU  81           HA       LEU  81 -11.006  -8.260 -13.897
  598   1HB   LEU  81          2HB       LEU  81 -10.197  -6.492 -12.306
  599   2HB   LEU  81          1HB       LEU  81 -10.757  -7.957 -11.500
  600    HG   LEU  81           HG       LEU  81  -8.085  -8.499 -11.968
  601   1HD1  LEU  81          1HD1      LEU  81  -8.443  -5.578 -11.241
  602   2HD1  LEU  81          2HD1      LEU  81  -7.593  -6.226 -12.644
  603   3HD1  LEU  81          3HD1      LEU  81  -6.935  -6.466 -11.026
  604   1HD2  LEU  81          1HD2      LEU  81  -7.852  -8.141  -9.528
  605   2HD2  LEU  81          2HD2      LEU  81  -9.359  -8.972  -9.910
  606   3HD2  LEU  81          3HD2      LEU  81  -9.375  -7.253  -9.519
  607    H    LEU  82           H        LEU  82 -10.248  -6.013 -14.645
  608    HA   LEU  82           HA       LEU  82  -7.808  -6.391 -16.310
  609   1HB   LEU  82          2HB       LEU  82 -10.067  -4.380 -16.541
  610   2HB   LEU  82          1HB       LEU  82  -8.715  -4.531 -17.666
  611    HG   LEU  82           HG       LEU  82  -9.548  -7.090 -17.665
  612   1HD1  LEU  82          1HD1      LEU  82 -11.825  -7.369 -17.294
  613   2HD1  LEU  82          2HD1      LEU  82 -12.184  -5.664 -17.569
  614   3HD1  LEU  82          3HD1      LEU  82 -11.439  -6.175 -16.054
  615   1HD2  LEU  82          1HD2      LEU  82 -10.964  -6.419 -19.685
  616   2HD2  LEU  82          2HD2      LEU  82  -9.295  -5.849 -19.699
  617   3HD2  LEU  82          3HD2      LEU  82 -10.601  -4.745 -19.267
  618    H    CYS  83           H        CYS  83  -6.054  -5.033 -16.092
  619    HA   CYS  83           HA       CYS  83  -6.317  -2.702 -14.247
  620   1HB   CYS  83          2HB       CYS  83  -5.283  -4.144 -12.753
  621   2HB   CYS  83          1HB       CYS  83  -4.482  -5.057 -14.031
  622    HG   CYS  83           HG       CYS  83  -3.426  -2.204 -13.843
  623    H    PHE  84           H        PHE  84  -6.050  -1.135 -15.854
  624    HA   PHE  84           HA       PHE  84  -3.824  -1.457 -17.780
  625   1HB   PHE  84          2HB       PHE  84  -4.728   0.819 -18.600
  626   2HB   PHE  84          1HB       PHE  84  -5.756  -0.593 -18.835
  627    HD1  PHE  84           HD1      PHE  84  -5.542   2.685 -17.434
  628    HD2  PHE  84           HD2      PHE  84  -7.484  -1.117 -16.963
  629    HE1  PHE  84           HE1      PHE  84  -7.336   3.767 -16.107
  630    HE2  PHE  84           HE2      PHE  84  -9.278  -0.035 -15.635
  631    HZ   PHE  84           HZ       PHE  84  -9.204   2.408 -15.209
  632    H    ASP  85           H        ASP  85  -2.233   0.323 -18.020
  633    HA   ASP  85           HA       ASP  85  -1.660   1.560 -15.356
  634   1HB   ASP  85          2HB       ASP  85   0.336   1.097 -17.581
  635   2HB   ASP  85          1HB       ASP  85   0.667   1.453 -15.885
  636    H    ALA  86           H        ALA  86  -0.391   3.668 -15.551
  637    HA   ALA  86           HA       ALA  86  -1.091   5.225 -17.982
  638   1HB   ALA  86          1HB       ALA  86  -2.800   6.229 -16.895
  639   2HB   ALA  86          2HB       ALA  86  -1.577   7.002 -15.888
  640   3HB   ALA  86          3HB       ALA  86  -2.338   5.502 -15.357
  641    H    THR  87           H        THR  87   0.843   6.044 -18.621
  642    HA   THR  87           HA       THR  87   2.886   6.664 -16.551
  643    HB   THR  87           HB       THR  87   4.025   7.124 -19.051
  644    HG1  THR  87           HG1      THR  87   3.307   5.542 -20.358
  645   1HG2  THR  87          1HG2      THR  87   5.174   4.977 -18.626
  646   2HG2  THR  87          2HG2      THR  87   3.964   4.577 -17.407
  647   3HG2  THR  87          3HG2      THR  87   5.053   5.941 -17.154
  648    H    MET  88           H        MET  88   3.952   8.745 -16.576
  649    HA   MET  88           HA       MET  88   2.855  10.877 -18.273
  650   1HB   MET  88          2HB       MET  88   1.161  10.781 -16.510
  651   2HB   MET  88          1HB       MET  88   2.412  10.862 -15.270
  652   1HG   MET  88          2HG       MET  88   1.563  13.083 -15.479
  653   2HG   MET  88          1HG       MET  88   3.113  13.089 -16.316
  654   1HE   MET  88          1HE       MET  88   1.052  15.353 -16.766
  655   2HE   MET  88          2HE       MET  88  -0.257  14.257 -16.328
  656   3HE   MET  88          3HE       MET  88  -0.273  15.054 -17.900
  657    H    GLN  89           H        GLN  89   4.886  11.542 -18.918
  658    HA   GLN  89           HA       GLN  89   7.165  11.628 -17.141
  659   1HB   GLN  89          2HB       GLN  89   6.912  11.663 -19.834
  660   2HB   GLN  89          1HB       GLN  89   7.131  13.388 -19.536
  661   1HG   GLN  89          2HG       GLN  89   9.337  12.591 -19.785
  662   2HG   GLN  89          1HG       GLN  89   9.120  12.660 -18.036
  663   1HE2  GLN  89          1HE2      GLN  89   7.173  10.158 -18.998
  664   2HE2  GLN  89          2HE2      GLN  89   8.263   8.868 -18.837
  665    H    SER  90           H        SER  90   7.472  13.127 -15.565
  666    HA   SER  90           HA       SER  90   6.831  15.949 -16.087
  667   1HB   SER  90          2HB       SER  90   4.741  15.638 -15.180
  668   2HB   SER  90          1HB       SER  90   5.234  14.213 -14.270
  669    HG   SER  90           HG       SER  90   6.213  15.539 -12.772
  670    H    ALA  91           H        ALA  91   7.829  17.363 -14.501
  671    HA   ALA  91           HA       ALA  91  10.380  16.574 -13.613
  672   1HB   ALA  91          1HB       ALA  91  10.427  18.808 -13.307
  673   2HB   ALA  91          2HB       ALA  91   9.515  18.570 -11.816
  674   3HB   ALA  91          3HB       ALA  91   8.666  18.890 -13.328
  675    H    LEU  92           H        LEU  92  10.784  17.016 -10.988
  676    HA   LEU  92           HA       LEU  92   9.109  14.919  -9.667
  677   1HB   LEU  92          2HB       LEU  92  11.556  14.395 -10.006
  678   2HB   LEU  92          1HB       LEU  92  11.932  15.747  -8.937
  679    HG   LEU  92           HG       LEU  92  10.127  14.463  -7.397
  680   1HD1  LEU  92          1HD1      LEU  92  11.626  12.132  -8.532
  681   2HD1  LEU  92          2HD1      LEU  92  10.179  12.687  -9.374
  682   3HD1  LEU  92          3HD1      LEU  92  10.075  12.164  -7.693
  683   1HD2  LEU  92          1HD2      LEU  92  13.019  13.577  -7.576
  684   2HD2  LEU  92          2HD2      LEU  92  12.004  13.631  -6.136
  685   3HD2  LEU  92          3HD2      LEU  92  12.527  15.130  -6.903
  686    H    ASP  93           H        ASP  93   7.647  15.936  -8.368
  687    HA   ASP  93           HA       ASP  93   8.627  17.721  -6.265
  688   1HB   ASP  93          2HB       ASP  93   8.351  19.431  -7.895
  689   2HB   ASP  93          1HB       ASP  93   6.853  18.720  -8.500
  690    H    ALA  94           H        ALA  94   7.515  17.097  -4.482
  691    HA   ALA  94           HA       ALA  94   5.389  15.257  -4.459
  692   1HB   ALA  94          1HB       ALA  94   5.508  15.478  -2.200
  693   2HB   ALA  94          2HB       ALA  94   5.290  17.227  -2.270
  694   3HB   ALA  94          3HB       ALA  94   6.887  16.527  -2.532
  695    H    LYS  95           H        LYS  95   5.243  18.821  -4.340
  696    HA   LYS  95           HA       LYS  95   2.434  19.083  -4.093
  697   1HB   LYS  95          2HB       LYS  95   4.462  20.854  -4.241
  698   2HB   LYS  95          1HB       LYS  95   3.840  20.999  -5.885
  699   1HG   LYS  95          2HG       LYS  95   2.543  22.575  -4.747
  700   2HG   LYS  95          1HG       LYS  95   1.505  21.148  -4.696
  701   1HD   LYS  95          2HD       LYS  95   2.942  20.707  -2.462
  702   2HD   LYS  95          1HD       LYS  95   3.018  22.469  -2.501
  703   1HE   LYS  95          2HE       LYS  95   0.466  20.840  -2.672
  704   2HE   LYS  95          1HE       LYS  95   1.049  21.656  -1.222
  705   1HZ   LYS  95          1HZ       LYS  95  -0.318  23.247  -2.074
  706   2HZ   LYS  95          2HZ       LYS  95  -0.046  22.796  -3.688
  707   3HZ   LYS  95          3HZ       LYS  95   1.127  23.689  -2.842
  708    H    LEU  96           H        LEU  96   4.233  19.539  -7.161
  709    HA   LEU  96           HA       LEU  96   2.141  19.462  -8.948
  710   1HB   LEU  96          2HB       LEU  96   4.821  19.385  -9.249
  711   2HB   LEU  96          1HB       LEU  96   4.441  17.719  -9.682
  712    HG   LEU  96           HG       LEU  96   4.381  19.086 -11.695
  713   1HD1  LEU  96          1HD1      LEU  96   2.628  17.285 -11.303
  714   2HD1  LEU  96          2HD1      LEU  96   2.183  18.521 -12.479
  715   3HD1  LEU  96          3HD1      LEU  96   1.517  18.578 -10.849
  716   1HD2  LEU  96          1HD2      LEU  96   3.627  21.125 -10.063
  717   2HD2  LEU  96          2HD2      LEU  96   2.070  20.706 -10.777
  718   3HD2  LEU  96          3HD2      LEU  96   3.421  21.160 -11.815
  719    H    ILE  97           H        ILE  97   3.807  16.569  -7.656
  720    HA   ILE  97           HA       ILE  97   2.104  14.669  -8.942
  721    HB   ILE  97           HB       ILE  97   3.658  14.442  -6.345
  722   1HG1  ILE  97          2HG1      ILE  97   4.445  13.266  -9.000
  723   2HG1  ILE  97          1HG1      ILE  97   4.795  14.962  -8.661
  724   1HG2  ILE  97          1HG2      ILE  97   2.165  12.634  -6.279
  725   2HG2  ILE  97          2HG2      ILE  97   3.558  11.941  -7.107
  726   3HG2  ILE  97          3HG2      ILE  97   2.149  12.458  -8.033
  727   1HD1  ILE  97          1HD1      ILE  97   6.477  14.430  -7.250
  728   2HD1  ILE  97          2HD1      ILE  97   6.362  12.794  -7.897
  729   3HD1  ILE  97          3HD1      ILE  97   5.496  13.221  -6.422
  730    H    ASP  98           H        ASP  98   1.605  16.725  -6.204
  731    HA   ASP  98           HA       ASP  98  -0.463  15.130  -4.942
  732   1HB   ASP  98          2HB       ASP  98   0.872  17.001  -3.844
  733   2HB   ASP  98          1HB       ASP  98  -0.125  18.134  -4.758
  734    H    GLU  99           H        GLU  99  -0.439  17.769  -7.321
  735    HA   GLU  99           HA       GLU  99  -3.346  17.904  -7.464
  736   1HB   GLU  99          2HB       GLU  99  -1.762  18.877  -9.769
  737   2HB   GLU  99          1HB       GLU  99  -3.003  19.703  -8.826
  738   1HG   GLU  99          2HG       GLU  99  -1.182  19.656  -6.925
  739   2HG   GLU  99          1HG       GLU  99  -0.063  19.449  -8.274
  740    H    GLN 100           H        GLN 100  -0.774  16.523  -9.520
  741    HA   GLN 100           HA       GLN 100  -2.398  15.522 -11.599
  742   1HB   GLN 100          2HB       GLN 100   0.135  14.412 -10.357
  743   2HB   GLN 100          1HB       GLN 100  -0.603  13.732 -11.808
  744   1HG   GLN 100          2HG       GLN 100  -0.150  16.682 -11.749
  745   2HG   GLN 100          1HG       GLN 100   1.261  15.644 -11.955
  746   1HE2  GLN 100          1HE2      GLN 100  -2.014  16.217 -13.333
  747   2HE2  GLN 100          2HE2      GLN 100  -1.608  15.704 -14.899
  748    H    VAL 101           H        VAL 101  -1.428  13.885  -8.563
  749    HA   VAL 101           HA       VAL 101  -2.965  11.519  -9.011
  750    HB   VAL 101           HB       VAL 101  -2.077  12.862  -6.442
  751   1HG1  VAL 101          1HG1      VAL 101  -4.035  11.407  -6.045
  752   2HG1  VAL 101          2HG1      VAL 101  -2.572  10.700  -5.360
  753   3HG1  VAL 101          3HG1      VAL 101  -3.220  10.085  -6.881
  754   1HG2  VAL 101          1HG2      VAL 101  -0.938  10.281  -7.292
  755   2HG2  VAL 101          2HG2      VAL 101  -0.122  11.729  -6.702
  756   3HG2  VAL 101          3HG2      VAL 101  -0.597  11.612  -8.397
  757    H    GLU 102           H        GLU 102  -3.740  14.310  -6.892
  758    HA   GLU 102           HA       GLU 102  -6.317  13.698  -6.143
  759   1HB   GLU 102          2HB       GLU 102  -5.133  15.830  -5.584
  760   2HB   GLU 102          1HB       GLU 102  -5.474  16.409  -7.214
  761   1HG   GLU 102          2HG       GLU 102  -7.884  15.386  -5.962
  762   2HG   GLU 102          1HG       GLU 102  -7.146  16.641  -4.967
  763    H    LYS 103           H        LYS 103  -5.307  14.958  -9.312
  764    HA   LYS 103           HA       LYS 103  -7.921  15.203 -10.435
  765   1HB   LYS 103          2HB       LYS 103  -5.808  16.119 -11.447
  766   2HB   LYS 103          1HB       LYS 103  -5.369  14.473 -11.902
  767   1HG   LYS 103          2HG       LYS 103  -6.467  15.030 -13.835
  768   2HG   LYS 103          1HG       LYS 103  -7.880  14.549 -12.894
  769   1HD   LYS 103          2HD       LYS 103  -8.642  16.625 -13.448
  770   2HD   LYS 103          1HD       LYS 103  -7.622  17.143 -12.106
  771   1HE   LYS 103          2HE       LYS 103  -5.775  17.602 -13.633
  772   2HE   LYS 103          1HE       LYS 103  -6.708  16.976 -14.992
  773   1HZ   LYS 103          1HZ       LYS 103  -8.329  18.723 -14.653
  774   2HZ   LYS 103          2HZ       LYS 103  -6.785  19.394 -14.883
  775   3HZ   LYS 103          3HZ       LYS 103  -7.458  19.317 -13.325
  776    H    LEU 104           H        LEU 104  -5.615  12.485 -10.388
  777    HA   LEU 104           HA       LEU 104  -7.217  10.704 -11.959
  778   1HB   LEU 104          2HB       LEU 104  -5.001  10.326  -9.956
  779   2HB   LEU 104          1HB       LEU 104  -5.862   8.929 -10.599
  780    HG   LEU 104           HG       LEU 104  -4.529  11.055 -12.301
  781   1HD1  LEU 104          1HD1      LEU 104  -3.582   8.217 -12.079
  782   2HD1  LEU 104          2HD1      LEU 104  -3.111   9.373 -10.832
  783   3HD1  LEU 104          3HD1      LEU 104  -2.675   9.666 -12.515
  784   1HD2  LEU 104          1HD2      LEU 104  -6.279   8.725 -12.822
  785   2HD2  LEU 104          2HD2      LEU 104  -4.844   8.819 -13.842
  786   3HD2  LEU 104          3HD2      LEU 104  -5.991  10.158 -13.808
  787    H    VAL 105           H        VAL 105  -6.688  10.605  -8.413
  788    HA   VAL 105           HA       VAL 105  -8.668   8.799  -7.710
  789    HB   VAL 105           HB       VAL 105  -7.707  11.306  -6.333
  790   1HG1  VAL 105          1HG1      VAL 105  -8.938  10.001  -4.329
  791   2HG1  VAL 105          2HG1      VAL 105 -10.013   9.547  -5.652
  792   3HG1  VAL 105          3HG1      VAL 105  -9.749  11.249  -5.276
  793   1HG2  VAL 105          1HG2      VAL 105  -7.484   8.452  -5.393
  794   2HG2  VAL 105          2HG2      VAL 105  -6.435   9.822  -5.027
  795   3HG2  VAL 105          3HG2      VAL 105  -6.381   9.072  -6.622
  796    H    ASN 106           H        ASN 106  -9.099  12.213  -8.565
  797    HA   ASN 106           HA       ASN 106 -11.864  12.406  -7.857
  798   1HB   ASN 106          2HB       ASN 106  -9.994  13.916  -9.628
  799   2HB   ASN 106          1HB       ASN 106 -11.724  14.162  -9.878
  800   1HD2  ASN 106          1HD2      ASN 106  -9.058  14.710  -7.645
  801   2HD2  ASN 106          2HD2      ASN 106  -9.931  15.659  -6.542
  802    H    LEU 107           H        LEU 107 -10.324  11.709 -11.013
  803    HA   LEU 107           HA       LEU 107 -12.800  11.197 -12.375
  804   1HB   LEU 107          2HB       LEU 107 -10.647  11.680 -13.536
  805   2HB   LEU 107          1HB       LEU 107 -10.039  10.112 -13.006
  806    HG   LEU 107           HG       LEU 107 -12.158   9.134 -14.128
  807   1HD1  LEU 107          1HD1      LEU 107 -13.570  10.611 -15.068
  808   2HD1  LEU 107          2HD1      LEU 107 -12.295  11.081 -16.190
  809   3HD1  LEU 107          3HD1      LEU 107 -12.489  11.944 -14.665
  810   1HD2  LEU 107          1HD2      LEU 107  -9.845   8.875 -14.986
  811   2HD2  LEU 107          2HD2      LEU 107  -9.999  10.411 -15.838
  812   3HD2  LEU 107          3HD2      LEU 107 -11.009   9.040 -16.301
  813    H    ALA 108           H        ALA 108 -10.344   8.940 -11.069
  814    HA   ALA 108           HA       ALA 108 -11.561   6.510 -11.603
  815   1HB   ALA 108          1HB       ALA 108  -9.768   7.525  -9.501
  816   2HB   ALA 108          2HB       ALA 108  -9.674   6.030 -10.433
  817   3HB   ALA 108          3HB       ALA 108 -10.715   6.118  -9.011
  818    H    GLU 109           H        GLU 109 -12.333   8.709  -8.902
  819    HA   GLU 109           HA       GLU 109 -14.474   6.971  -7.937
  820   1HB   GLU 109          2HB       GLU 109 -13.850   9.866  -7.269
  821   2HB   GLU 109          1HB       GLU 109 -14.955   8.816  -6.379
  822   1HG   GLU 109          2HG       GLU 109 -12.067   8.057  -6.820
  823   2HG   GLU 109          1HG       GLU 109 -12.565   9.047  -5.447
  824    H    LYS 110           H        LYS 110 -14.166   9.377 -10.368
  825    HA   LYS 110           HA       LYS 110 -16.933  10.271 -10.338
  826   1HB   LYS 110          2HB       LYS 110 -15.132  11.646 -11.326
  827   2HB   LYS 110          1HB       LYS 110 -14.859  10.404 -12.548
  828   1HG   LYS 110          2HG       LYS 110 -17.663  11.319 -12.280
  829   2HG   LYS 110          1HG       LYS 110 -16.533  12.521 -12.906
  830   1HD   LYS 110          2HD       LYS 110 -15.728  10.744 -14.539
  831   2HD   LYS 110          1HD       LYS 110 -17.106   9.769 -14.027
  832   1HE   LYS 110          2HE       LYS 110 -17.666  12.592 -14.793
  833   2HE   LYS 110          1HE       LYS 110 -17.256  11.477 -16.096
  834   1HZ   LYS 110          1HZ       LYS 110 -19.265  10.770 -14.052
  835   2HZ   LYS 110          2HZ       LYS 110 -19.052  10.115 -15.606
  836   3HZ   LYS 110          3HZ       LYS 110 -19.691  11.679 -15.419
  837    H    PHE 111           H        PHE 111 -15.190   7.596 -11.777
  838    HA   PHE 111           HA       PHE 111 -17.576   6.913 -13.421
  839   1HB   PHE 111          2HB       PHE 111 -14.679   6.218 -13.518
  840   2HB   PHE 111          1HB       PHE 111 -15.818   4.991 -14.076
  841    HD1  PHE 111           HD1      PHE 111 -13.839   7.578 -15.209
  842    HD2  PHE 111           HD2      PHE 111 -17.890   6.175 -15.475
  843    HE1  PHE 111           HE1      PHE 111 -14.127   8.812 -17.341
  844    HE2  PHE 111           HE2      PHE 111 -18.177   7.409 -17.607
  845    HZ   PHE 111           HZ       PHE 111 -16.296   8.728 -18.539
  846    H    ASP 112           H        ASP 112 -15.253   4.760 -11.762
  847    HA   ASP 112           HA       ASP 112 -16.820   3.870  -9.636
  848   1HB   ASP 112          2HB       ASP 112 -17.832   2.956 -12.248
  849   2HB   ASP 112          1HB       ASP 112 -17.589   1.661 -11.075
  850    H    ILE 113           H        ILE 113 -14.045   4.005 -10.584
  851    HA   ILE 113           HA       ILE 113 -13.307   1.122 -10.267
  852    HB   ILE 113           HB       ILE 113 -11.356   1.502 -11.583
  853   1HG1  ILE 113          2HG1      ILE 113 -12.036   4.420 -11.194
  854   2HG1  ILE 113          1HG1      ILE 113 -10.556   3.579 -10.732
  855   1HG2  ILE 113          1HG2      ILE 113 -12.299   1.977 -13.669
  856   2HG2  ILE 113          2HG2      ILE 113 -13.330   3.252 -13.021
  857   3HG2  ILE 113          3HG2      ILE 113 -13.722   1.561 -12.714
  858   1HD1  ILE 113          1HD1      ILE 113  -9.858   4.611 -12.691
  859   2HD1  ILE 113          2HD1      ILE 113 -11.449   4.488 -13.444
  860   3HD1  ILE 113          3HD1      ILE 113 -10.417   3.063 -13.322
  861    H    ILE 114           H        ILE 114 -11.105   0.876  -9.171
  862    HA   ILE 114           HA       ILE 114 -10.898   2.887  -6.967
  863    HB   ILE 114           HB       ILE 114 -11.505   0.821  -5.982
  864   1HG1  ILE 114          2HG1      ILE 114  -9.532   0.157  -4.718
  865   2HG1  ILE 114          1HG1      ILE 114  -8.470   0.843  -5.948
  866   1HG2  ILE 114          1HG2      ILE 114  -9.786  -1.170  -6.697
  867   2HG2  ILE 114          2HG2      ILE 114  -9.896  -0.273  -8.212
  868   3HG2  ILE 114          3HG2      ILE 114 -11.357  -0.911  -7.456
  869   1HD1  ILE 114          1HD1      ILE 114  -9.150   2.213  -3.749
  870   2HD1  ILE 114          2HD1      ILE 114 -10.528   2.645  -4.761
  871   3HD1  ILE 114          3HD1      ILE 114  -8.889   3.013  -5.300
  872    H    TYR 115           H        TYR 115  -9.286   4.246  -7.706
  873    HA   TYR 115           HA       TYR 115  -6.854   3.081  -8.921
  874   1HB   TYR 115          2HB       TYR 115  -7.350   5.008 -10.101
  875   2HB   TYR 115          1HB       TYR 115  -8.043   5.814  -8.695
  876    HD1  TYR 115           HD1      TYR 115  -4.728   4.120  -9.006
  877    HD2  TYR 115           HD2      TYR 115  -6.831   7.837  -8.549
  878    HE1  TYR 115           HE1      TYR 115  -2.578   5.288  -8.610
  879    HE2  TYR 115           HE2      TYR 115  -4.680   9.006  -8.153
  880    HH   TYR 115           HH       TYR 115  -2.454   8.817  -8.186
  881    H    ASP 116           H        ASP 116  -5.324   2.369  -7.517
  882    HA   ASP 116           HA       ASP 116  -4.322   4.157  -5.433
  883   1HB   ASP 116          2HB       ASP 116  -4.654   2.418  -3.617
  884   2HB   ASP 116          1HB       ASP 116  -6.132   3.217  -4.154
  885    H    GLY 117           H        GLY 117  -2.479   3.796  -6.923
  886   1HA   GLY 117          2HA       GLY 117  -0.546   2.023  -5.937
  887   2HA   GLY 117          1HA       GLY 117  -1.335   1.170  -7.265
  888    H    TRP 118           H        TRP 118   0.543   4.053  -6.444
  889    HA   TRP 118           HA       TRP 118   1.210   4.307  -9.352
  890   1HB   TRP 118          2HB       TRP 118   1.203   6.625  -9.190
  891   2HB   TRP 118          1HB       TRP 118  -0.075   6.221  -8.045
  892    HD1  TRP 118           HD1      TRP 118   0.392   6.576  -5.486
  893    HE1  TRP 118           HE1      TRP 118   2.257   7.803  -4.196
  894    HE3  TRP 118           HE3      TRP 118   3.788   7.220  -9.245
  895    HZ2  TRP 118           HZ2      TRP 118   4.847   8.911  -4.694
  896    HZ3  TRP 118           HZ3      TRP 118   5.944   8.362  -8.810
  897    HH2  TRP 118           HH2      TRP 118   6.478   9.208  -6.541
  898    H    GLY 119           H        GLY 119   3.430   4.765  -9.844
  899   1HA   GLY 119          2HA       GLY 119   5.417   4.977  -7.726
  900   2HA   GLY 119          1HA       GLY 119   5.402   3.382  -8.480
  901    H    THR 120           H        THR 120   7.620   5.170  -8.658
  902    HA   THR 120           HA       THR 120   7.613   5.648 -11.606
  903    HB   THR 120           HB       THR 120   7.397   7.842 -10.623
  904    HG1  THR 120           HG1      THR 120   9.197   7.293 -12.190
  905   1HG2  THR 120          1HG2      THR 120   8.259   6.927  -8.343
  906   2HG2  THR 120          2HG2      THR 120   8.603   8.605  -8.762
  907   3HG2  THR 120          3HG2      THR 120   9.853   7.375  -8.950
  908    H    TYR 121           H        TYR 121   9.932   5.813 -12.436
  909    HA   TYR 121           HA       TYR 121  11.631   3.869 -10.929
  910   1HB   TYR 121          2HB       TYR 121  11.805   4.570 -13.872
  911   2HB   TYR 121          1HB       TYR 121  12.586   3.222 -13.045
  912    HD1  TYR 121           HD1      TYR 121  11.514   1.139 -12.918
  913    HD2  TYR 121           HD2      TYR 121   9.205   4.656 -13.782
  914    HE1  TYR 121           HE1      TYR 121   9.516  -0.272 -13.326
  915    HE2  TYR 121           HE2      TYR 121   7.208   3.245 -14.190
  916    HH   TYR 121           HH       TYR 121   7.135   0.334 -14.931
  917    H    TYR 122           H        TYR 122  13.978   4.273 -10.992
  918    HA   TYR 122           HA       TYR 122  14.623   7.030 -10.457
  919   1HB   TYR 122          2HB       TYR 122  15.875   5.244  -9.370
  920   2HB   TYR 122          1HB       TYR 122  16.408   4.623 -10.932
  921    HD1  TYR 122           HD1      TYR 122  16.360   7.876  -9.050
  922    HD2  TYR 122           HD2      TYR 122  18.528   5.243 -11.661
  923    HE1  TYR 122           HE1      TYR 122  18.292   9.429  -9.011
  924    HE2  TYR 122           HE2      TYR 122  20.461   6.797 -11.622
  925    HH   TYR 122           HH       TYR 122  20.255   9.943 -10.030
  926    H    GLU 123           H        GLU 123  16.773   7.869 -11.687
  927    HA   GLU 123           HA       GLU 123  16.022   7.878 -14.572
  928   1HB   GLU 123          2HB       GLU 123  17.903   9.780 -13.153
  929   2HB   GLU 123          1HB       GLU 123  17.131  10.000 -14.724
  930   1HG   GLU 123          2HG       GLU 123  15.765  11.288 -13.327
  931   2HG   GLU 123          1HG       GLU 123  14.902   9.751 -13.371
  932    H    GLY 124           H        GLY 124  17.438   7.089 -16.092
  933   1HA   GLY 124          2HA       GLY 124  19.325   5.997 -16.960
  934   2HA   GLY 124          1HA       GLY 124  20.267   6.948 -15.810
  935    H    LEU 125           H        LEU 125  18.778   3.861 -16.410
  936    HA   LEU 125           HA       LEU 125  20.026   2.853 -13.884
  937   1HB   LEU 125          2HB       LEU 125  18.111   1.030 -14.216
  938   2HB   LEU 125          1HB       LEU 125  17.790   2.542 -13.365
  939    HG   LEU 125           HG       LEU 125  17.465   2.504 -16.338
  940   1HD1  LEU 125          1HD1      LEU 125  15.198   1.635 -16.157
  941   2HD1  LEU 125          2HD1      LEU 125  15.368   1.463 -14.409
  942   3HD1  LEU 125          3HD1      LEU 125  16.318   0.445 -15.492
  943   1HD2  LEU 125          1HD2      LEU 125  15.921   4.246 -15.900
  944   2HD2  LEU 125          2HD2      LEU 125  17.212   4.516 -14.729
  945   3HD2  LEU 125          3HD2      LEU 125  15.707   3.749 -14.222
  946    H    GLU 126           H        GLU 126  21.887   1.964 -14.776
  947    HA   GLU 126           HA       GLU 126  22.197   0.753 -17.285
  948   1HB   GLU 126          2HB       GLU 126  23.512  -0.090 -14.681
  949   2HB   GLU 126          1HB       GLU 126  24.100  -0.471 -16.301
  950   1HG   GLU 126          2HG       GLU 126  23.625   2.363 -16.115
  951   2HG   GLU 126          1HG       GLU 126  24.644   1.856 -14.766
  952    H    HIS 127           H        HIS 127  20.658  -0.685 -18.012
  953    HA   HIS 127           HA       HIS 127  20.574  -3.327 -16.763
  954   1HB   HIS 127          2HB       HIS 127  18.472  -1.349 -16.258
  955   2HB   HIS 127          1HB       HIS 127  17.848  -2.843 -16.958
  956    HD2  HIS 127           HD2      HIS 127  19.034  -5.226 -15.442
  957    HE1  HIS 127           HE1      HIS 127  18.979  -3.019 -11.841
  958    HE2  HIS 127           HE2      HIS 127  19.188  -5.341 -12.840
  959    H    HIS 128           H        HIS 128  21.211  -2.032 -19.381
  960    HA   HIS 128           HA       HIS 128  19.553  -3.845 -21.042
  961   1HB   HIS 128          2HB       HIS 128  18.805  -1.261 -20.947
  962   2HB   HIS 128          1HB       HIS 128  20.053  -1.141 -22.186
  963    HD2  HIS 128           HD2      HIS 128  16.593  -2.987 -21.661
  964    HE1  HIS 128           HE1      HIS 128  17.651  -3.239 -25.743
  965    HE2  HIS 128           HE2      HIS 128  15.831  -3.726 -24.044
  966    H    HIS 129           H        HIS 129  20.584  -3.033 -23.531
  967    HA   HIS 129           HA       HIS 129  22.443  -3.694 -24.838
  968   1HB   HIS 129          2HB       HIS 129  24.555  -2.335 -23.868
  969   2HB   HIS 129          1HB       HIS 129  23.255  -1.543 -24.757
  970    HD2  HIS 129           HD2      HIS 129  21.666   0.201 -23.222
  971    HE1  HIS 129           HE1      HIS 129  23.576  -0.507 -19.522
  972    HE2  HIS 129           HE2      HIS 129  21.870   0.933 -20.727
  973    H    HIS 130           H        HIS 130  22.102  -5.857 -23.493
  974    HA   HIS 130           HA       HIS 130  24.779  -6.540 -22.375
  975   1HB   HIS 130          2HB       HIS 130  22.699  -6.149 -20.694
  976   2HB   HIS 130          1HB       HIS 130  22.428  -7.842 -21.104
  977    HD2  HIS 130           HD2      HIS 130  23.697  -9.328 -19.159
  978    HE1  HIS 130           HE1      HIS 130  27.175  -6.968 -18.758
  979    HE2  HIS 130           HE2      HIS 130  26.007  -9.079 -17.975
  980    H    HIS 131           H        HIS 131  25.423  -8.688 -22.812
  981    HA   HIS 131           HA       HIS 131  24.401  -9.914 -25.159
  982   1HB   HIS 131          2HB       HIS 131  25.829 -11.439 -22.977
  983   2HB   HIS 131          1HB       HIS 131  25.917 -11.686 -24.722
  984    HD2  HIS 131           HD2      HIS 131  27.282  -9.431 -26.102
  985    HE1  HIS 131           HE1      HIS 131  29.418  -8.331 -22.630
  986    HE2  HIS 131           HE2      HIS 131  29.257  -8.023 -25.142
  987    H    HIS 132           HN       HIS 132  24.393 -11.695 -22.083
  988    HA   HIS 132           HA       HIS 132  21.488 -12.244 -22.484
  989   1HB   HIS 132          2HB       HIS 132  22.499 -14.621 -21.466
  990   2HB   HIS 132          1HB       HIS 132  22.033 -14.339 -23.144
  991    HD2  HIS 132           HD2      HIS 132  24.182 -15.658 -24.383
  992    HE1  HIS 132           HE1      HIS 132  27.273 -13.462 -22.523
  993    HE2  HIS 132           HE2      HIS 132  26.746 -15.184 -24.310
  Start of MODEL   10
    1   1H    MET   1          1H        MET   1 -12.983  -7.055   8.210
    2   2H    MET   1          2H        MET   1 -14.581  -7.443   7.783
    3   3H    MET   1          3H        MET   1 -13.579  -8.617   8.494
    4    HA   MET   1           HA       MET   1 -14.396  -8.054  10.459
    5   1HB   MET   1          2HB       MET   1 -12.719  -5.729   9.658
    6   2HB   MET   1          1HB       MET   1 -13.771  -5.499  11.055
    7   1HG   MET   1          2HG       MET   1 -12.078  -7.976  10.849
    8   2HG   MET   1          1HG       MET   1 -11.365  -6.469  11.422
    9   1HE   MET   1          1HE       MET   1 -11.679  -7.734  14.886
   10   2HE   MET   1          2HE       MET   1 -10.752  -6.917  13.630
   11   3HE   MET   1          3HE       MET   1 -11.103  -8.637  13.478
   12    H    SER   2           H        SER   2 -14.766  -4.723   9.347
   13    HA   SER   2           HA       SER   2 -17.682  -4.970   9.851
   14   1HB   SER   2          2HB       SER   2 -16.719  -3.102  10.983
   15   2HB   SER   2          1HB       SER   2 -15.808  -2.614   9.557
   16    HG   SER   2           HG       SER   2 -17.961  -1.553  10.169
   17    H    HIS   3           H        HIS   3 -18.507  -2.813   8.183
   18    HA   HIS   3           HA       HIS   3 -18.195  -4.109   5.510
   19   1HB   HIS   3          2HB       HIS   3 -20.503  -3.613   6.860
   20   2HB   HIS   3          1HB       HIS   3 -20.356  -2.123   5.927
   21    HD2  HIS   3           HD2      HIS   3 -22.255  -2.803   3.952
   22    HE1  HIS   3           HE1      HIS   3 -20.315  -6.299   2.593
   23    HE2  HIS   3           HE2      HIS   3 -22.213  -4.679   2.140
   24    H    GLN   4           H        GLN   4 -17.464  -2.878   3.787
   25    HA   GLN   4           HA       GLN   4 -17.354   0.048   3.978
   26   1HB   GLN   4          2HB       GLN   4 -14.952   0.251   3.856
   27   2HB   GLN   4          1HB       GLN   4 -15.325  -0.775   5.242
   28   1HG   GLN   4          2HG       GLN   4 -15.165  -2.608   3.193
   29   2HG   GLN   4          1HG       GLN   4 -13.919  -1.442   2.747
   30   1HE2  GLN   4          1HE2      GLN   4 -13.541  -4.219   3.819
   31   2HE2  GLN   4          2HE2      GLN   4 -12.625  -4.039   5.236
   32    H    ASP   5           H        ASP   5 -17.433  -2.846   2.248
   33    HA   ASP   5           HA       ASP   5 -16.254  -2.079  -0.240
   34   1HB   ASP   5          2HB       ASP   5 -17.190  -4.397   0.590
   35   2HB   ASP   5          1HB       ASP   5 -18.695  -3.827  -0.132
   36    H    ASP   6           H        ASP   6 -18.402  -0.293   1.254
   37    HA   ASP   6           HA       ASP   6 -19.652   0.609  -1.283
   38   1HB   ASP   6          2HB       ASP   6 -21.319   0.397   1.221
   39   2HB   ASP   6          1HB       ASP   6 -21.858   0.578  -0.449
   40    H    TYR   7           H        TYR   7 -19.019   1.241   2.157
   41    HA   TYR   7           HA       TYR   7 -19.402   4.144   1.691
   42   1HB   TYR   7          2HB       TYR   7 -19.199   2.381   4.096
   43   2HB   TYR   7          1HB       TYR   7 -18.715   4.068   4.263
   44    HD1  TYR   7           HD1      TYR   7 -21.503   1.763   3.806
   45    HD2  TYR   7           HD2      TYR   7 -20.334   5.896   3.734
   46    HE1  TYR   7           HE1      TYR   7 -23.886   2.439   3.920
   47    HE2  TYR   7           HE2      TYR   7 -22.717   6.572   3.848
   48    HH   TYR   7           HH       TYR   7 -25.286   4.328   3.397
   49    H    LEU   8           H        LEU   8 -17.352   3.671   0.185
   50    HA   LEU   8           HA       LEU   8 -14.786   3.409   1.457
   51   1HB   LEU   8          2HB       LEU   8 -15.567   4.657  -1.197
   52   2HB   LEU   8          1HB       LEU   8 -13.905   4.337  -0.698
   53    HG   LEU   8           HG       LEU   8 -15.961   2.136  -0.666
   54   1HD1  LEU   8          1HD1      LEU   8 -15.952   3.190  -2.936
   55   2HD1  LEU   8          2HD1      LEU   8 -15.327   1.541  -2.944
   56   3HD1  LEU   8          3HD1      LEU   8 -14.213   2.906  -3.023
   57   1HD2  LEU   8          1HD2      LEU   8 -13.375   2.271   0.210
   58   2HD2  LEU   8          2HD2      LEU   8 -13.139   1.697  -1.440
   59   3HD2  LEU   8          3HD2      LEU   8 -14.154   0.782  -0.326
   60    H    SER   9           H        SER   9 -13.298   5.594   0.559
   61    HA   SER   9           HA       SER   9 -14.492   8.112   1.327
   62   1HB   SER   9          2HB       SER   9 -12.660   6.739   3.312
   63   2HB   SER   9          1HB       SER   9 -13.127   8.436   3.396
   64    HG   SER   9           HG       SER   9 -15.159   7.866   3.862
   65    H    VAL  10           H        VAL  10 -13.450   8.649  -0.691
   66    HA   VAL  10           HA       VAL  10 -10.753   8.261  -1.364
   67    HB   VAL  10           HB       VAL  10 -10.985  10.363  -2.716
   68   1HG1  VAL  10          1HG1      VAL  10 -13.053   9.539  -3.982
   69   2HG1  VAL  10          2HG1      VAL  10 -13.202   8.305  -2.732
   70   3HG1  VAL  10          3HG1      VAL  10 -11.764   8.358  -3.752
   71   1HG2  VAL  10          1HG2      VAL  10 -12.298  11.799  -1.384
   72   2HG2  VAL  10          2HG2      VAL  10 -13.487  10.543  -1.041
   73   3HG2  VAL  10          3HG2      VAL  10 -13.422  11.283  -2.640
   74    H    GLU  11           H        GLU  11 -12.196  10.632   0.813
   75    HA   GLU  11           HA       GLU  11 -10.129  12.462   1.162
   76   1HB   GLU  11          2HB       GLU  11 -12.464  11.893   2.498
   77   2HB   GLU  11          1HB       GLU  11 -11.246  11.498   3.710
   78   1HG   GLU  11          2HG       GLU  11 -10.246  13.700   3.505
   79   2HG   GLU  11          1HG       GLU  11 -11.314  14.101   2.160
   80    H    GLU  12           H        GLU  12 -10.343   9.168   2.462
   81    HA   GLU  12           HA       GLU  12  -7.906   9.411   4.028
   82   1HB   GLU  12          2HB       GLU  12  -8.969   6.771   3.070
   83   2HB   GLU  12          1HB       GLU  12  -8.264   7.188   4.633
   84   1HG   GLU  12          2HG       GLU  12 -10.969   8.103   3.616
   85   2HG   GLU  12          1HG       GLU  12 -10.697   6.864   4.840
   86    H    LEU  13           H        LEU  13  -8.595   7.326   1.198
   87    HA   LEU  13           HA       LEU  13  -6.089   6.521   0.486
   88   1HB   LEU  13          2HB       LEU  13  -7.709   7.744  -1.716
   89   2HB   LEU  13          1HB       LEU  13  -6.880   6.187  -1.667
   90    HG   LEU  13           HG       LEU  13  -9.440   6.921  -0.218
   91   1HD1  LEU  13          1HD1      LEU  13 -10.541   5.755  -1.838
   92   2HD1  LEU  13          2HD1      LEU  13  -9.258   4.553  -1.979
   93   3HD1  LEU  13          3HD1      LEU  13  -9.108   6.105  -2.804
   94   1HD2  LEU  13          1HD2      LEU  13  -8.451   5.477   1.310
   95   2HD2  LEU  13          2HD2      LEU  13  -7.512   4.643   0.072
   96   3HD2  LEU  13          3HD2      LEU  13  -9.236   4.313   0.242
   97    H    ILE  14           H        ILE  14  -7.371   9.797   0.021
   98    HA   ILE  14           HA       ILE  14  -5.093  10.776  -1.452
   99    HB   ILE  14           HB       ILE  14  -7.332  12.077   0.085
  100   1HG1  ILE  14          2HG1      ILE  14  -6.515  12.586  -2.764
  101   2HG1  ILE  14          1HG1      ILE  14  -7.385  11.107  -2.359
  102   1HG2  ILE  14          1HG2      ILE  14  -5.807  13.731   0.557
  103   2HG2  ILE  14          2HG2      ILE  14  -6.181  14.202  -1.100
  104   3HG2  ILE  14          3HG2      ILE  14  -4.731  13.258  -0.758
  105   1HD1  ILE  14          1HD1      ILE  14  -9.275  12.295  -1.573
  106   2HD1  ILE  14          2HD1      ILE  14  -8.799  13.161  -3.034
  107   3HD1  ILE  14          3HD1      ILE  14  -8.376  13.808  -1.449
  108    H    GLU  15           H        GLU  15  -6.046  11.244   1.973
  109    HA   GLU  15           HA       GLU  15  -3.732  12.577   2.838
  110   1HB   GLU  15          2HB       GLU  15  -5.968  11.291   4.059
  111   2HB   GLU  15          1HB       GLU  15  -4.515  10.709   4.872
  112   1HG   GLU  15          2HG       GLU  15  -5.056  12.672   6.059
  113   2HG   GLU  15          1HG       GLU  15  -3.807  13.207   4.935
  114    H    ILE  16           H        ILE  16  -4.325   9.046   2.931
  115    HA   ILE  16           HA       ILE  16  -1.852   8.194   3.897
  116    HB   ILE  16           HB       ILE  16  -3.406   6.890   1.641
  117   1HG1  ILE  16          2HG1      ILE  16  -3.651   6.510   4.643
  118   2HG1  ILE  16          1HG1      ILE  16  -4.787   7.433   3.658
  119   1HG2  ILE  16          1HG2      ILE  16  -2.001   5.283   3.686
  120   2HG2  ILE  16          2HG2      ILE  16  -0.944   6.206   2.617
  121   3HG2  ILE  16          3HG2      ILE  16  -2.093   5.051   1.941
  122   1HD1  ILE  16          1HD1      ILE  16  -4.162   4.677   2.731
  123   2HD1  ILE  16          2HD1      ILE  16  -5.690   5.555   2.697
  124   3HD1  ILE  16          3HD1      ILE  16  -5.133   4.814   4.196
  125    H    GLN  17           H        GLN  17  -2.653   8.506   0.414
  126    HA   GLN  17           HA       GLN  17  -0.087   8.056  -0.613
  127   1HB   GLN  17          2HB       GLN  17  -2.554   9.256  -1.558
  128   2HB   GLN  17          1HB       GLN  17  -1.154  10.115  -2.203
  129   1HG   GLN  17          2HG       GLN  17  -1.632   8.327  -3.736
  130   2HG   GLN  17          1HG       GLN  17  -0.193   7.851  -2.833
  131   1HE2  GLN  17          1HE2      GLN  17  -3.745   7.668  -2.168
  132   2HE2  GLN  17          2HE2      GLN  17  -3.721   6.029  -1.727
  133    H    LYS  18           H        LYS  18  -1.496  11.242   0.231
  134    HA   LYS  18           HA       LYS  18   0.587  12.942  -0.323
  135   1HB   LYS  18          2HB       LYS  18  -1.456  12.845   1.819
  136   2HB   LYS  18          1HB       LYS  18  -0.072  13.891   2.140
  137   1HG   LYS  18          2HG       LYS  18  -0.430  14.887  -0.169
  138   2HG   LYS  18          1HG       LYS  18  -1.956  14.004  -0.227
  139   1HD   LYS  18          2HD       LYS  18  -1.698  15.411   2.293
  140   2HD   LYS  18          1HD       LYS  18  -1.512  16.527   0.940
  141   1HE   LYS  18          2HE       LYS  18  -3.615  15.697  -0.043
  142   2HE   LYS  18          1HE       LYS  18  -3.801  14.570   1.300
  143   1HZ   LYS  18          1HZ       LYS  18  -4.147  16.292   2.799
  144   2HZ   LYS  18          2HZ       LYS  18  -5.014  16.794   1.426
  145   3HZ   LYS  18          3HZ       LYS  18  -3.492  17.469   1.767
  146    H    GLU  19           H        GLU  19   0.363  10.985   2.671
  147    HA   GLU  19           HA       GLU  19   2.987  11.797   3.587
  148   1HB   GLU  19          2HB       GLU  19   1.150  10.947   5.080
  149   2HB   GLU  19          1HB       GLU  19   1.413   9.339   4.403
  150   1HG   GLU  19          2HG       GLU  19   3.802   9.473   5.125
  151   2HG   GLU  19          1HG       GLU  19   3.447  11.016   5.903
  152    H    GLU  20           H        GLU  20   1.764   8.760   2.131
  153    HA   GLU  20           HA       GLU  20   4.149   7.305   2.080
  154   1HB   GLU  20          2HB       GLU  20   1.734   6.747   1.166
  155   2HB   GLU  20          1HB       GLU  20   2.414   7.296  -0.366
  156   1HG   GLU  20          2HG       GLU  20   4.271   5.688  -0.122
  157   2HG   GLU  20          1HG       GLU  20   3.589   5.133   1.408
  158    H    THR  21           H        THR  21   2.979   9.340  -0.636
  159    HA   THR  21           HA       THR  21   5.314   9.223  -2.193
  160    HB   THR  21           HB       THR  21   3.675  11.746  -1.918
  161    HG1  THR  21           HG1      THR  21   3.004   9.513  -3.511
  162   1HG2  THR  21          1HG2      THR  21   5.653  10.709  -3.759
  163   2HG2  THR  21          2HG2      THR  21   4.924  12.313  -3.700
  164   3HG2  THR  21          3HG2      THR  21   4.132  11.018  -4.597
  165    H    ARG  22           H        ARG  22   4.464  11.907   0.035
  166    HA   ARG  22           HA       ARG  22   6.718  13.432   0.004
  167   1HB   ARG  22          2HB       ARG  22   5.171  12.445   2.406
  168   2HB   ARG  22          1HB       ARG  22   6.477  13.620   2.558
  169   1HG   ARG  22          2HG       ARG  22   4.651  14.327   0.400
  170   2HG   ARG  22          1HG       ARG  22   3.806  14.186   1.942
  171   1HD   ARG  22          2HD       ARG  22   6.408  15.681   1.839
  172   2HD   ARG  22          1HD       ARG  22   4.938  16.470   1.268
  173    HE   ARG  22           HE       ARG  22   4.211  15.447   3.735
  174   1HH1  ARG  22          1HH2      ARG  22   6.755  17.419   2.501
  175   2HH1  ARG  22          2HH2      ARG  22   6.940  18.328   3.965
  176   1HH2  ARG  22          2HH1      ARG  22   4.436  16.624   5.652
  177   2HH2  ARG  22          1HH1      ARG  22   5.627  17.879   5.748
  178    H    ASP  23           H        ASP  23   6.472  10.322   1.750
  179    HA   ASP  23           HA       ASP  23   9.139  10.323   2.764
  180   1HB   ASP  23          2HB       ASP  23   7.119   8.718   3.258
  181   2HB   ASP  23          1HB       ASP  23   7.772   7.782   1.914
  182    H    ILE  24           H        ILE  24   7.782   9.087  -0.287
  183    HA   ILE  24           HA       ILE  24  10.244   7.969  -1.257
  184    HB   ILE  24           HB       ILE  24   7.936   9.063  -2.890
  185   1HG1  ILE  24          2HG1      ILE  24   8.350   6.343  -1.607
  186   2HG1  ILE  24          1HG1      ILE  24   7.089   7.510  -1.204
  187   1HG2  ILE  24          1HG2      ILE  24   8.772   7.816  -4.664
  188   2HG2  ILE  24          2HG2      ILE  24   9.620   6.687  -3.606
  189   3HG2  ILE  24          3HG2      ILE  24  10.274   8.303  -3.877
  190   1HD1  ILE  24          1HD1      ILE  24   6.663   7.293  -3.864
  191   2HD1  ILE  24          2HD1      ILE  24   5.870   6.252  -2.681
  192   3HD1  ILE  24          3HD1      ILE  24   7.302   5.682  -3.537
  193    H    ILE  25           H        ILE  25   8.587  10.905  -2.476
  194    HA   ILE  25           HA       ILE  25  10.654  11.998  -3.955
  195    HB   ILE  25           HB       ILE  25   8.906  13.634  -2.096
  196   1HG1  ILE  25          2HG1      ILE  25   7.388  12.212  -3.246
  197   2HG1  ILE  25          1HG1      ILE  25   7.412  13.695  -4.200
  198   1HG2  ILE  25          1HG2      ILE  25   9.375  14.655  -4.771
  199   2HG2  ILE  25          2HG2      ILE  25  10.902  14.343  -3.947
  200   3HG2  ILE  25          3HG2      ILE  25   9.710  15.416  -3.217
  201   1HD1  ILE  25          1HD1      ILE  25   9.251  12.596  -5.599
  202   2HD1  ILE  25          2HD1      ILE  25   7.632  11.918  -5.778
  203   3HD1  ILE  25          3HD1      ILE  25   8.831  11.089  -4.784
  204    H    GLN  26           H        GLN  26  10.343  11.954  -0.440
  205    HA   GLN  26           HA       GLN  26  12.512  13.786   0.074
  206   1HB   GLN  26          2HB       GLN  26  11.171  11.646   1.740
  207   2HB   GLN  26          1HB       GLN  26  12.496  12.631   2.360
  208   1HG   GLN  26          2HG       GLN  26  10.112  13.942   1.075
  209   2HG   GLN  26          1HG       GLN  26  10.044  13.436   2.763
  210   1HE2  GLN  26          1HE2      GLN  26  10.281  15.397   3.896
  211   2HE2  GLN  26          2HE2      GLN  26  11.567  16.481   3.665
  212    H    ALA  27           H        ALA  27  12.395  10.221   0.476
  213    HA   ALA  27           HA       ALA  27  15.102   9.744   0.897
  214   1HB   ALA  27          1HB       ALA  27  14.359   7.692  -0.841
  215   2HB   ALA  27          2HB       ALA  27  12.836   8.207  -0.115
  216   3HB   ALA  27          3HB       ALA  27  14.172   7.685   0.912
  217    H    LEU  28           H        LEU  28  13.479   9.978  -2.284
  218    HA   LEU  28           HA       LEU  28  15.808   9.642  -3.875
  219   1HB   LEU  28          2HB       LEU  28  13.083  10.721  -4.262
  220   2HB   LEU  28          1HB       LEU  28  14.297  11.360  -5.371
  221    HG   LEU  28           HG       LEU  28  14.999   8.964  -5.818
  222   1HD1  LEU  28          1HD1      LEU  28  12.897   7.413  -5.299
  223   2HD1  LEU  28          2HD1      LEU  28  12.679   8.556  -3.975
  224   3HD1  LEU  28          3HD1      LEU  28  14.178   7.637  -4.107
  225   1HD2  LEU  28          1HD2      LEU  28  13.104  10.502  -7.012
  226   2HD2  LEU  28          2HD2      LEU  28  12.131   9.099  -6.571
  227   3HD2  LEU  28          3HD2      LEU  28  13.555   8.900  -7.594
  228    H    LEU  29           H        LEU  29  14.157  12.782  -3.417
  229    HA   LEU  29           HA       LEU  29  16.074  14.527  -4.260
  230   1HB   LEU  29          2HB       LEU  29  14.212  14.639  -1.913
  231   2HB   LEU  29          1HB       LEU  29  15.403  15.925  -2.109
  232    HG   LEU  29           HG       LEU  29  13.501  15.040  -4.297
  233   1HD1  LEU  29          1HD1      LEU  29  12.404  16.082  -2.245
  234   2HD1  LEU  29          2HD1      LEU  29  12.140  16.941  -3.763
  235   3HD1  LEU  29          3HD1      LEU  29  13.324  17.543  -2.602
  236   1HD2  LEU  29          1HD2      LEU  29  14.325  17.644  -4.751
  237   2HD2  LEU  29          2HD2      LEU  29  15.001  16.213  -5.530
  238   3HD2  LEU  29          3HD2      LEU  29  15.777  16.886  -4.096
  239    H    GLU  30           H        GLU  30  16.043  13.176  -0.941
  240    HA   GLU  30           HA       GLU  30  18.464  14.295  -0.047
  241   1HB   GLU  30          2HB       GLU  30  17.008  11.745   0.598
  242   2HB   GLU  30          1HB       GLU  30  18.594  12.050   1.308
  243   1HG   GLU  30          2HG       GLU  30  17.770  13.603   2.730
  244   2HG   GLU  30          1HG       GLU  30  16.832  14.381   1.455
  245    H    ASP  31           H        ASP  31  17.940  11.320  -1.932
  246    HA   ASP  31           HA       ASP  31  20.601  10.359  -1.927
  247   1HB   ASP  31          2HB       ASP  31  18.295   9.504  -3.063
  248   2HB   ASP  31          1HB       ASP  31  19.110  10.150  -4.488
  249    H    GLY  32           H        GLY  32  19.150  13.030  -3.668
  250   1HA   GLY  32          2HA       GLY  32  20.793  14.819  -4.326
  251   2HA   GLY  32          1HA       GLY  32  21.803  13.521  -4.964
  252    H    SER  33           H        SER  33  18.742  12.564  -5.623
  253    HA   SER  33           HA       SER  33  18.989  13.187  -8.445
  254   1HB   SER  33          2HB       SER  33  17.881  11.161  -8.067
  255   2HB   SER  33          1HB       SER  33  16.937  11.813  -6.730
  256    HG   SER  33           HG       SER  33  16.482  13.170  -9.027
  257    H    ASP  34           H        ASP  34  18.561  15.197  -9.218
  258    HA   ASP  34           HA       ASP  34  16.476  16.826  -7.838
  259   1HB   ASP  34          2HB       ASP  34  17.683  18.510  -9.646
  260   2HB   ASP  34          1HB       ASP  34  18.161  18.346  -7.956
  261    HA   PRO  35           HA       PRO  35  13.645  16.420 -11.177
  262   1HB   PRO  35          2HB       PRO  35  12.704  19.032 -11.333
  263   2HB   PRO  35          1HB       PRO  35  12.138  17.815 -10.175
  264   1HG   PRO  35          2HG       PRO  35  14.056  20.045  -9.792
  265   2HG   PRO  35          1HG       PRO  35  12.868  19.366  -8.668
  266   1HD   PRO  35          2HD       PRO  35  15.531  18.827  -8.475
  267   2HD   PRO  35          1HD       PRO  35  14.282  17.659  -7.987
  268    H    ASP  36           H        ASP  36  16.188  18.792 -11.364
  269    HA   ASP  36           HA       ASP  36  15.775  19.822 -13.969
  270   1HB   ASP  36          2HB       ASP  36  18.346  19.209 -12.483
  271   2HB   ASP  36          1HB       ASP  36  18.281  20.112 -13.997
  272    H    ALA  37           H        ALA  37  16.168  16.626 -13.076
  273    HA   ALA  37           HA       ALA  37  17.367  15.905 -15.717
  274   1HB   ALA  37          1HB       ALA  37  18.676  14.628 -14.365
  275   2HB   ALA  37          2HB       ALA  37  17.270  13.565 -14.275
  276   3HB   ALA  37          3HB       ALA  37  17.556  14.759 -13.008
  277    H    LEU  38           H        LEU  38  14.455  16.542 -14.725
  278    HA   LEU  38           HA       LEU  38  12.301  15.773 -15.251
  279   1HB   LEU  38          2HB       LEU  38  14.081  14.789 -17.409
  280   2HB   LEU  38          1HB       LEU  38  12.517  13.982 -17.282
  281    HG   LEU  38           HG       LEU  38  12.652  16.983 -17.184
  282   1HD1  LEU  38          1HD1      LEU  38  13.905  16.462 -19.187
  283   2HD1  LEU  38          2HD1      LEU  38  12.279  16.941 -19.677
  284   3HD1  LEU  38          3HD1      LEU  38  12.728  15.236 -19.659
  285   1HD2  LEU  38          1HD2      LEU  38  10.622  14.926 -18.104
  286   2HD2  LEU  38          2HD2      LEU  38  10.400  16.667 -18.264
  287   3HD2  LEU  38          3HD2      LEU  38  10.524  15.938 -16.664
  288    H    TYR  39           H        TYR  39  10.900  13.839 -15.144
  289    HA   TYR  39           HA       TYR  39  12.140  11.316 -14.278
  290   1HB   TYR  39          2HB       TYR  39  11.048  13.282 -12.390
  291   2HB   TYR  39          1HB       TYR  39  10.309  11.688 -12.234
  292    HD1  TYR  39           HD1      TYR  39  13.422  13.624 -11.944
  293    HD2  TYR  39           HD2      TYR  39  11.654   9.721 -11.648
  294    HE1  TYR  39           HE1      TYR  39  15.441  12.800 -10.765
  295    HE2  TYR  39           HE2      TYR  39  13.674   8.896 -10.468
  296    HH   TYR  39           HH       TYR  39  15.801  10.693  -8.995
  297    H    GLU  40           H        GLU  40  10.657   9.566 -14.453
  298    HA   GLU  40           HA       GLU  40   8.075  10.305 -15.762
  299   1HB   GLU  40          2HB       GLU  40   8.196   8.309 -17.001
  300   2HB   GLU  40          1HB       GLU  40   9.875   8.847 -16.949
  301   1HG   GLU  40          2HG       GLU  40   9.990   7.409 -14.759
  302   2HG   GLU  40          1HG       GLU  40   8.560   6.617 -15.422
  303    H    ILE  41           H        ILE  41   6.153   9.398 -14.995
  304    HA   ILE  41           HA       ILE  41   6.376   7.752 -12.506
  305    HB   ILE  41           HB       ILE  41   4.402   9.978 -13.104
  306   1HG1  ILE  41          2HG1      ILE  41   5.600  10.621 -10.760
  307   2HG1  ILE  41          1HG1      ILE  41   6.925   9.762 -11.548
  308   1HG2  ILE  41          1HG2      ILE  41   3.331   8.152 -11.878
  309   2HG2  ILE  41          2HG2      ILE  41   3.600   9.513 -10.790
  310   3HG2  ILE  41          3HG2      ILE  41   4.667   8.111 -10.728
  311   1HD1  ILE  41          1HD1      ILE  41   5.380  12.108 -12.690
  312   2HD1  ILE  41          2HD1      ILE  41   6.625  11.207 -13.555
  313   3HD1  ILE  41          3HD1      ILE  41   7.047  12.135 -12.116
  314    H    GLU  42           H        GLU  42   4.436   6.372 -12.134
  315    HA   GLU  42           HA       GLU  42   2.770   5.921 -14.553
  316   1HB   GLU  42          2HB       GLU  42   4.758   4.392 -14.667
  317   2HB   GLU  42          1HB       GLU  42   4.245   3.685 -13.134
  318   1HG   GLU  42          2HG       GLU  42   2.125   2.987 -14.114
  319   2HG   GLU  42          1HG       GLU  42   2.531   3.789 -15.632
  320    H    HIS  43           H        HIS  43   0.685   5.354 -14.029
  321    HA   HIS  43           HA       HIS  43   0.128   4.808 -11.139
  322   1HB   HIS  43          2HB       HIS  43  -1.684   6.103 -13.201
  323   2HB   HIS  43          1HB       HIS  43  -2.065   5.853 -11.498
  324    HD2  HIS  43           HD2      HIS  43   0.809   7.816 -13.465
  325    HE1  HIS  43           HE1      HIS  43  -0.131   9.891  -9.908
  326    HE2  HIS  43           HE2      HIS  43   1.294   9.924 -12.006
  327    H    HIS  44           H        HIS  44  -1.482   3.199 -10.686
  328    HA   HIS  44           HA       HIS  44  -2.099   1.423 -13.016
  329   1HB   HIS  44          2HB       HIS  44  -1.692   0.609 -10.121
  330   2HB   HIS  44          1HB       HIS  44  -1.989  -0.476 -11.479
  331    HD2  HIS  44           HD2      HIS  44   0.230   1.094 -13.532
  332    HE1  HIS  44           HE1      HIS  44   3.010  -0.151 -10.608
  333    HE2  HIS  44           HE2      HIS  44   2.746   0.680 -12.990
  334    H    LEU  45           H        LEU  45  -4.250   1.388 -13.452
  335    HA   LEU  45           HA       LEU  45  -6.138   1.702 -11.150
  336   1HB   LEU  45          2HB       LEU  45  -6.709   2.749 -13.925
  337   2HB   LEU  45          1HB       LEU  45  -7.536   3.142 -12.418
  338    HG   LEU  45           HG       LEU  45  -5.002   3.886 -11.783
  339   1HD1  LEU  45          1HD1      LEU  45  -4.070   3.428 -13.968
  340   2HD1  LEU  45          2HD1      LEU  45  -4.171   5.179 -13.784
  341   3HD1  LEU  45          3HD1      LEU  45  -5.366   4.323 -14.760
  342   1HD2  LEU  45          1HD2      LEU  45  -7.109   5.522 -13.230
  343   2HD2  LEU  45          2HD2      LEU  45  -5.763   6.205 -12.320
  344   3HD2  LEU  45          3HD2      LEU  45  -7.000   5.263 -11.489
  345    H    PHE  46           H        PHE  46  -7.892   0.300 -11.168
  346    HA   PHE  46           HA       PHE  46  -8.179  -1.463 -13.561
  347   1HB   PHE  46          2HB       PHE  46  -8.894  -3.074 -11.424
  348   2HB   PHE  46          1HB       PHE  46  -7.357  -3.146 -12.287
  349    HD1  PHE  46           HD1      PHE  46  -5.482  -1.533 -11.494
  350    HD2  PHE  46           HD2      PHE  46  -8.935  -2.521  -9.140
  351    HE1  PHE  46           HE1      PHE  46  -4.291  -0.807  -9.443
  352    HE2  PHE  46           HE2      PHE  46  -7.745  -1.795  -7.089
  353    HZ   PHE  46           HZ       PHE  46  -5.423  -0.938  -7.240
  354    H    ALA  47           H        ALA  47 -10.333  -2.349 -13.823
  355    HA   ALA  47           HA       ALA  47 -12.427  -1.028 -12.157
  356   1HB   ALA  47          1HB       ALA  47 -13.536  -0.125 -13.977
  357   2HB   ALA  47          2HB       ALA  47 -12.899  -1.329 -15.095
  358   3HB   ALA  47          3HB       ALA  47 -11.875   0.001 -14.553
  359    H    GLU  48           H        GLU  48 -14.675  -2.070 -12.950
  360    HA   GLU  48           HA       GLU  48 -14.204  -5.017 -13.185
  361   1HB   GLU  48          2HB       GLU  48 -15.097  -3.999 -10.937
  362   2HB   GLU  48          1HB       GLU  48 -16.622  -3.871 -11.815
  363   1HG   GLU  48          2HG       GLU  48 -16.428  -6.302 -12.397
  364   2HG   GLU  48          1HG       GLU  48 -15.004  -6.393 -11.361
  365    H    ASP  49           H        ASP  49 -15.765  -2.244 -14.452
  366    HA   ASP  49           HA       ASP  49 -17.559  -3.983 -16.098
  367   1HB   ASP  49          2HB       ASP  49 -18.439  -2.004 -14.566
  368   2HB   ASP  49          1HB       ASP  49 -17.923  -1.013 -15.932
  369    H    PHE  50           H        PHE  50 -16.361  -4.417 -17.922
  370    HA   PHE  50           HA       PHE  50 -14.303  -3.129 -19.142
  371   1HB   PHE  50          2HB       PHE  50 -16.087  -5.044 -19.970
  372   2HB   PHE  50          1HB       PHE  50 -16.427  -3.731 -21.097
  373    HD1  PHE  50           HD1      PHE  50 -14.542  -6.587 -20.760
  374    HD2  PHE  50           HD2      PHE  50 -14.066  -2.443 -21.789
  375    HE1  PHE  50           HE1      PHE  50 -12.480  -7.137 -22.025
  376    HE2  PHE  50           HE2      PHE  50 -12.004  -2.994 -23.054
  377    HZ   PHE  50           HZ       PHE  50 -11.212  -5.341 -23.171
  378    H    ASP  51           H        ASP  51 -17.714  -2.135 -19.477
  379    HA   ASP  51           HA       ASP  51 -17.249   0.055 -21.241
  380   1HB   ASP  51          2HB       ASP  51 -19.474  -1.081 -20.145
  381   2HB   ASP  51          1HB       ASP  51 -19.375   0.413 -19.213
  382    H    LYS  52           H        LYS  52 -17.593   0.053 -17.673
  383    HA   LYS  52           HA       LYS  52 -16.942   2.826 -17.365
  384   1HB   LYS  52          2HB       LYS  52 -18.012   1.227 -15.651
  385   2HB   LYS  52          1HB       LYS  52 -16.367   0.698 -15.299
  386   1HG   LYS  52          2HG       LYS  52 -16.565   2.415 -13.760
  387   2HG   LYS  52          1HG       LYS  52 -15.928   3.315 -15.137
  388   1HD   LYS  52          2HD       LYS  52 -17.861   4.491 -14.193
  389   2HD   LYS  52          1HD       LYS  52 -18.251   3.892 -15.805
  390   1HE   LYS  52          2HE       LYS  52 -19.844   2.487 -15.018
  391   2HE   LYS  52          1HE       LYS  52 -18.828   1.952 -13.679
  392   1HZ   LYS  52          1HZ       LYS  52 -20.450   4.433 -13.820
  393   2HZ   LYS  52          2HZ       LYS  52 -19.327   4.105 -12.586
  394   3HZ   LYS  52          3HZ       LYS  52 -20.688   3.109 -12.787
  395    H    LEU  53           H        LEU  53 -15.002   0.090 -18.094
  396    HA   LEU  53           HA       LEU  53 -12.519   1.171 -16.990
  397   1HB   LEU  53          2HB       LEU  53 -12.972  -1.290 -17.325
  398   2HB   LEU  53          1HB       LEU  53 -12.862  -1.013 -19.064
  399    HG   LEU  53           HG       LEU  53 -10.618   0.152 -17.585
  400   1HD1  LEU  53          1HD1      LEU  53  -9.605  -2.251 -17.375
  401   2HD1  LEU  53          2HD1      LEU  53 -11.290  -2.771 -17.320
  402   3HD1  LEU  53          3HD1      LEU  53 -10.669  -1.662 -16.098
  403   1HD2  LEU  53          1HD2      LEU  53 -11.018  -0.375 -20.127
  404   2HD2  LEU  53          2HD2      LEU  53 -10.482  -1.997 -19.687
  405   3HD2  LEU  53          3HD2      LEU  53  -9.412  -0.616 -19.442
  406    H    GLU  54           H        GLU  54 -13.596   0.517 -20.351
  407    HA   GLU  54           HA       GLU  54 -11.528   2.035 -21.585
  408   1HB   GLU  54          2HB       GLU  54 -14.086   0.824 -22.405
  409   2HB   GLU  54          1HB       GLU  54 -13.626   2.241 -23.350
  410   1HG   GLU  54          2HG       GLU  54 -11.545   1.267 -23.987
  411   2HG   GLU  54          1HG       GLU  54 -11.690  -0.009 -22.780
  412    H    LYS  55           H        LYS  55 -14.369   3.034 -19.902
  413    HA   LYS  55           HA       LYS  55 -14.534   5.657 -21.193
  414   1HB   LYS  55          2HB       LYS  55 -16.043   4.152 -19.178
  415   2HB   LYS  55          1HB       LYS  55 -15.892   5.866 -18.789
  416   1HG   LYS  55          2HG       LYS  55 -16.759   6.475 -20.996
  417   2HG   LYS  55          1HG       LYS  55 -16.843   4.774 -21.454
  418   1HD   LYS  55          2HD       LYS  55 -18.556   4.327 -19.846
  419   2HD   LYS  55          1HD       LYS  55 -18.315   5.885 -19.057
  420   1HE   LYS  55          2HE       LYS  55 -18.947   6.930 -21.330
  421   2HE   LYS  55          1HE       LYS  55 -19.550   5.329 -21.754
  422   1HZ   LYS  55          1HZ       LYS  55 -21.197   6.921 -20.730
  423   2HZ   LYS  55          2HZ       LYS  55 -20.359   6.713 -19.267
  424   3HZ   LYS  55          3HZ       LYS  55 -21.103   5.384 -20.020
  425    H    ALA  56           H        ALA  56 -13.496   4.467 -17.978
  426    HA   ALA  56           HA       ALA  56 -12.517   7.047 -17.129
  427   1HB   ALA  56          1HB       ALA  56 -11.095   4.993 -15.770
  428   2HB   ALA  56          2HB       ALA  56 -12.738   4.402 -16.024
  429   3HB   ALA  56          3HB       ALA  56 -12.469   5.926 -15.177
  430    H    ALA  57           H        ALA  57 -11.109   4.329 -18.869
  431    HA   ALA  57           HA       ALA  57  -8.365   5.161 -18.640
  432   1HB   ALA  57          1HB       ALA  57  -8.396   3.014 -19.437
  433   2HB   ALA  57          2HB       ALA  57  -8.398   3.829 -21.001
  434   3HB   ALA  57          3HB       ALA  57  -9.912   3.251 -20.306
  435    H    VAL  58           H        VAL  58 -10.633   5.471 -21.407
  436    HA   VAL  58           HA       VAL  58  -9.057   7.109 -23.036
  437    HB   VAL  58           HB       VAL  58 -12.044   7.044 -22.583
  438   1HG1  VAL  58          1HG1      VAL  58 -10.385   8.906 -24.245
  439   2HG1  VAL  58          2HG1      VAL  58 -11.886   9.221 -23.373
  440   3HG1  VAL  58          3HG1      VAL  58 -11.922   8.336 -24.898
  441   1HG2  VAL  58          1HG2      VAL  58 -10.266   6.205 -24.898
  442   2HG2  VAL  58          2HG2      VAL  58 -12.014   5.987 -24.808
  443   3HG2  VAL  58          3HG2      VAL  58 -10.957   5.111 -23.700
  444    H    GLU  59           H        GLU  59 -11.438   8.236 -20.605
  445    HA   GLU  59           HA       GLU  59 -10.994  10.979 -20.760
  446   1HB   GLU  59          2HB       GLU  59 -11.308   9.391 -18.193
  447   2HB   GLU  59          1HB       GLU  59 -11.656  11.107 -18.404
  448   1HG   GLU  59          2HG       GLU  59 -12.992   9.212 -20.277
  449   2HG   GLU  59          1HG       GLU  59 -13.567   9.232 -18.610
  450    H    ALA  60           H        ALA  60  -9.067   8.591 -18.939
  451    HA   ALA  60           HA       ALA  60  -7.228  10.425 -17.782
  452   1HB   ALA  60          1HB       ALA  60  -7.452   7.944 -17.264
  453   2HB   ALA  60          2HB       ALA  60  -5.795   8.530 -17.419
  454   3HB   ALA  60          3HB       ALA  60  -6.542   7.635 -18.743
  455    H    PHE  61           H        PHE  61  -7.349   8.944 -20.988
  456    HA   PHE  61           HA       PHE  61  -4.727   9.828 -21.814
  457   1HB   PHE  61          2HB       PHE  61  -5.490   8.162 -23.225
  458   2HB   PHE  61          1HB       PHE  61  -7.159   8.728 -23.162
  459    HD1  PHE  61           HD1      PHE  61  -7.914  10.602 -24.565
  460    HD2  PHE  61           HD2      PHE  61  -3.892   9.112 -24.797
  461    HE1  PHE  61           HE1      PHE  61  -7.585  11.822 -26.698
  462    HE2  PHE  61           HE2      PHE  61  -3.563  10.333 -26.931
  463    HZ   PHE  61           HZ       PHE  61  -5.410  11.689 -27.881
  464    H    LYS  62           H        LYS  62  -7.995  11.200 -22.092
  465    HA   LYS  62           HA       LYS  62  -7.346  13.420 -23.743
  466   1HB   LYS  62          2HB       LYS  62  -9.531  12.670 -21.918
  467   2HB   LYS  62          1HB       LYS  62  -9.280  14.411 -22.048
  468   1HG   LYS  62          2HG       LYS  62  -9.364  14.220 -24.522
  469   2HG   LYS  62          1HG       LYS  62  -9.686  12.493 -24.362
  470   1HD   LYS  62          2HD       LYS  62 -11.864  12.844 -23.878
  471   2HD   LYS  62          1HD       LYS  62 -11.476  14.111 -22.713
  472   1HE   LYS  62          2HE       LYS  62 -12.798  14.991 -24.620
  473   2HE   LYS  62          1HE       LYS  62 -11.199  15.731 -24.533
  474   1HZ   LYS  62          1HZ       LYS  62 -10.515  13.873 -26.121
  475   2HZ   LYS  62          2HZ       LYS  62 -11.435  15.155 -26.753
  476   3HZ   LYS  62          3HZ       LYS  62 -12.175  13.665 -26.403
  477    H    MET  63           H        MET  63  -7.013  12.943 -20.251
  478    HA   MET  63           HA       MET  63  -6.367  15.665 -19.612
  479   1HB   MET  63          2HB       MET  63  -6.163  13.027 -18.281
  480   2HB   MET  63          1HB       MET  63  -5.016  14.245 -17.721
  481   1HG   MET  63          2HG       MET  63  -7.090  14.366 -16.408
  482   2HG   MET  63          1HG       MET  63  -6.889  15.830 -17.371
  483   1HE   MET  63          1HE       MET  63 -10.042  12.609 -17.557
  484   2HE   MET  63          2HE       MET  63  -9.599  13.607 -16.175
  485   3HE   MET  63          3HE       MET  63  -8.418  12.494 -16.863
  486    H    GLY  64           H        GLY  64  -4.167  12.843 -19.927
  487   1HA   GLY  64          2HA       GLY  64  -2.292  13.822 -21.674
  488   2HA   GLY  64          1HA       GLY  64  -1.857  14.625 -20.164
  489    H    PHE  65           H        PHE  65  -3.302  11.602 -19.629
  490    HA   PHE  65           HA       PHE  65  -0.671  10.486 -18.856
  491   1HB   PHE  65          2HB       PHE  65  -3.527   9.629 -18.331
  492   2HB   PHE  65          1HB       PHE  65  -2.134   8.656 -17.857
  493    HD1  PHE  65           HD1      PHE  65  -0.800   9.230 -15.961
  494    HD2  PHE  65           HD2      PHE  65  -3.785  11.957 -17.412
  495    HE1  PHE  65           HE1      PHE  65  -0.515  10.622 -13.929
  496    HE2  PHE  65           HE2      PHE  65  -3.502  13.349 -15.379
  497    HZ   PHE  65           HZ       PHE  65  -1.867  12.682 -13.638
  498    H    GLU  66           H        GLU  66   0.264   8.744 -19.900
  499    HA   GLU  66           HA       GLU  66  -0.932   7.956 -22.476
  500   1HB   GLU  66          2HB       GLU  66   1.712   8.157 -21.430
  501   2HB   GLU  66          1HB       GLU  66   1.445   6.466 -21.855
  502   1HG   GLU  66          2HG       GLU  66   0.991   8.853 -23.671
  503   2HG   GLU  66          1HG       GLU  66   2.309   7.689 -23.796
  504    H    VAL  67           H        VAL  67  -2.759   6.760 -21.603
  505    HA   VAL  67           HA       VAL  67  -2.671   4.659 -19.748
  506    HB   VAL  67           HB       VAL  67  -4.817   5.281 -20.513
  507   1HG1  VAL  67          1HG1      VAL  67  -5.418   5.104 -22.961
  508   2HG1  VAL  67          2HG1      VAL  67  -3.712   4.804 -23.294
  509   3HG1  VAL  67          3HG1      VAL  67  -4.217   6.343 -22.597
  510   1HG2  VAL  67          1HG2      VAL  67  -4.365   2.763 -20.302
  511   2HG2  VAL  67          2HG2      VAL  67  -4.320   2.732 -22.064
  512   3HG2  VAL  67          3HG2      VAL  67  -5.793   3.225 -21.229
  513    H    LEU  68           H        LEU  68  -2.354   2.385 -19.968
  514    HA   LEU  68           HA       LEU  68  -0.969   1.542 -22.480
  515   1HB   LEU  68          2HB       LEU  68   0.130   1.715 -19.841
  516   2HB   LEU  68          1HB       LEU  68   0.006   0.009 -20.273
  517    HG   LEU  68           HG       LEU  68   1.189   2.069 -22.145
  518   1HD1  LEU  68          1HD1      LEU  68   3.343   0.703 -21.259
  519   2HD1  LEU  68          2HD1      LEU  68   2.367   0.685 -19.791
  520   3HD1  LEU  68          3HD1      LEU  68   2.814   2.221 -20.533
  521   1HD2  LEU  68          1HD2      LEU  68   0.355  -0.203 -22.965
  522   2HD2  LEU  68          2HD2      LEU  68   1.629  -0.922 -21.980
  523   3HD2  LEU  68          3HD2      LEU  68   2.047   0.157 -23.310
  524    H    GLU  69           H        GLU  69  -1.533  -0.510 -23.216
  525    HA   GLU  69           HA       GLU  69  -4.001  -1.614 -22.765
  526   1HB   GLU  69          2HB       GLU  69  -2.080  -2.362 -24.380
  527   2HB   GLU  69          1HB       GLU  69  -1.673  -3.490 -23.087
  528   1HG   GLU  69          2HG       GLU  69  -4.373  -3.841 -23.232
  529   2HG   GLU  69          1HG       GLU  69  -3.996  -3.481 -24.917
  530    H    ALA  70           H        ALA  70  -4.934  -3.084 -21.325
  531    HA   ALA  70           HA       ALA  70  -3.516  -3.361 -18.736
  532   1HB   ALA  70          1HB       ALA  70  -5.724  -4.037 -17.862
  533   2HB   ALA  70          2HB       ALA  70  -6.387  -3.986 -19.495
  534   3HB   ALA  70          3HB       ALA  70  -5.837  -2.502 -18.721
  535    H    GLU  71           H        GLU  71  -4.239  -5.613 -17.628
  536    HA   GLU  71           HA       GLU  71  -4.175  -7.848 -19.550
  537   1HB   GLU  71          2HB       GLU  71  -1.774  -7.151 -19.188
  538   2HB   GLU  71          1HB       GLU  71  -1.978  -7.556 -17.483
  539   1HG   GLU  71          2HG       GLU  71  -2.815  -9.855 -18.351
  540   2HG   GLU  71          1HG       GLU  71  -2.052  -9.392 -19.872
  541    H    GLU  72           H        GLU  72  -5.693  -9.209 -18.743
  542    HA   GLU  72           HA       GLU  72  -6.958  -9.109 -16.282
  543   1HB   GLU  72          2HB       GLU  72  -6.605 -11.137 -18.361
  544   2HB   GLU  72          1HB       GLU  72  -6.816 -11.847 -16.759
  545   1HG   GLU  72          2HG       GLU  72  -8.850 -10.488 -16.422
  546   2HG   GLU  72          1HG       GLU  72  -8.645  -9.786 -18.027
  547    H    THR  73           H        THR  73  -5.700  -8.782 -14.452
  548    HA   THR  73           HA       THR  73  -3.599 -10.830 -13.881
  549    HB   THR  73           HB       THR  73  -2.850  -8.446 -13.930
  550    HG1  THR  73           HG1      THR  73  -2.162  -8.564 -11.561
  551   1HG2  THR  73          1HG2      THR  73  -4.487  -8.066 -11.426
  552   2HG2  THR  73          2HG2      THR  73  -5.133  -7.658 -13.016
  553   3HG2  THR  73          3HG2      THR  73  -3.691  -6.841 -12.415
  554    H    GLU  74           H        GLU  74  -3.493 -10.320 -11.073
  555    HA   GLU  74           HA       GLU  74  -6.224 -11.072 -10.146
  556   1HB   GLU  74          2HB       GLU  74  -3.848 -12.771 -10.214
  557   2HB   GLU  74          1HB       GLU  74  -4.518 -12.622  -8.588
  558   1HG   GLU  74          2HG       GLU  74  -5.567 -14.503  -9.776
  559   2HG   GLU  74          1HG       GLU  74  -6.752 -13.233  -9.464
  560    H    ASP  75           H        ASP  75  -6.702 -10.340  -8.066
  561    HA   ASP  75           HA       ASP  75  -4.581  -8.667  -6.783
  562   1HB   ASP  75          2HB       ASP  75  -6.895  -7.713  -7.708
  563   2HB   ASP  75          1HB       ASP  75  -7.478  -8.288  -6.146
  564    H    GLU  76           H        GLU  76  -4.612 -11.400  -6.227
  565    HA   GLU  76           HA       GLU  76  -4.690 -12.894  -4.420
  566   1HB   GLU  76          2HB       GLU  76  -5.010 -10.296  -2.886
  567   2HB   GLU  76          1HB       GLU  76  -4.635 -11.860  -2.160
  568   1HG   GLU  76          2HG       GLU  76  -2.459 -11.722  -2.753
  569   2HG   GLU  76          1HG       GLU  76  -2.863 -11.220  -4.396
  570    H    ASP  77           H        ASP  77  -7.279 -11.302  -5.547
  571    HA   ASP  77           HA       ASP  77  -9.135 -12.443  -3.498
  572   1HB   ASP  77          2HB       ASP  77  -9.155  -9.971  -5.089
  573   2HB   ASP  77          1HB       ASP  77 -10.683 -10.850  -5.135
  574    H    GLY  78           H        GLY  78  -7.882 -12.911  -6.598
  575   1HA   GLY  78          2HA       GLY  78  -8.495 -14.346  -8.350
  576   2HA   GLY  78          1HA       GLY  78  -9.444 -15.214  -7.142
  577    H    ASN  79           H        ASN  79  -9.547 -12.509  -9.432
  578    HA   ASN  79           HA       ASN  79 -12.431 -13.010  -9.804
  579   1HB   ASN  79          2HB       ASN  79 -11.340 -10.687  -8.357
  580   2HB   ASN  79          1HB       ASN  79 -12.443 -10.262  -9.667
  581   1HD2  ASN  79          1HD2      ASN  79 -14.624 -11.422  -9.628
  582   2HD2  ASN  79          2HD2      ASN  79 -15.280 -11.839  -8.119
  583    H    LYS  80           H        LYS  80  -9.566 -12.729 -11.180
  584    HA   LYS  80           HA       LYS  80  -8.749 -11.873 -13.234
  585   1HB   LYS  80          2HB       LYS  80 -11.576 -12.727 -13.929
  586   2HB   LYS  80          1HB       LYS  80 -10.304 -12.416 -15.109
  587   1HG   LYS  80          2HG       LYS  80  -9.564 -14.520 -14.846
  588   2HG   LYS  80          1HG       LYS  80  -9.213 -14.172 -13.153
  589   1HD   LYS  80          2HD       LYS  80 -11.366 -14.901 -12.445
  590   2HD   LYS  80          1HD       LYS  80 -11.995 -14.889 -14.093
  591   1HE   LYS  80          2HE       LYS  80 -11.534 -17.112 -14.071
  592   2HE   LYS  80          1HE       LYS  80  -9.862 -16.612 -14.319
  593   1HZ   LYS  80          1HZ       LYS  80 -10.205 -16.351 -11.645
  594   2HZ   LYS  80          2HZ       LYS  80  -9.464 -17.669 -12.417
  595   3HZ   LYS  80          3HZ       LYS  80 -11.108 -17.743 -11.994
  596    H    LEU  81           H        LEU  81  -8.745  -9.618 -12.350
  597    HA   LEU  81           HA       LEU  81 -10.981  -7.940 -13.375
  598   1HB   LEU  81          2HB       LEU  81  -9.819  -6.140 -11.999
  599   2HB   LEU  81          1HB       LEU  81 -10.486  -7.486 -11.072
  600    HG   LEU  81           HG       LEU  81  -7.687  -7.792 -12.035
  601   1HD1  LEU  81          1HD1      LEU  81  -8.492  -5.909  -9.797
  602   2HD1  LEU  81          2HD1      LEU  81  -7.636  -5.476 -11.278
  603   3HD1  LEU  81          3HD1      LEU  81  -6.850  -6.492 -10.070
  604   1HD2  LEU  81          1HD2      LEU  81  -7.495  -9.144 -10.142
  605   2HD2  LEU  81          2HD2      LEU  81  -9.204  -9.340 -10.530
  606   3HD2  LEU  81          3HD2      LEU  81  -8.713  -8.236  -9.246
  607    H    LEU  82           H        LEU  82 -10.280  -5.805 -14.359
  608    HA   LEU  82           HA       LEU  82  -7.976  -6.300 -16.189
  609   1HB   LEU  82          2HB       LEU  82 -10.467  -4.604 -16.424
  610   2HB   LEU  82          1HB       LEU  82  -9.094  -4.397 -17.513
  611    HG   LEU  82           HG       LEU  82  -9.268  -6.965 -17.865
  612   1HD1  LEU  82          1HD1      LEU  82 -10.823  -7.440 -16.049
  613   2HD1  LEU  82          2HD1      LEU  82 -11.611  -7.799 -17.586
  614   3HD1  LEU  82          3HD1      LEU  82 -12.000  -6.312 -16.722
  615   1HD2  LEU  82          1HD2      LEU  82 -11.509  -5.200 -18.900
  616   2HD2  LEU  82          2HD2      LEU  82 -10.849  -6.636 -19.684
  617   3HD2  LEU  82          3HD2      LEU  82  -9.863  -5.182 -19.532
  618    H    CYS  83           H        CYS  83  -6.179  -5.054 -15.935
  619    HA   CYS  83           HA       CYS  83  -6.465  -2.505 -14.401
  620   1HB   CYS  83          2HB       CYS  83  -5.389  -4.041 -12.916
  621   2HB   CYS  83          1HB       CYS  83  -4.332  -4.638 -14.194
  622    HG   CYS  83           HG       CYS  83  -3.483  -2.512 -12.442
  623    H    PHE  84           H        PHE  84  -6.061  -0.871 -15.814
  624    HA   PHE  84           HA       PHE  84  -4.120  -1.332 -18.016
  625   1HB   PHE  84          2HB       PHE  84  -4.981   1.070 -18.640
  626   2HB   PHE  84          1HB       PHE  84  -6.020  -0.323 -18.935
  627    HD1  PHE  84           HD1      PHE  84  -7.525  -1.028 -16.835
  628    HD2  PHE  84           HD2      PHE  84  -5.885   2.885 -17.504
  629    HE1  PHE  84           HE1      PHE  84  -9.257  -0.050 -15.355
  630    HE2  PHE  84           HE2      PHE  84  -7.617   3.863 -16.024
  631    HZ   PHE  84           HZ       PHE  84  -9.303   2.397 -14.949
  632    H    ASP  85           H        ASP  85  -2.373   0.214 -18.348
  633    HA   ASP  85           HA       ASP  85  -1.525   1.462 -15.767
  634   1HB   ASP  85          2HB       ASP  85   0.031   0.362 -18.110
  635   2HB   ASP  85          1HB       ASP  85   0.781   1.400 -16.898
  636    H    ALA  86           H        ALA  86  -0.676   3.585 -15.786
  637    HA   ALA  86           HA       ALA  86  -1.068   5.121 -18.318
  638   1HB   ALA  86          1HB       ALA  86  -2.557   6.527 -17.352
  639   2HB   ALA  86          2HB       ALA  86  -1.576   6.673 -15.894
  640   3HB   ALA  86          3HB       ALA  86  -2.701   5.327 -16.069
  641    H    THR  87           H        THR  87   0.719   6.322 -18.823
  642    HA   THR  87           HA       THR  87   2.771   6.657 -16.675
  643    HB   THR  87           HB       THR  87   3.955   7.203 -19.167
  644    HG1  THR  87           HG1      THR  87   3.260   5.657 -20.492
  645   1HG2  THR  87          1HG2      THR  87   3.960   4.847 -17.284
  646   2HG2  THR  87          2HG2      THR  87   5.184   6.103 -17.471
  647   3HG2  THR  87          3HG2      THR  87   4.978   4.879 -18.724
  648    H    MET  88           H        MET  88   3.941   8.687 -16.626
  649    HA   MET  88           HA       MET  88   2.855  10.939 -18.191
  650   1HB   MET  88          2HB       MET  88   1.356  10.747 -16.197
  651   2HB   MET  88          1HB       MET  88   2.766  10.948 -15.158
  652   1HG   MET  88          2HG       MET  88   3.215  13.146 -16.166
  653   2HG   MET  88          1HG       MET  88   1.828  12.947 -17.237
  654   1HE   MET  88          1HE       MET  88   0.220  14.885 -16.577
  655   2HE   MET  88          2HE       MET  88  -1.019  14.251 -15.497
  656   3HE   MET  88          3HE       MET  88  -0.401  13.244 -16.804
  657    H    GLN  89           H        GLN  89   4.641  12.048 -18.823
  658    HA   GLN  89           HA       GLN  89   7.130  11.778 -17.236
  659   1HB   GLN  89          2HB       GLN  89   6.783  13.216 -19.876
  660   2HB   GLN  89          1HB       GLN  89   8.275  12.592 -19.173
  661   1HG   GLN  89          2HG       GLN  89   6.450  10.416 -19.311
  662   2HG   GLN  89          1HG       GLN  89   6.397  11.235 -20.872
  663   1HE2  GLN  89          1HE2      GLN  89   9.024  10.483 -18.495
  664   2HE2  GLN  89          2HE2      GLN  89  10.082   9.842 -19.656
  665    H    SER  90           H        SER  90   7.807  13.388 -15.906
  666    HA   SER  90           HA       SER  90   7.315  16.194 -16.494
  667   1HB   SER  90          2HB       SER  90   5.190  16.036 -15.564
  668   2HB   SER  90          1HB       SER  90   5.651  14.734 -14.472
  669    HG   SER  90           HG       SER  90   6.637  16.188 -13.157
  670    H    ALA  91           H        ALA  91   8.024  17.503 -14.380
  671    HA   ALA  91           HA       ALA  91  10.701  16.588 -13.757
  672   1HB   ALA  91          1HB       ALA  91   9.045  18.858 -12.616
  673   2HB   ALA  91          2HB       ALA  91  10.235  18.976 -13.911
  674   3HB   ALA  91          3HB       ALA  91  10.754  18.598 -12.268
  675    H    LEU  92           H        LEU  92  11.352  16.698 -11.278
  676    HA   LEU  92           HA       LEU  92   9.604  14.726  -9.914
  677   1HB   LEU  92          2HB       LEU  92  12.069  14.297 -10.162
  678   2HB   LEU  92          1HB       LEU  92  12.368  15.692  -9.124
  679    HG   LEU  92           HG       LEU  92  10.643  14.432  -7.534
  680   1HD1  LEU  92          1HD1      LEU  92  11.181  11.942  -7.703
  681   2HD1  LEU  92          2HD1      LEU  92  11.806  12.280  -9.316
  682   3HD1  LEU  92          3HD1      LEU  92  10.107  12.578  -8.949
  683   1HD2  LEU  92          1HD2      LEU  92  12.620  13.315  -6.465
  684   2HD2  LEU  92          2HD2      LEU  92  12.922  15.000  -6.889
  685   3HD2  LEU  92          3HD2      LEU  92  13.567  13.706  -7.900
  686    H    ASP  93           H        ASP  93   7.990  15.820  -8.831
  687    HA   ASP  93           HA       ASP  93   8.853  17.656  -6.676
  688   1HB   ASP  93          2HB       ASP  93   8.116  18.853  -8.946
  689   2HB   ASP  93          1HB       ASP  93   6.504  18.549  -8.295
  690    H    ALA  94           H        ALA  94   7.559  17.440  -4.863
  691    HA   ALA  94           HA       ALA  94   5.606  15.267  -4.882
  692   1HB   ALA  94          1HB       ALA  94   5.407  15.777  -2.454
  693   2HB   ALA  94          2HB       ALA  94   6.457  17.175  -2.684
  694   3HB   ALA  94          3HB       ALA  94   7.083  15.549  -2.953
  695    H    LYS  95           H        LYS  95   5.482  18.797  -4.326
  696    HA   LYS  95           HA       LYS  95   2.755  19.063  -3.735
  697   1HB   LYS  95          2HB       LYS  95   4.694  20.853  -4.039
  698   2HB   LYS  95          1HB       LYS  95   3.985  21.014  -5.646
  699   1HG   LYS  95          2HG       LYS  95   1.748  21.352  -4.568
  700   2HG   LYS  95          1HG       LYS  95   2.550  21.344  -2.997
  701   1HD   LYS  95          2HD       LYS  95   3.613  23.185  -5.098
  702   2HD   LYS  95          1HD       LYS  95   2.102  23.624  -4.300
  703   1HE   LYS  95          2HE       LYS  95   3.120  24.010  -2.292
  704   2HE   LYS  95          1HE       LYS  95   4.266  22.686  -2.506
  705   1HZ   LYS  95          1HZ       LYS  95   4.385  25.330  -3.851
  706   2HZ   LYS  95          2HZ       LYS  95   5.472  24.050  -4.107
  707   3HZ   LYS  95          3HZ       LYS  95   5.390  24.809  -2.589
  708    H    LEU  96           H        LEU  96   4.249  19.095  -6.991
  709    HA   LEU  96           HA       LEU  96   1.774  19.236  -8.414
  710   1HB   LEU  96          2HB       LEU  96   4.345  19.412  -9.179
  711   2HB   LEU  96          1HB       LEU  96   4.046  17.731  -9.623
  712    HG   LEU  96           HG       LEU  96   1.868  18.667 -10.719
  713   1HD1  LEU  96          1HD1      LEU  96   2.901  21.030  -9.649
  714   2HD1  LEU  96          2HD1      LEU  96   1.614  20.909 -10.849
  715   3HD1  LEU  96          3HD1      LEU  96   3.285  21.133 -11.367
  716   1HD2  LEU  96          1HD2      LEU  96   3.702  17.700 -12.009
  717   2HD2  LEU  96          2HD2      LEU  96   4.636  19.188 -11.847
  718   3HD2  LEU  96          3HD2      LEU  96   3.155  19.176 -12.805
  719    H    ILE  97           H        ILE  97   3.852  16.409  -7.687
  720    HA   ILE  97           HA       ILE  97   2.220  14.413  -8.796
  721    HB   ILE  97           HB       ILE  97   4.020  14.411  -6.369
  722   1HG1  ILE  97          2HG1      ILE  97   4.273  12.953  -9.011
  723   2HG1  ILE  97          1HG1      ILE  97   4.891  14.587  -8.771
  724   1HG2  ILE  97          1HG2      ILE  97   2.840  12.585  -5.691
  725   2HG2  ILE  97          2HG2      ILE  97   3.690  11.770  -7.003
  726   3HG2  ILE  97          3HG2      ILE  97   2.060  12.388  -7.260
  727   1HD1  ILE  97          1HD1      ILE  97   5.982  13.454  -6.611
  728   2HD1  ILE  97          2HD1      ILE  97   6.777  13.394  -8.184
  729   3HD1  ILE  97          3HD1      ILE  97   5.849  12.008  -7.611
  730    H    ASP  98           H        ASP  98   1.799  16.233  -5.823
  731    HA   ASP  98           HA       ASP  98  -0.216  14.510  -4.676
  732   1HB   ASP  98          2HB       ASP  98   0.789  16.001  -3.148
  733   2HB   ASP  98          1HB       ASP  98   0.599  17.380  -4.232
  734    H    GLU  99           H        GLU  99  -0.371  17.471  -6.666
  735    HA   GLU  99           HA       GLU  99  -3.257  17.536  -6.739
  736   1HB   GLU  99          2HB       GLU  99  -1.344  18.687  -8.790
  737   2HB   GLU  99          1HB       GLU  99  -2.996  19.210  -8.461
  738   1HG   GLU  99          2HG       GLU  99  -0.765  19.301  -6.412
  739   2HG   GLU  99          1HG       GLU  99  -1.233  20.676  -7.414
  740    H    GLN 100           H        GLN 100  -0.766  16.169  -8.871
  741    HA   GLN 100           HA       GLN 100  -2.510  15.339 -10.971
  742   1HB   GLN 100          2HB       GLN 100   0.016  13.944 -10.035
  743   2HB   GLN 100          1HB       GLN 100  -0.712  13.847 -11.639
  744   1HG   GLN 100          2HG       GLN 100   0.087  16.511 -10.483
  745   2HG   GLN 100          1HG       GLN 100   1.279  15.487 -11.286
  746   1HE2  GLN 100          1HE2      GLN 100  -0.008  14.438 -13.448
  747   2HE2  GLN 100          2HE2      GLN 100  -0.634  15.655 -14.451
  748    H    VAL 101           H        VAL 101  -1.259  13.490  -8.166
  749    HA   VAL 101           HA       VAL 101  -2.764  11.127  -8.663
  750    HB   VAL 101           HB       VAL 101  -1.717  12.340  -6.092
  751   1HG1  VAL 101          1HG1      VAL 101  -3.358  10.972  -5.201
  752   2HG1  VAL 101          2HG1      VAL 101  -2.068   9.787  -5.409
  753   3HG1  VAL 101          3HG1      VAL 101  -3.367   9.896  -6.598
  754   1HG2  VAL 101          1HG2      VAL 101  -0.822   9.910  -7.671
  755   2HG2  VAL 101          2HG2      VAL 101   0.017  10.667  -6.317
  756   3HG2  VAL 101          3HG2      VAL 101  -0.110  11.513  -7.860
  757    H    GLU 102           H        GLU 102  -3.530  13.936  -6.582
  758    HA   GLU 102           HA       GLU 102  -6.080  13.047  -5.719
  759   1HB   GLU 102          2HB       GLU 102  -5.123  14.984  -4.669
  760   2HB   GLU 102          1HB       GLU 102  -4.994  15.831  -6.212
  761   1HG   GLU 102          2HG       GLU 102  -7.160  16.497  -6.157
  762   2HG   GLU 102          1HG       GLU 102  -7.721  14.921  -5.599
  763    H    LYS 103           H        LYS 103  -5.007  14.310  -8.779
  764    HA   LYS 103           HA       LYS 103  -7.622  15.039  -9.791
  765   1HB   LYS 103          2HB       LYS 103  -5.017  15.379 -10.654
  766   2HB   LYS 103          1HB       LYS 103  -5.642  14.178 -11.784
  767   1HG   LYS 103          2HG       LYS 103  -7.719  15.774 -11.911
  768   2HG   LYS 103          1HG       LYS 103  -6.595  16.984 -11.290
  769   1HD   LYS 103          2HD       LYS 103  -5.010  16.184 -13.177
  770   2HD   LYS 103          1HD       LYS 103  -6.449  15.441 -13.877
  771   1HE   LYS 103          2HE       LYS 103  -7.181  18.075 -13.114
  772   2HE   LYS 103          1HE       LYS 103  -5.638  18.199 -13.958
  773   1HZ   LYS 103          1HZ       LYS 103  -6.513  17.123 -15.835
  774   2HZ   LYS 103          2HZ       LYS 103  -7.695  18.256 -15.382
  775   3HZ   LYS 103          3HZ       LYS 103  -7.903  16.610 -15.010
  776    H    LEU 104           H        LEU 104  -5.503  12.207 -10.362
  777    HA   LEU 104           HA       LEU 104  -7.464  10.764 -11.890
  778   1HB   LEU 104          2HB       LEU 104  -5.183   9.615 -10.255
  779   2HB   LEU 104          1HB       LEU 104  -5.994   8.850 -11.622
  780    HG   LEU 104           HG       LEU 104  -4.562  11.506 -11.849
  781   1HD1  LEU 104          1HD1      LEU 104  -2.617  10.365 -12.619
  782   2HD1  LEU 104          2HD1      LEU 104  -3.464   8.820 -12.698
  783   3HD1  LEU 104          3HD1      LEU 104  -3.081   9.536 -11.133
  784   1HD2  LEU 104          1HD2      LEU 104  -4.546  10.107 -14.270
  785   2HD2  LEU 104          2HD2      LEU 104  -5.606  11.454 -13.854
  786   3HD2  LEU 104          3HD2      LEU 104  -6.148   9.795 -13.602
  787    H    VAL 105           H        VAL 105  -6.831  11.063  -8.448
  788    HA   VAL 105           HA       VAL 105  -8.341   8.785  -7.583
  789    HB   VAL 105           HB       VAL 105  -7.675  11.412  -6.230
  790   1HG1  VAL 105          1HG1      VAL 105  -9.676  10.626  -5.162
  791   2HG1  VAL 105          2HG1      VAL 105  -8.335  10.144  -4.124
  792   3HG1  VAL 105          3HG1      VAL 105  -9.105   8.958  -5.179
  793   1HG2  VAL 105          1HG2      VAL 105  -6.088   9.250  -6.851
  794   2HG2  VAL 105          2HG2      VAL 105  -6.626   8.848  -5.219
  795   3HG2  VAL 105          3HG2      VAL 105  -5.782  10.367  -5.520
  796    H    ASN 106           H        ASN 106  -9.273  12.240  -7.795
  797    HA   ASN 106           HA       ASN 106 -12.000  11.868  -7.088
  798   1HB   ASN 106          2HB       ASN 106 -10.451  13.959  -8.553
  799   2HB   ASN 106          1HB       ASN 106 -12.209  13.991  -8.700
  800   1HD2  ASN 106          1HD2      ASN 106  -9.548  14.700  -6.583
  801   2HD2  ASN 106          2HD2      ASN 106 -10.471  15.172  -5.240
  802    H    LEU 107           H        LEU 107 -10.382  11.719 -10.255
  803    HA   LEU 107           HA       LEU 107 -12.791  11.372 -11.785
  804   1HB   LEU 107          2HB       LEU 107 -10.838  12.003 -12.994
  805   2HB   LEU 107          1HB       LEU 107  -9.893  10.682 -12.305
  806    HG   LEU 107           HG       LEU 107 -12.319   9.792 -13.709
  807   1HD1  LEU 107          1HD1      LEU 107 -10.139  11.321 -15.141
  808   2HD1  LEU 107          2HD1      LEU 107 -11.883  11.555 -15.253
  809   3HD1  LEU 107          3HD1      LEU 107 -11.139  10.123 -15.963
  810   1HD2  LEU 107          1HD2      LEU 107 -10.197   8.522 -12.808
  811   2HD2  LEU 107          2HD2      LEU 107  -9.480   9.024 -14.338
  812   3HD2  LEU 107          3HD2      LEU 107 -10.928   8.017 -14.330
  813    H    ALA 108           H        ALA 108 -10.554   9.086 -10.238
  814    HA   ALA 108           HA       ALA 108 -11.660   6.690 -11.288
  815   1HB   ALA 108          1HB       ALA 108  -9.626   6.459 -10.101
  816   2HB   ALA 108          2HB       ALA 108 -10.820   5.709  -9.042
  817   3HB   ALA 108          3HB       ALA 108 -10.242   7.341  -8.704
  818    H    GLU 109           H        GLU 109 -12.291   8.049  -8.028
  819    HA   GLU 109           HA       GLU 109 -14.554   6.412  -7.502
  820   1HB   GLU 109          2HB       GLU 109 -13.143   8.304  -6.090
  821   2HB   GLU 109          1HB       GLU 109 -14.682   9.122  -6.357
  822   1HG   GLU 109          2HG       GLU 109 -14.938   7.896  -4.320
  823   2HG   GLU 109          1HG       GLU 109 -15.810   6.980  -5.550
  824    H    LYS 110           H        LYS 110 -14.231   9.426  -9.284
  825    HA   LYS 110           HA       LYS 110 -16.975  10.176  -9.379
  826   1HB   LYS 110          2HB       LYS 110 -15.171  11.649 -10.176
  827   2HB   LYS 110          1HB       LYS 110 -14.830  10.530 -11.497
  828   1HG   LYS 110          2HG       LYS 110 -17.036  10.890 -12.445
  829   2HG   LYS 110          1HG       LYS 110 -17.508  11.882 -11.066
  830   1HD   LYS 110          2HD       LYS 110 -15.443  13.340 -11.708
  831   2HD   LYS 110          1HD       LYS 110 -15.560  12.526 -13.269
  832   1HE   LYS 110          2HE       LYS 110 -18.193  13.265 -12.650
  833   2HE   LYS 110          1HE       LYS 110 -17.213  14.655 -12.187
  834   1HZ   LYS 110          1HZ       LYS 110 -16.404  14.906 -14.319
  835   2HZ   LYS 110          2HZ       LYS 110 -18.015  14.448 -14.606
  836   3HZ   LYS 110          3HZ       LYS 110 -16.763  13.310 -14.769
  837    H    PHE 111           H        PHE 111 -15.140   7.785 -11.216
  838    HA   PHE 111           HA       PHE 111 -17.498   7.235 -12.923
  839   1HB   PHE 111          2HB       PHE 111 -14.605   6.464 -12.964
  840   2HB   PHE 111          1HB       PHE 111 -15.766   5.403 -13.764
  841    HD1  PHE 111           HD1      PHE 111 -17.679   6.893 -15.087
  842    HD2  PHE 111           HD2      PHE 111 -13.597   8.016 -14.367
  843    HE1  PHE 111           HE1      PHE 111 -17.765   8.444 -17.021
  844    HE2  PHE 111           HE2      PHE 111 -13.683   9.567 -16.301
  845    HZ   PHE 111           HZ       PHE 111 -15.767   9.781 -17.626
  846    H    ASP 112           H        ASP 112 -15.228   4.938 -11.415
  847    HA   ASP 112           HA       ASP 112 -16.808   3.817  -9.433
  848   1HB   ASP 112          2HB       ASP 112 -17.888   3.280 -12.095
  849   2HB   ASP 112          1HB       ASP 112 -17.542   1.796 -11.207
  850    H    ILE 113           H        ILE 113 -14.059   4.074 -10.233
  851    HA   ILE 113           HA       ILE 113 -13.269   1.187 -10.271
  852    HB   ILE 113           HB       ILE 113 -11.231   1.840 -11.466
  853   1HG1  ILE 113          2HG1      ILE 113 -12.430   4.625 -11.322
  854   2HG1  ILE 113          1HG1      ILE 113 -10.946   4.082 -10.537
  855   1HG2  ILE 113          1HG2      ILE 113 -13.292   3.256 -13.073
  856   2HG2  ILE 113          2HG2      ILE 113 -13.695   1.618 -12.558
  857   3HG2  ILE 113          3HG2      ILE 113 -12.245   1.907 -13.520
  858   1HD1  ILE 113          1HD1      ILE 113 -11.469   4.432 -13.490
  859   2HD1  ILE 113          2HD1      ILE 113 -10.116   3.474 -12.891
  860   3HD1  ILE 113          3HD1      ILE 113 -10.219   5.193 -12.507
  861    H    ILE 114           H        ILE 114 -10.795   1.144  -9.446
  862    HA   ILE 114           HA       ILE 114 -10.697   2.823  -6.973
  863    HB   ILE 114           HB       ILE 114 -11.084   0.751  -6.032
  864   1HG1  ILE 114          2HG1      ILE 114  -8.995  -0.220  -5.265
  865   2HG1  ILE 114          1HG1      ILE 114  -8.120   0.479  -6.626
  866   1HG2  ILE 114          1HG2      ILE 114  -9.891  -1.322  -7.215
  867   2HG2  ILE 114          2HG2      ILE 114  -9.944  -0.242  -8.607
  868   3HG2  ILE 114          3HG2      ILE 114 -11.438  -0.700  -7.790
  869   1HD1  ILE 114          1HD1      ILE 114  -8.399   1.646  -4.131
  870   2HD1  ILE 114          2HD1      ILE 114  -9.626   2.472  -5.090
  871   3HD1  ILE 114          3HD1      ILE 114  -7.940   2.493  -5.606
  872    H    TYR 115           H        TYR 115  -8.945   4.137  -6.990
  873    HA   TYR 115           HA       TYR 115  -6.633   3.406  -8.720
  874   1HB   TYR 115          2HB       TYR 115  -7.236   5.585  -9.285
  875   2HB   TYR 115          1HB       TYR 115  -7.727   5.983  -7.638
  876    HD1  TYR 115           HD1      TYR 115  -4.813   5.445  -9.870
  877    HD2  TYR 115           HD2      TYR 115  -6.152   6.800  -6.020
  878    HE1  TYR 115           HE1      TYR 115  -2.574   6.417  -9.432
  879    HE2  TYR 115           HE2      TYR 115  -3.914   7.772  -5.583
  880    HH   TYR 115           HH       TYR 115  -1.371   7.089  -6.673
  881    H    ASP 116           H        ASP 116  -5.134   2.247  -7.584
  882    HA   ASP 116           HA       ASP 116  -3.937   3.440  -5.197
  883   1HB   ASP 116          2HB       ASP 116  -5.830   2.274  -4.170
  884   2HB   ASP 116          1HB       ASP 116  -5.394   0.786  -5.009
  885    H    GLY 117           H        GLY 117  -2.083   3.368  -6.621
  886   1HA   GLY 117          2HA       GLY 117  -0.232   1.367  -6.257
  887   2HA   GLY 117          1HA       GLY 117  -1.148   0.798  -7.655
  888    H    TRP 118           H        TRP 118   0.778   3.540  -6.462
  889    HA   TRP 118           HA       TRP 118   1.414   4.157  -9.319
  890   1HB   TRP 118          2HB       TRP 118   1.226   6.431  -8.946
  891   2HB   TRP 118          1HB       TRP 118   0.013   5.849  -7.808
  892    HD1  TRP 118           HD1      TRP 118   0.487   6.118  -5.257
  893    HE1  TRP 118           HE1      TRP 118   2.326   7.326  -3.913
  894    HE3  TRP 118           HE3      TRP 118   3.827   7.066  -8.996
  895    HZ2  TRP 118           HZ2      TRP 118   4.881   8.536  -4.368
  896    HZ3  TRP 118           HZ3      TRP 118   5.954   8.246  -8.516
  897    HH2  TRP 118           HH2      TRP 118   6.484   8.982  -6.209
  898    H    GLY 119           H        GLY 119   3.601   5.034  -9.646
  899   1HA   GLY 119          2HA       GLY 119   5.570   5.120  -7.569
  900   2HA   GLY 119          1HA       GLY 119   5.632   3.545  -8.361
  901    H    THR 120           H        THR 120   7.884   4.886  -8.709
  902    HA   THR 120           HA       THR 120   7.741   5.736 -11.547
  903    HB   THR 120           HB       THR 120   7.711   7.885 -10.599
  904    HG1  THR 120           HG1      THR 120   9.410   8.273 -11.756
  905   1HG2  THR 120          1HG2      THR 120   9.664   6.862  -8.518
  906   2HG2  THR 120          2HG2      THR 120   7.944   7.147  -8.259
  907   3HG2  THR 120          3HG2      THR 120   9.021   8.502  -8.601
  908    H    TYR 121           H        TYR 121   9.871   5.631 -12.599
  909    HA   TYR 121           HA       TYR 121  11.558   3.540 -11.354
  910   1HB   TYR 121          2HB       TYR 121  11.377   4.700 -14.139
  911   2HB   TYR 121          1HB       TYR 121  12.698   3.637 -13.659
  912    HD1  TYR 121           HD1      TYR 121   9.039   3.877 -14.153
  913    HD2  TYR 121           HD2      TYR 121  12.342   1.280 -13.264
  914    HE1  TYR 121           HE1      TYR 121   7.585   1.902 -14.517
  915    HE2  TYR 121           HE2      TYR 121  10.888  -0.695 -13.628
  916    HH   TYR 121           HH       TYR 121   7.693  -0.398 -14.979
  917    H    TYR 122           H        TYR 122  13.536   3.990 -10.494
  918    HA   TYR 122           HA       TYR 122  14.422   6.779 -10.385
  919   1HB   TYR 122          2HB       TYR 122  14.763   5.584  -8.367
  920   2HB   TYR 122          1HB       TYR 122  15.439   4.190  -9.210
  921    HD1  TYR 122           HD1      TYR 122  17.662   3.965  -8.502
  922    HD2  TYR 122           HD2      TYR 122  16.160   7.851  -9.550
  923    HE1  TYR 122           HE1      TYR 122  19.940   4.913  -8.251
  924    HE2  TYR 122           HE2      TYR 122  18.439   8.799  -9.299
  925    HH   TYR 122           HH       TYR 122  21.070   6.925  -7.960
  926    H    GLU 123           H        GLU 123  16.345   7.589 -11.317
  927    HA   GLU 123           HA       GLU 123  17.104   6.430 -13.843
  928   1HB   GLU 123          2HB       GLU 123  18.143   8.702 -12.162
  929   2HB   GLU 123          1HB       GLU 123  19.019   8.185 -13.603
  930   1HG   GLU 123          2HG       GLU 123  17.486   9.098 -14.993
  931   2HG   GLU 123          1HG       GLU 123  16.135   8.458 -14.054
  932    H    GLY 124           H        GLY 124  19.744   6.371 -14.133
  933   1HA   GLY 124          2HA       GLY 124  21.779   5.337 -13.477
  934   2HA   GLY 124          1HA       GLY 124  21.054   4.975 -11.908
  935    H    LEU 125           H        LEU 125  19.648   4.156 -15.051
  936    HA   LEU 125           HA       LEU 125  19.738   1.294 -14.231
  937   1HB   LEU 125          2HB       LEU 125  17.657   2.805 -15.203
  938   2HB   LEU 125          1HB       LEU 125  18.240   2.014 -16.667
  939    HG   LEU 125           HG       LEU 125  16.519   0.643 -15.552
  940   1HD1  LEU 125          1HD1      LEU 125  17.720  -1.433 -15.590
  941   2HD1  LEU 125          2HD1      LEU 125  19.237  -0.637 -15.174
  942   3HD1  LEU 125          3HD1      LEU 125  18.512  -0.378 -16.760
  943   1HD2  LEU 125          1HD2      LEU 125  17.628   1.573 -13.218
  944   2HD2  LEU 125          2HD2      LEU 125  18.267  -0.071 -13.282
  945   3HD2  LEU 125          3HD2      LEU 125  16.524   0.199 -13.318
  946    H    GLU 126           H        GLU 126  21.898   0.822 -14.863
  947    HA   GLU 126           HA       GLU 126  23.080   1.536 -17.346
  948   1HB   GLU 126          2HB       GLU 126  24.286   0.557 -15.367
  949   2HB   GLU 126          1HB       GLU 126  23.587  -1.009 -15.780
  950   1HG   GLU 126          2HG       GLU 126  25.652  -1.097 -16.877
  951   2HG   GLU 126          1HG       GLU 126  24.581  -0.526 -18.158
  952    H    HIS 127           H        HIS 127  22.657   0.845 -19.383
  953    HA   HIS 127           HA       HIS 127  20.731  -1.372 -19.750
  954   1HB   HIS 127          2HB       HIS 127  21.989   0.420 -21.848
  955   2HB   HIS 127          1HB       HIS 127  20.564  -0.603 -22.040
  956    HD2  HIS 127           HD2      HIS 127  18.627   0.251 -19.683
  957    HE1  HIS 127           HE1      HIS 127  19.522   4.280 -20.588
  958    HE2  HIS 127           HE2      HIS 127  17.907   2.741 -19.380
  959    H    HIS 128           H        HIS 128  22.454  -1.273 -22.528
  960    HA   HIS 128           HA       HIS 128  23.942  -2.802 -23.511
  961   1HB   HIS 128          2HB       HIS 128  25.323  -1.451 -21.629
  962   2HB   HIS 128          1HB       HIS 128  25.469  -3.082 -20.972
  963    HD2  HIS 128           HD2      HIS 128  26.460  -1.150 -24.289
  964    HE1  HIS 128           HE1      HIS 128  28.626  -4.773 -24.129
  965    HE2  HIS 128           HE2      HIS 128  28.315  -2.603 -25.406
  966    H    HIS 129           H        HIS 129  21.593  -3.889 -22.176
  967    HA   HIS 129           HA       HIS 129  22.315  -6.196 -20.605
  968   1HB   HIS 129          2HB       HIS 129  19.840  -5.413 -22.150
  969   2HB   HIS 129          1HB       HIS 129  19.962  -6.970 -21.327
  970    HD2  HIS 129           HD2      HIS 129  18.503  -3.717 -20.436
  971    HE1  HIS 129           HE1      HIS 129  20.278  -4.975 -16.817
  972    HE2  HIS 129           HE2      HIS 129  18.640  -3.342 -17.859
  973    H    HIS 130           H        HIS 130  22.706  -5.497 -23.890
  974    HA   HIS 130           HA       HIS 130  22.281  -8.165 -24.956
  975   1HB   HIS 130          2HB       HIS 130  23.713  -5.709 -25.989
  976   2HB   HIS 130          1HB       HIS 130  23.678  -7.225 -26.891
  977    HD2  HIS 130           HD2      HIS 130  20.589  -8.109 -26.670
  978    HE1  HIS 130           HE1      HIS 130  19.612  -4.168 -27.833
  979    HE2  HIS 130           HE2      HIS 130  18.732  -6.537 -27.609
  980    H    HIS 131           H        HIS 131  24.310  -9.205 -26.123
  981    HA   HIS 131           HA       HIS 131  26.675  -9.070 -24.307
  982   1HB   HIS 131          2HB       HIS 131  24.988 -11.053 -23.916
  983   2HB   HIS 131          1HB       HIS 131  25.732 -11.717 -25.370
  984    HD2  HIS 131           HD2      HIS 131  26.979 -13.688 -23.587
  985    HE1  HIS 131           HE1      HIS 131  29.745 -10.916 -22.004
  986    HE2  HIS 131           HE2      HIS 131  29.155 -13.376 -22.183
  987    H    HIS 132           HN       HIS 132  25.366 -10.224 -27.414
  988    HA   HIS 132           HA       HIS 132  28.091  -9.785 -28.573
  989   1HB   HIS 132          2HB       HIS 132  27.658 -11.630 -30.127
  990   2HB   HIS 132          1HB       HIS 132  27.502 -12.202 -28.466
  991    HD2  HIS 132           HD2      HIS 132  24.733 -12.547 -27.605
  992    HE1  HIS 132           HE1      HIS 132  23.193 -12.544 -31.537
  993    HE2  HIS 132           HE2      HIS 132  22.657 -13.036 -29.107
  Start of MODEL   11
    1   1H    MET   1          1H        MET   1 -27.248  13.830  12.096
    2   2H    MET   1          2H        MET   1 -28.755  14.378  12.658
    3   3H    MET   1          3H        MET   1 -27.328  14.832  13.462
    4    HA   MET   1           HA       MET   1 -28.623  16.246  11.497
    5   1HB   MET   1          2HB       MET   1 -26.076  16.376  13.024
    6   2HB   MET   1          1HB       MET   1 -26.173  17.391  11.584
    7   1HG   MET   1          2HG       MET   1 -26.981  18.571  13.622
    8   2HG   MET   1          1HG       MET   1 -28.242  18.408  12.400
    9   1HE   MET   1          1HE       MET   1 -26.574  17.340  15.426
   10   2HE   MET   1          2HE       MET   1 -27.699  16.404  16.407
   11   3HE   MET   1          3HE       MET   1 -27.915  18.146  16.252
   12    H    SER   2           H        SER   2 -28.768  14.746   9.642
   13    HA   SER   2           HA       SER   2 -28.025  13.878   7.586
   14   1HB   SER   2          2HB       SER   2 -26.018  15.560   6.763
   15   2HB   SER   2          1HB       SER   2 -27.737  15.884   6.560
   16    HG   SER   2           HG       SER   2 -25.997  17.269   7.952
   17    H    HIS   3           H        HIS   3 -26.715  12.838   9.988
   18    HA   HIS   3           HA       HIS   3 -23.889  12.669   9.718
   19   1HB   HIS   3          2HB       HIS   3 -25.845  11.559  11.402
   20   2HB   HIS   3          1HB       HIS   3 -25.055  10.173  10.651
   21    HD2  HIS   3           HD2      HIS   3 -23.139   9.439  12.512
   22    HE1  HIS   3           HE1      HIS   3 -21.579  13.284  13.295
   23    HE2  HIS   3           HE2      HIS   3 -21.315  10.807  13.777
   24    H    GLN   4           H        GLN   4 -26.392  11.353   7.777
   25    HA   GLN   4           HA       GLN   4 -25.074   9.000   6.801
   26   1HB   GLN   4          2HB       GLN   4 -27.208  10.810   5.660
   27   2HB   GLN   4          1HB       GLN   4 -26.589   9.428   4.754
   28   1HG   GLN   4          2HG       GLN   4 -27.377   8.928   7.581
   29   2HG   GLN   4          1HG       GLN   4 -28.682   9.225   6.434
   30   1HE2  GLN   4          1HE2      GLN   4 -28.392   6.648   7.587
   31   2HE2  GLN   4          2HE2      GLN   4 -27.886   5.559   6.387
   32    H    ASP   5           H        ASP   5 -24.701   9.100   4.161
   33    HA   ASP   5           HA       ASP   5 -22.970   9.634   2.649
   34   1HB   ASP   5          2HB       ASP   5 -24.035  12.384   3.360
   35   2HB   ASP   5          1HB       ASP   5 -23.035  12.020   1.953
   36    H    ASP   6           H        ASP   6 -22.183  12.738   3.680
   37    HA   ASP   6           HA       ASP   6 -20.183  13.584   4.579
   38   1HB   ASP   6          2HB       ASP   6 -21.065  11.451   6.503
   39   2HB   ASP   6          1HB       ASP   6 -19.522  12.268   6.758
   40    H    TYR   7           H        TYR   7 -19.014  12.806   2.640
   41    HA   TYR   7           HA       TYR   7 -17.843  10.430   2.055
   42   1HB   TYR   7          2HB       TYR   7 -15.749  12.462   2.120
   43   2HB   TYR   7          1HB       TYR   7 -16.488  11.663   0.732
   44    HD1  TYR   7           HD1      TYR   7 -16.959  14.405   3.211
   45    HD2  TYR   7           HD2      TYR   7 -18.170  12.740  -0.559
   46    HE1  TYR   7           HE1      TYR   7 -18.266  16.457   2.724
   47    HE2  TYR   7           HE2      TYR   7 -19.476  14.791  -1.046
   48    HH   TYR   7           HH       TYR   7 -20.312  16.691  -0.159
   49    H    LEU   8           H        LEU   8 -16.297   9.052   2.905
   50    HA   LEU   8           HA       LEU   8 -14.621   9.932   5.163
   51   1HB   LEU   8          2HB       LEU   8 -16.876   9.162   6.103
   52   2HB   LEU   8          1HB       LEU   8 -16.445   7.547   5.538
   53    HG   LEU   8           HG       LEU   8 -14.169   8.543   6.898
   54   1HD1  LEU   8          1HD1      LEU   8 -16.734   8.925   8.472
   55   2HD1  LEU   8          2HD1      LEU   8 -15.650  10.214   7.949
   56   3HD1  LEU   8          3HD1      LEU   8 -15.103   9.025   9.132
   57   1HD2  LEU   8          1HD2      LEU   8 -16.302   6.559   7.758
   58   2HD2  LEU   8          2HD2      LEU   8 -14.681   6.676   8.445
   59   3HD2  LEU   8          3HD2      LEU   8 -14.893   6.190   6.762
   60    H    SER   9           H        SER   9 -14.382   8.803   2.360
   61    HA   SER   9           HA       SER   9 -12.454   6.661   3.084
   62   1HB   SER   9          2HB       SER   9 -14.519   6.415   0.877
   63   2HB   SER   9          1HB       SER   9 -13.234   5.256   1.210
   64    HG   SER   9           HG       SER   9 -14.192   5.198   3.403
   65    H    VAL  10           H        VAL  10 -13.750   8.253   0.143
   66    HA   VAL  10           HA       VAL  10 -11.356   8.238  -1.333
   67    HB   VAL  10           HB       VAL  10 -13.385   8.910  -2.427
   68   1HG1  VAL  10          1HG1      VAL  10 -13.485  11.363  -0.661
   69   2HG1  VAL  10          2HG1      VAL  10 -14.349   9.879  -0.260
   70   3HG1  VAL  10          3HG1      VAL  10 -14.737  10.752  -1.742
   71   1HG2  VAL  10          1HG2      VAL  10 -11.288  10.025  -3.200
   72   2HG2  VAL  10          2HG2      VAL  10 -11.641  11.376  -2.122
   73   3HG2  VAL  10          3HG2      VAL  10 -12.719  11.019  -3.472
   74    H    GLU  11           H        GLU  11 -12.327  10.283   1.334
   75    HA   GLU  11           HA       GLU  11 -10.154  12.206   0.899
   76   1HB   GLU  11          2HB       GLU  11 -12.369  12.791   1.978
   77   2HB   GLU  11          1HB       GLU  11 -11.861  11.843   3.375
   78   1HG   GLU  11          2HG       GLU  11 -10.920  13.768   4.114
   79   2HG   GLU  11          1HG       GLU  11  -9.660  13.441   2.923
   80    H    GLU  12           H        GLU  12 -10.709   9.281   2.742
   81    HA   GLU  12           HA       GLU  12  -8.525   9.586   4.588
   82   1HB   GLU  12          2HB       GLU  12  -9.620   6.972   3.520
   83   2HB   GLU  12          1HB       GLU  12  -8.837   7.255   5.076
   84   1HG   GLU  12          2HG       GLU  12 -11.336   8.767   4.352
   85   2HG   GLU  12          1HG       GLU  12 -11.447   7.125   4.986
   86    H    LEU  13           H        LEU  13  -8.789   7.902   1.449
   87    HA   LEU  13           HA       LEU  13  -6.072   6.993   1.398
   88   1HB   LEU  13          2HB       LEU  13  -7.666   7.684  -1.069
   89   2HB   LEU  13          1HB       LEU  13  -6.473   6.402  -0.858
   90    HG   LEU  13           HG       LEU  13  -9.242   6.541   0.365
   91   1HD1  LEU  13          1HD1      LEU  13  -9.300   4.246  -0.840
   92   2HD1  LEU  13          2HD1      LEU  13  -7.886   4.831  -1.718
   93   3HD1  LEU  13          3HD1      LEU  13  -9.419   5.698  -1.832
   94   1HD2  LEU  13          1HD2      LEU  13  -7.852   5.632   2.076
   95   2HD2  LEU  13          2HD2      LEU  13  -6.890   4.718   0.914
   96   3HD2  LEU  13          3HD2      LEU  13  -8.550   4.233   1.260
   97    H    ILE  14           H        ILE  14  -7.525  10.088   0.722
   98    HA   ILE  14           HA       ILE  14  -5.349  11.116  -0.890
   99    HB   ILE  14           HB       ILE  14  -7.709  12.301   0.530
  100   1HG1  ILE  14          2HG1      ILE  14  -6.741  12.813  -2.278
  101   2HG1  ILE  14          1HG1      ILE  14  -7.580  11.313  -1.885
  102   1HG2  ILE  14          1HG2      ILE  14  -5.989  13.894   1.092
  103   2HG2  ILE  14          2HG2      ILE  14  -6.888  14.561  -0.270
  104   3HG2  ILE  14          3HG2      ILE  14  -5.310  13.817  -0.534
  105   1HD1  ILE  14          1HD1      ILE  14  -9.582  12.350  -1.770
  106   2HD1  ILE  14          2HD1      ILE  14  -8.793  13.730  -2.533
  107   3HD1  ILE  14          3HD1      ILE  14  -8.930  13.653  -0.777
  108    H    GLU  15           H        GLU  15  -6.213  11.439   2.565
  109    HA   GLU  15           HA       GLU  15  -3.985  13.078   3.275
  110   1HB   GLU  15          2HB       GLU  15  -6.154  12.241   4.622
  111   2HB   GLU  15          1HB       GLU  15  -4.986  11.074   5.244
  112   1HG   GLU  15          2HG       GLU  15  -4.665  12.806   6.750
  113   2HG   GLU  15          1HG       GLU  15  -3.477  13.241   5.520
  114    H    ILE  16           H        ILE  16  -4.403   9.534   3.632
  115    HA   ILE  16           HA       ILE  16  -1.744   9.011   4.494
  116    HB   ILE  16           HB       ILE  16  -3.445   7.155   2.811
  117   1HG1  ILE  16          2HG1      ILE  16  -3.494   7.472   5.825
  118   2HG1  ILE  16          1HG1      ILE  16  -4.684   8.217   4.758
  119   1HG2  ILE  16          1HG2      ILE  16  -0.900   6.838   3.781
  120   2HG2  ILE  16          2HG2      ILE  16  -2.019   5.508   3.476
  121   3HG2  ILE  16          3HG2      ILE  16  -1.861   6.173   5.102
  122   1HD1  ILE  16          1HD1      ILE  16  -5.728   6.239   4.333
  123   2HD1  ILE  16          2HD1      ILE  16  -4.952   5.719   5.829
  124   3HD1  ILE  16          3HD1      ILE  16  -4.212   5.341   4.273
  125    H    GLN  17           H        GLN  17  -3.077   8.439   1.210
  126    HA   GLN  17           HA       GLN  17  -0.842   7.833  -0.222
  127   1HB   GLN  17          2HB       GLN  17  -3.101   8.287  -1.214
  128   2HB   GLN  17          1HB       GLN  17  -2.763  10.014  -1.091
  129   1HG   GLN  17          2HG       GLN  17  -2.123   9.491  -3.298
  130   2HG   GLN  17          1HG       GLN  17  -0.597   9.463  -2.414
  131   1HE2  GLN  17          1HE2      GLN  17  -2.017   7.794  -4.790
  132   2HE2  GLN  17          2HE2      GLN  17  -1.521   6.213  -4.424
  133    H    LYS  18           H        LYS  18  -1.707  11.165   0.754
  134    HA   LYS  18           HA       LYS  18   0.502  12.506  -0.368
  135   1HB   LYS  18          2HB       LYS  18  -1.482  13.046   1.682
  136   2HB   LYS  18          1HB       LYS  18   0.088  13.707   2.143
  137   1HG   LYS  18          2HG       LYS  18  -1.036  15.400   0.853
  138   2HG   LYS  18          1HG       LYS  18   0.229  14.722  -0.173
  139   1HD   LYS  18          2HD       LYS  18  -1.279  13.601  -1.532
  140   2HD   LYS  18          1HD       LYS  18  -2.496  13.485  -0.262
  141   1HE   LYS  18          2HE       LYS  18  -2.845  15.187  -2.233
  142   2HE   LYS  18          1HE       LYS  18  -3.237  15.675  -0.583
  143   1HZ   LYS  18          1HZ       LYS  18  -1.660  17.088  -2.162
  144   2HZ   LYS  18          2HZ       LYS  18  -0.488  16.086  -1.450
  145   3HZ   LYS  18          3HZ       LYS  18  -1.480  17.063  -0.476
  146    H    GLU  19           H        GLU  19   0.252  11.266   2.990
  147    HA   GLU  19           HA       GLU  19   2.889  11.720   3.801
  148   1HB   GLU  19          2HB       GLU  19   1.170   9.292   4.409
  149   2HB   GLU  19          1HB       GLU  19   2.605   9.771   5.315
  150   1HG   GLU  19          2HG       GLU  19   1.354  12.079   5.513
  151   2HG   GLU  19          1HG       GLU  19  -0.079  11.107   5.175
  152    H    GLU  20           H        GLU  20   1.617   8.962   1.942
  153    HA   GLU  20           HA       GLU  20   4.030   7.470   1.777
  154   1HB   GLU  20          2HB       GLU  20   1.493   7.621   0.243
  155   2HB   GLU  20          1HB       GLU  20   2.869   6.929  -0.615
  156   1HG   GLU  20          2HG       GLU  20   2.164   6.037   2.179
  157   2HG   GLU  20          1HG       GLU  20   1.394   5.315   0.766
  158    H    THR  21           H        THR  21   2.688   9.836  -0.554
  159    HA   THR  21           HA       THR  21   4.863   9.841  -2.354
  160    HB   THR  21           HB       THR  21   3.475  12.418  -1.722
  161    HG1  THR  21           HG1      THR  21   2.065  10.724  -3.331
  162   1HG2  THR  21          1HG2      THR  21   5.099  12.094  -3.630
  163   2HG2  THR  21          2HG2      THR  21   3.500  12.657  -4.117
  164   3HG2  THR  21          3HG2      THR  21   3.943  10.964  -4.334
  165    H    ARG  22           H        ARG  22   4.277  12.317   0.175
  166    HA   ARG  22           HA       ARG  22   6.673  13.684   0.071
  167   1HB   ARG  22          2HB       ARG  22   5.219  12.797   2.582
  168   2HB   ARG  22          1HB       ARG  22   6.434  14.075   2.517
  169   1HG   ARG  22          2HG       ARG  22   4.795  14.911   0.535
  170   2HG   ARG  22          1HG       ARG  22   3.621  14.089   1.564
  171   1HD   ARG  22          2HD       ARG  22   5.457  16.375   2.301
  172   2HD   ARG  22          1HD       ARG  22   3.695  16.335   2.359
  173    HE   ARG  22           HE       ARG  22   4.455  14.317   4.098
  174   1HH1  ARG  22          1HH2      ARG  22   5.180  17.661   3.671
  175   2HH1  ARG  22          2HH2      ARG  22   5.458  17.953   5.357
  176   1HH2  ARG  22          2HH1      ARG  22   4.811  14.678   6.300
  177   2HH2  ARG  22          1HH1      ARG  22   5.249  16.264   6.845
  178    H    ASP  23           H        ASP  23   6.131  10.514   1.579
  179    HA   ASP  23           HA       ASP  23   8.690  10.241   2.797
  180   1HB   ASP  23          2HB       ASP  23   6.715   8.728   3.169
  181   2HB   ASP  23          1HB       ASP  23   7.023   8.020   1.583
  182    H    ILE  24           H        ILE  24   7.570   9.168  -0.430
  183    HA   ILE  24           HA       ILE  24  10.126   8.153  -1.248
  184    HB   ILE  24           HB       ILE  24   7.871   9.227  -2.969
  185   1HG1  ILE  24          2HG1      ILE  24   8.400   6.331  -2.320
  186   2HG1  ILE  24          1HG1      ILE  24   7.427   7.325  -1.235
  187   1HG2  ILE  24          1HG2      ILE  24   9.781   8.994  -4.355
  188   2HG2  ILE  24          2HG2      ILE  24   8.902   7.479  -4.567
  189   3HG2  ILE  24          3HG2      ILE  24  10.316   7.538  -3.514
  190   1HD1  ILE  24          1HD1      ILE  24   6.499   5.999  -3.497
  191   2HD1  ILE  24          2HD1      ILE  24   6.663   7.671  -4.033
  192   3HD1  ILE  24          3HD1      ILE  24   5.656   7.287  -2.637
  193    H    ILE  25           H        ILE  25   8.485  11.180  -2.260
  194    HA   ILE  25           HA       ILE  25  10.519  12.376  -3.695
  195    HB   ILE  25           HB       ILE  25   8.947  13.917  -1.620
  196   1HG1  ILE  25          2HG1      ILE  25   7.316  12.511  -2.672
  197   2HG1  ILE  25          1HG1      ILE  25   7.209  14.072  -3.487
  198   1HG2  ILE  25          1HG2      ILE  25   8.910  15.420  -3.836
  199   2HG2  ILE  25          2HG2      ILE  25  10.383  14.512  -4.171
  200   3HG2  ILE  25          3HG2      ILE  25  10.258  15.477  -2.702
  201   1HD1  ILE  25          1HD1      ILE  25   7.276  12.589  -5.293
  202   2HD1  ILE  25          2HD1      ILE  25   8.402  11.499  -4.483
  203   3HD1  ILE  25          3HD1      ILE  25   8.973  13.039  -5.127
  204    H    GLN  26           H        GLN  26  10.408  11.877  -0.222
  205    HA   GLN  26           HA       GLN  26  12.659  13.648   0.329
  206   1HB   GLN  26          2HB       GLN  26  11.138  11.591   1.922
  207   2HB   GLN  26          1HB       GLN  26  12.622  12.305   2.555
  208   1HG   GLN  26          2HG       GLN  26  10.348  13.998   1.509
  209   2HG   GLN  26          1HG       GLN  26  10.436  13.483   3.194
  210   1HE2  GLN  26          1HE2      GLN  26  11.262  16.029   1.198
  211   2HE2  GLN  26          2HE2      GLN  26  12.554  16.670   2.092
  212    H    ALA  27           H        ALA  27  12.254  10.086   0.292
  213    HA   ALA  27           HA       ALA  27  15.005   9.471   0.697
  214   1HB   ALA  27          1HB       ALA  27  13.269   7.764   0.914
  215   2HB   ALA  27          2HB       ALA  27  14.432   7.263  -0.316
  216   3HB   ALA  27          3HB       ALA  27  12.867   7.921  -0.797
  217    H    LEU  28           H        LEU  28  13.190  10.293  -2.214
  218    HA   LEU  28           HA       LEU  28  15.251   9.543  -4.085
  219   1HB   LEU  28          2HB       LEU  28  12.742  11.148  -4.165
  220   2HB   LEU  28          1HB       LEU  28  13.923  11.450  -5.439
  221    HG   LEU  28           HG       LEU  28  12.956   8.680  -4.692
  222   1HD1  LEU  28          1HD1      LEU  28  11.174  10.296  -5.603
  223   2HD1  LEU  28          2HD1      LEU  28  11.398   8.784  -6.483
  224   3HD1  LEU  28          3HD1      LEU  28  12.095  10.279  -7.108
  225   1HD2  LEU  28          1HD2      LEU  28  14.622   8.037  -6.068
  226   2HD2  LEU  28          2HD2      LEU  28  15.049   9.720  -6.375
  227   3HD2  LEU  28          3HD2      LEU  28  13.845   8.918  -7.383
  228    H    LEU  29           H        LEU  29  14.389  12.647  -2.538
  229    HA   LEU  29           HA       LEU  29  16.490  14.138  -3.826
  230   1HB   LEU  29          2HB       LEU  29  14.519  14.593  -1.689
  231   2HB   LEU  29          1HB       LEU  29  16.036  15.456  -1.445
  232    HG   LEU  29           HG       LEU  29  14.264  16.689  -2.806
  233   1HD1  LEU  29          1HD1      LEU  29  17.107  16.216  -3.519
  234   2HD1  LEU  29          2HD1      LEU  29  16.280  17.722  -3.127
  235   3HD1  LEU  29          3HD1      LEU  29  16.130  17.028  -4.741
  236   1HD2  LEU  29          1HD2      LEU  29  13.551  15.880  -4.824
  237   2HD2  LEU  29          2HD2      LEU  29  13.990  14.326  -4.117
  238   3HD2  LEU  29          3HD2      LEU  29  15.112  15.150  -5.199
  239    H    GLU  30           H        GLU  30  16.233  12.799  -0.512
  240    HA   GLU  30           HA       GLU  30  18.771  13.459   0.438
  241   1HB   GLU  30          2HB       GLU  30  17.046  11.022   0.869
  242   2HB   GLU  30          1HB       GLU  30  18.612  11.180   1.667
  243   1HG   GLU  30          2HG       GLU  30  17.941  13.151   2.821
  244   2HG   GLU  30          1HG       GLU  30  16.516  13.354   1.801
  245    H    ASP  31           H        ASP  31  17.879  10.662  -1.589
  246    HA   ASP  31           HA       ASP  31  20.381   9.383  -1.696
  247   1HB   ASP  31          2HB       ASP  31  18.047   9.591  -3.548
  248   2HB   ASP  31          1HB       ASP  31  19.550   8.941  -4.203
  249    H    GLY  32           H        GLY  32  19.241  12.251  -3.418
  250   1HA   GLY  32          2HA       GLY  32  20.927  13.969  -3.998
  251   2HA   GLY  32          1HA       GLY  32  22.043  12.655  -4.379
  252    H    SER  33           H        SER  33  18.742  12.276  -5.337
  253    HA   SER  33           HA       SER  33  19.245  11.743  -8.028
  254   1HB   SER  33          2HB       SER  33  16.885  12.179  -8.435
  255   2HB   SER  33          1HB       SER  33  17.055  11.406  -6.861
  256    HG   SER  33           HG       SER  33  16.126  13.880  -7.507
  257    H    ASP  34           H        ASP  34  18.577  13.147  -9.943
  258    HA   ASP  34           HA       ASP  34  19.339  16.000  -9.469
  259   1HB   ASP  34          2HB       ASP  34  20.569  13.984 -11.203
  260   2HB   ASP  34          1HB       ASP  34  20.113  15.446 -12.077
  261    HA   PRO  35           HA       PRO  35  15.083  15.624 -11.363
  262   1HB   PRO  35          2HB       PRO  35  14.937  18.266 -10.003
  263   2HB   PRO  35          1HB       PRO  35  13.782  16.922  -9.985
  264   1HG   PRO  35          2HG       PRO  35  15.344  17.482  -7.886
  265   2HG   PRO  35          1HG       PRO  35  14.874  15.825  -8.302
  266   1HD   PRO  35          2HD       PRO  35  17.507  17.179  -8.660
  267   2HD   PRO  35          1HD       PRO  35  17.148  15.463  -8.373
  268    H    ASP  36           H        ASP  36  17.616  18.025 -11.477
  269    HA   ASP  36           HA       ASP  36  16.597  19.936 -13.245
  270   1HB   ASP  36          2HB       ASP  36  18.887  20.330 -13.959
  271   2HB   ASP  36          1HB       ASP  36  18.894  19.959 -12.235
  272    H    ALA  37           H        ALA  37  17.089  16.585 -13.824
  273    HA   ALA  37           HA       ALA  37  17.178  16.926 -16.761
  274   1HB   ALA  37          1HB       ALA  37  17.439  14.607 -14.871
  275   2HB   ALA  37          2HB       ALA  37  18.525  15.119 -16.163
  276   3HB   ALA  37          3HB       ALA  37  17.012  14.302 -16.555
  277    H    LEU  38           H        LEU  38  15.405  14.222 -15.599
  278    HA   LEU  38           HA       LEU  38  12.779  15.522 -15.840
  279   1HB   LEU  38          2HB       LEU  38  13.797  14.844 -18.202
  280   2HB   LEU  38          1HB       LEU  38  13.235  13.241 -17.727
  281    HG   LEU  38           HG       LEU  38  11.016  14.511 -17.113
  282   1HD1  LEU  38          1HD1      LEU  38  11.802  16.278 -19.393
  283   2HD1  LEU  38          2HD1      LEU  38  12.382  16.707 -17.784
  284   3HD1  LEU  38          3HD1      LEU  38  10.651  16.574 -18.090
  285   1HD2  LEU  38          1HD2      LEU  38  11.236  12.799 -18.878
  286   2HD2  LEU  38          2HD2      LEU  38  11.872  14.016 -19.984
  287   3HD2  LEU  38          3HD2      LEU  38  10.206  14.123 -19.420
  288    H    TYR  39           H        TYR  39  11.014  13.920 -15.390
  289    HA   TYR  39           HA       TYR  39  11.973  11.408 -14.119
  290   1HB   TYR  39          2HB       TYR  39  10.878  13.755 -12.737
  291   2HB   TYR  39          1HB       TYR  39  10.013  12.263 -12.365
  292    HD1  TYR  39           HD1      TYR  39  10.957  10.626 -10.943
  293    HD2  TYR  39           HD2      TYR  39  13.423  13.776 -12.507
  294    HE1  TYR  39           HE1      TYR  39  12.809   9.916  -9.455
  295    HE2  TYR  39           HE2      TYR  39  15.274  13.067 -11.017
  296    HH   TYR  39           HH       TYR  39  15.484  10.181  -9.599
  297    H    GLU  40           H        GLU  40  10.530   9.721 -14.384
  298    HA   GLU  40           HA       GLU  40   7.993  10.386 -15.815
  299   1HB   GLU  40          2HB       GLU  40   8.093   8.018 -16.611
  300   2HB   GLU  40          1HB       GLU  40   9.489   8.969 -17.119
  301   1HG   GLU  40          2HG       GLU  40  10.468   8.063 -14.800
  302   2HG   GLU  40          1HG       GLU  40   9.328   6.756 -15.124
  303    H    ILE  41           H        ILE  41   6.046   9.571 -15.023
  304    HA   ILE  41           HA       ILE  41   6.198   8.045 -12.453
  305    HB   ILE  41           HB       ILE  41   4.215  10.221 -13.196
  306   1HG1  ILE  41          2HG1      ILE  41   5.326  11.345 -11.177
  307   2HG1  ILE  41          1HG1      ILE  41   6.604  10.142 -11.340
  308   1HG2  ILE  41          1HG2      ILE  41   2.911   9.233 -11.645
  309   2HG2  ILE  41          2HG2      ILE  41   4.129   9.663 -10.445
  310   3HG2  ILE  41          3HG2      ILE  41   4.182   8.084 -11.228
  311   1HD1  ILE  41          1HD1      ILE  41   5.990  11.315 -13.915
  312   2HD1  ILE  41          2HD1      ILE  41   7.530  11.271 -13.054
  313   3HD1  ILE  41          3HD1      ILE  41   6.381  12.572 -12.743
  314    H    GLU  42           H        GLU  42   4.326   6.628 -12.080
  315    HA   GLU  42           HA       GLU  42   2.657   6.111 -14.488
  316   1HB   GLU  42          2HB       GLU  42   3.441   3.625 -13.212
  317   2HB   GLU  42          1HB       GLU  42   3.572   4.095 -14.908
  318   1HG   GLU  42          2HG       GLU  42   5.650   5.322 -14.418
  319   2HG   GLU  42          1HG       GLU  42   5.518   4.876 -12.717
  320    H    HIS  43           H        HIS  43   0.564   5.623 -13.958
  321    HA   HIS  43           HA       HIS  43  -0.013   5.072 -11.072
  322   1HB   HIS  43          2HB       HIS  43  -1.912   6.440 -12.988
  323   2HB   HIS  43          1HB       HIS  43  -1.992   6.389 -11.227
  324    HD2  HIS  43           HD2      HIS  43  -0.005   8.303 -14.040
  325    HE1  HIS  43           HE1      HIS  43   0.925  10.076 -10.321
  326    HE2  HIS  43           HE2      HIS  43   1.202  10.277 -12.835
  327    H    HIS  44           H        HIS  44  -1.272   3.275 -10.674
  328    HA   HIS  44           HA       HIS  44  -2.195   1.760 -13.072
  329   1HB   HIS  44          2HB       HIS  44  -1.569   0.858 -10.247
  330   2HB   HIS  44          1HB       HIS  44  -2.240  -0.196 -11.493
  331    HD2  HIS  44           HD2      HIS  44  -0.262  -1.442 -12.959
  332    HE1  HIS  44           HE1      HIS  44   2.846   1.333 -12.271
  333    HE2  HIS  44           HE2      HIS  44   2.247  -0.869 -13.379
  334    H    LEU  45           H        LEU  45  -4.345   1.253 -13.304
  335    HA   LEU  45           HA       LEU  45  -6.182   1.750 -11.022
  336   1HB   LEU  45          2HB       LEU  45  -6.310   3.062 -13.745
  337   2HB   LEU  45          1HB       LEU  45  -7.742   2.891 -12.730
  338    HG   LEU  45           HG       LEU  45  -5.938   3.906 -10.934
  339   1HD1  LEU  45          1HD1      LEU  45  -5.361   5.119 -13.654
  340   2HD1  LEU  45          2HD1      LEU  45  -4.217   4.259 -12.622
  341   3HD1  LEU  45          3HD1      LEU  45  -4.854   5.825 -12.119
  342   1HD2  LEU  45          1HD2      LEU  45  -7.070   6.167 -11.638
  343   2HD2  LEU  45          2HD2      LEU  45  -8.077   4.861 -11.014
  344   3HD2  LEU  45          3HD2      LEU  45  -7.988   5.153 -12.751
  345    H    PHE  46           H        PHE  46  -7.583   0.063 -10.861
  346    HA   PHE  46           HA       PHE  46  -7.897  -1.691 -13.258
  347   1HB   PHE  46          2HB       PHE  46  -8.909  -3.024 -10.992
  348   2HB   PHE  46          1HB       PHE  46  -7.387  -3.350 -11.820
  349    HD1  PHE  46           HD1      PHE  46  -8.695  -2.758  -8.695
  350    HD2  PHE  46           HD2      PHE  46  -5.560  -1.334 -11.264
  351    HE1  PHE  46           HE1      PHE  46  -7.443  -1.941  -6.717
  352    HE2  PHE  46           HE2      PHE  46  -4.308  -0.517  -9.285
  353    HZ   PHE  46           HZ       PHE  46  -5.251  -0.822  -7.011
  354    H    ALA  47           H        ALA  47 -10.060  -2.649 -13.573
  355    HA   ALA  47           HA       ALA  47 -12.265  -1.064 -12.339
  356   1HB   ALA  47          1HB       ALA  47 -13.001  -0.223 -14.317
  357   2HB   ALA  47          2HB       ALA  47 -12.672  -1.726 -15.178
  358   3HB   ALA  47          3HB       ALA  47 -11.371  -0.569 -14.896
  359    H    GLU  48           H        GLU  48 -14.422  -2.148 -12.752
  360    HA   GLU  48           HA       GLU  48 -14.050  -5.108 -12.684
  361   1HB   GLU  48          2HB       GLU  48 -16.281  -3.337 -11.640
  362   2HB   GLU  48          1HB       GLU  48 -16.322  -5.100 -11.607
  363   1HG   GLU  48          2HG       GLU  48 -13.995  -4.864 -10.419
  364   2HG   GLU  48          1HG       GLU  48 -14.546  -3.224 -10.074
  365    H    ASP  49           H        ASP  49 -15.533  -2.501 -14.438
  366    HA   ASP  49           HA       ASP  49 -16.943  -4.499 -16.162
  367   1HB   ASP  49          2HB       ASP  49 -17.550  -1.544 -16.114
  368   2HB   ASP  49          1HB       ASP  49 -18.575  -2.865 -16.671
  369    H    PHE  50           H        PHE  50 -15.826  -4.847 -18.024
  370    HA   PHE  50           HA       PHE  50 -13.596  -3.516 -18.971
  371   1HB   PHE  50          2HB       PHE  50 -14.566  -4.177 -21.335
  372   2HB   PHE  50          1HB       PHE  50 -14.101  -5.435 -20.190
  373    HD1  PHE  50           HD1      PHE  50 -15.800  -6.690 -18.928
  374    HD2  PHE  50           HD2      PHE  50 -16.904  -3.714 -21.822
  375    HE1  PHE  50           HE1      PHE  50 -18.125  -7.552 -18.929
  376    HE2  PHE  50           HE2      PHE  50 -19.229  -4.577 -21.822
  377    HZ   PHE  50           HZ       PHE  50 -19.840  -6.496 -20.375
  378    H    ASP  51           H        ASP  51 -16.986  -2.611 -19.488
  379    HA   ASP  51           HA       ASP  51 -16.507  -0.488 -21.341
  380   1HB   ASP  51          2HB       ASP  51 -18.702  -0.136 -19.372
  381   2HB   ASP  51          1HB       ASP  51 -18.749  -0.064 -21.134
  382    H    LYS  52           H        LYS  52 -17.500   0.007 -17.940
  383    HA   LYS  52           HA       LYS  52 -16.797   2.619 -17.567
  384   1HB   LYS  52          2HB       LYS  52 -17.510   0.745 -15.837
  385   2HB   LYS  52          1HB       LYS  52 -15.777   0.688 -15.510
  386   1HG   LYS  52          2HG       LYS  52 -16.449   2.330 -14.007
  387   2HG   LYS  52          1HG       LYS  52 -16.021   3.315 -15.407
  388   1HD   LYS  52          2HD       LYS  52 -18.171   4.083 -14.663
  389   2HD   LYS  52          1HD       LYS  52 -18.450   3.144 -16.130
  390   1HE   LYS  52          2HE       LYS  52 -18.492   1.613 -13.589
  391   2HE   LYS  52          1HE       LYS  52 -19.828   2.739 -13.832
  392   1HZ   LYS  52          1HZ       LYS  52 -19.782   1.635 -16.209
  393   2HZ   LYS  52          2HZ       LYS  52 -20.646   0.944 -14.919
  394   3HZ   LYS  52          3HZ       LYS  52 -19.115   0.341 -15.340
  395    H    LEU  53           H        LEU  53 -14.554  -0.082 -17.895
  396    HA   LEU  53           HA       LEU  53 -12.175   1.323 -17.142
  397   1HB   LEU  53          2HB       LEU  53 -12.588  -1.230 -17.580
  398   2HB   LEU  53          1HB       LEU  53 -12.191  -0.828 -19.250
  399    HG   LEU  53           HG       LEU  53 -10.384   0.097 -17.032
  400   1HD1  LEU  53          1HD1      LEU  53 -10.405  -2.173 -16.466
  401   2HD1  LEU  53          2HD1      LEU  53  -9.092  -2.098 -17.641
  402   3HD1  LEU  53          3HD1      LEU  53 -10.681  -2.685 -18.131
  403   1HD2  LEU  53          1HD2      LEU  53  -9.225  -0.931 -19.504
  404   2HD2  LEU  53          2HD2      LEU  53  -9.043   0.660 -18.764
  405   3HD2  LEU  53          3HD2      LEU  53 -10.415   0.330 -19.821
  406    H    GLU  54           H        GLU  54 -13.797   0.878 -20.278
  407    HA   GLU  54           HA       GLU  54 -11.793   2.289 -21.799
  408   1HB   GLU  54          2HB       GLU  54 -13.465   0.719 -22.791
  409   2HB   GLU  54          1HB       GLU  54 -14.730   1.899 -22.446
  410   1HG   GLU  54          2HG       GLU  54 -12.962   3.486 -23.750
  411   2HG   GLU  54          1HG       GLU  54 -12.623   1.943 -24.534
  412    H    LYS  55           H        LYS  55 -14.527   3.313 -19.872
  413    HA   LYS  55           HA       LYS  55 -14.644   5.987 -21.041
  414   1HB   LYS  55          2HB       LYS  55 -16.411   4.526 -19.585
  415   2HB   LYS  55          1HB       LYS  55 -15.734   5.552 -18.320
  416   1HG   LYS  55          2HG       LYS  55 -16.342   7.551 -19.486
  417   2HG   LYS  55          1HG       LYS  55 -16.731   6.657 -20.955
  418   1HD   LYS  55          2HD       LYS  55 -18.186   6.213 -18.339
  419   2HD   LYS  55          1HD       LYS  55 -18.732   7.373 -19.550
  420   1HE   LYS  55          2HE       LYS  55 -19.898   5.571 -20.342
  421   2HE   LYS  55          1HE       LYS  55 -18.362   5.200 -21.125
  422   1HZ   LYS  55          1HZ       LYS  55 -18.154   3.386 -19.898
  423   2HZ   LYS  55          2HZ       LYS  55 -19.718   3.650 -19.288
  424   3HZ   LYS  55          3HZ       LYS  55 -18.366   4.257 -18.458
  425    H    ALA  56           H        ALA  56 -13.828   4.917 -17.716
  426    HA   ALA  56           HA       ALA  56 -12.643   7.330 -16.884
  427   1HB   ALA  56          1HB       ALA  56 -13.139   5.452 -15.356
  428   2HB   ALA  56          2HB       ALA  56 -11.468   5.986 -15.186
  429   3HB   ALA  56          3HB       ALA  56 -11.836   4.516 -16.088
  430    H    ALA  57           H        ALA  57 -11.325   4.778 -18.903
  431    HA   ALA  57           HA       ALA  57  -8.572   5.676 -18.705
  432   1HB   ALA  57          1HB       ALA  57  -9.148   3.370 -19.379
  433   2HB   ALA  57          2HB       ALA  57  -8.185   4.171 -20.620
  434   3HB   ALA  57          3HB       ALA  57  -9.926   3.991 -20.834
  435    H    VAL  58           H        VAL  58 -11.157   6.118 -21.131
  436    HA   VAL  58           HA       VAL  58  -9.642   7.673 -22.966
  437    HB   VAL  58           HB       VAL  58 -12.584   7.530 -22.318
  438   1HG1  VAL  58          1HG1      VAL  58 -12.463   9.764 -23.032
  439   2HG1  VAL  58          2HG1      VAL  58 -12.757   8.895 -24.538
  440   3HG1  VAL  58          3HG1      VAL  58 -11.127   9.438 -24.136
  441   1HG2  VAL  58          1HG2      VAL  58 -11.305   6.978 -24.974
  442   2HG2  VAL  58          2HG2      VAL  58 -12.717   6.222 -24.236
  443   3HG2  VAL  58          3HG2      VAL  58 -11.099   5.802 -23.676
  444    H    GLU  59           H        GLU  59 -11.161   8.519 -19.922
  445    HA   GLU  59           HA       GLU  59 -11.046  11.386 -20.323
  446   1HB   GLU  59          2HB       GLU  59 -12.329   9.840 -18.528
  447   2HB   GLU  59          1HB       GLU  59 -10.915  10.271 -17.566
  448   1HG   GLU  59          2HG       GLU  59 -12.476  11.997 -17.116
  449   2HG   GLU  59          1HG       GLU  59 -11.377  12.699 -18.306
  450    H    ALA  60           H        ALA  60  -9.049   9.163 -18.338
  451    HA   ALA  60           HA       ALA  60  -7.115  11.045 -17.526
  452   1HB   ALA  60          1HB       ALA  60  -6.515   9.140 -16.470
  453   2HB   ALA  60          2HB       ALA  60  -5.666   8.702 -17.952
  454   3HB   ALA  60          3HB       ALA  60  -7.315   8.137 -17.679
  455    H    PHE  61           H        PHE  61  -7.226   9.089 -20.502
  456    HA   PHE  61           HA       PHE  61  -4.712   9.922 -21.554
  457   1HB   PHE  61          2HB       PHE  61  -6.199   8.054 -22.428
  458   2HB   PHE  61          1HB       PHE  61  -7.184   9.302 -23.189
  459    HD1  PHE  61           HD1      PHE  61  -3.527   8.510 -22.818
  460    HD2  PHE  61           HD2      PHE  61  -6.717   9.726 -25.425
  461    HE1  PHE  61           HE1      PHE  61  -1.937   8.605 -24.719
  462    HE2  PHE  61           HE2      PHE  61  -5.127   9.821 -27.327
  463    HZ   PHE  61           HZ       PHE  61  -2.737   9.261 -26.973
  464    H    LYS  62           H        LYS  62  -7.958  11.352 -21.827
  465    HA   LYS  62           HA       LYS  62  -7.244  13.420 -23.674
  466   1HB   LYS  62          2HB       LYS  62  -9.495  12.853 -21.835
  467   2HB   LYS  62          1HB       LYS  62  -9.253  14.556 -22.229
  468   1HG   LYS  62          2HG       LYS  62  -9.228  12.487 -24.413
  469   2HG   LYS  62          1HG       LYS  62 -10.761  13.104 -23.796
  470   1HD   LYS  62          2HD       LYS  62 -10.039  15.409 -24.282
  471   2HD   LYS  62          1HD       LYS  62  -8.498  14.803 -24.889
  472   1HE   LYS  62          2HE       LYS  62 -10.647  13.383 -26.176
  473   2HE   LYS  62          1HE       LYS  62 -10.919  15.119 -26.333
  474   1HZ   LYS  62          1HZ       LYS  62  -8.866  13.466 -27.498
  475   2HZ   LYS  62          2HZ       LYS  62  -8.279  14.902 -26.804
  476   3HZ   LYS  62          3HZ       LYS  62  -9.473  14.965 -28.011
  477    H    MET  63           H        MET  63  -6.775  13.063 -20.231
  478    HA   MET  63           HA       MET  63  -6.218  15.892 -19.765
  479   1HB   MET  63          2HB       MET  63  -6.194  13.386 -18.175
  480   2HB   MET  63          1HB       MET  63  -5.076  14.642 -17.647
  481   1HG   MET  63          2HG       MET  63  -6.872  16.252 -17.452
  482   2HG   MET  63          1HG       MET  63  -8.019  15.128 -18.182
  483   1HE   MET  63          1HE       MET  63  -9.645  13.572 -16.424
  484   2HE   MET  63          2HE       MET  63  -8.520  12.347 -15.844
  485   3HE   MET  63          3HE       MET  63  -8.389  12.939 -17.498
  486    H    GLY  64           H        GLY  64  -4.385  13.030 -20.638
  487   1HA   GLY  64          2HA       GLY  64  -2.280  13.822 -21.954
  488   2HA   GLY  64          1HA       GLY  64  -1.856  14.599 -20.427
  489    H    PHE  65           H        PHE  65  -3.286  12.129 -19.148
  490    HA   PHE  65           HA       PHE  65  -0.922  10.682 -18.495
  491   1HB   PHE  65          2HB       PHE  65  -3.851   9.945 -18.295
  492   2HB   PHE  65          1HB       PHE  65  -2.559   8.923 -17.664
  493    HD1  PHE  65           HD1      PHE  65  -4.382  12.089 -17.272
  494    HD2  PHE  65           HD2      PHE  65  -1.180   9.650 -15.769
  495    HE1  PHE  65           HE1      PHE  65  -4.290  13.474 -15.217
  496    HE2  PHE  65           HE2      PHE  65  -1.088  11.036 -13.715
  497    HZ   PHE  65           HZ       PHE  65  -2.644  12.948 -13.440
  498    H    GLU  66           H        GLU  66   0.091   8.990 -19.506
  499    HA   GLU  66           HA       GLU  66  -0.900   8.193 -22.160
  500   1HB   GLU  66          2HB       GLU  66   1.647   8.157 -20.736
  501   2HB   GLU  66          1HB       GLU  66   1.332   6.628 -21.559
  502   1HG   GLU  66          2HG       GLU  66   2.482   8.131 -23.094
  503   2HG   GLU  66          1HG       GLU  66   0.821   7.907 -23.644
  504    H    VAL  67           H        VAL  67  -2.846   7.084 -21.317
  505    HA   VAL  67           HA       VAL  67  -2.839   4.930 -19.499
  506    HB   VAL  67           HB       VAL  67  -4.913   5.894 -20.399
  507   1HG1  VAL  67          1HG1      VAL  67  -5.613   5.403 -22.697
  508   2HG1  VAL  67          2HG1      VAL  67  -4.117   4.512 -22.981
  509   3HG1  VAL  67          3HG1      VAL  67  -4.069   6.255 -22.711
  510   1HG2  VAL  67          1HG2      VAL  67  -6.000   3.934 -20.062
  511   2HG2  VAL  67          2HG2      VAL  67  -4.401   3.204 -19.925
  512   3HG2  VAL  67          3HG2      VAL  67  -5.248   3.188 -21.471
  513    H    LEU  68           H        LEU  68  -2.117   2.842 -19.624
  514    HA   LEU  68           HA       LEU  68  -1.044   1.943 -22.268
  515   1HB   LEU  68          2HB       LEU  68   0.376   2.245 -19.962
  516   2HB   LEU  68          1HB       LEU  68  -0.133   0.562 -19.811
  517    HG   LEU  68           HG       LEU  68   1.156   1.693 -22.307
  518   1HD1  LEU  68          1HD1      LEU  68   3.146   0.305 -21.449
  519   2HD1  LEU  68          2HD1      LEU  68   2.346   0.345 -19.878
  520   3HD1  LEU  68          3HD1      LEU  68   2.851   1.849 -20.649
  521   1HD2  LEU  68          1HD2      LEU  68   0.407  -1.066 -21.321
  522   2HD2  LEU  68          2HD2      LEU  68   1.596  -0.830 -22.603
  523   3HD2  LEU  68          3HD2      LEU  68  -0.064  -0.281 -22.828
  524    H    GLU  69           H        GLU  69  -1.745  -0.031 -23.050
  525    HA   GLU  69           HA       GLU  69  -4.182  -1.130 -22.475
  526   1HB   GLU  69          2HB       GLU  69  -1.663  -2.249 -23.572
  527   2HB   GLU  69          1HB       GLU  69  -2.848  -3.433 -23.018
  528   1HG   GLU  69          2HG       GLU  69  -3.227  -2.895 -25.387
  529   2HG   GLU  69          1HG       GLU  69  -4.581  -2.333 -24.405
  530    H    ALA  70           H        ALA  70  -4.808  -3.126 -21.269
  531    HA   ALA  70           HA       ALA  70  -3.426  -3.180 -18.628
  532   1HB   ALA  70          1HB       ALA  70  -5.556  -4.266 -17.846
  533   2HB   ALA  70          2HB       ALA  70  -6.212  -4.030 -19.466
  534   3HB   ALA  70          3HB       ALA  70  -5.783  -2.635 -18.477
  535    H    GLU  71           H        GLU  71  -3.833  -5.512 -17.563
  536    HA   GLU  71           HA       GLU  71  -3.426  -7.676 -19.539
  537   1HB   GLU  71          2HB       GLU  71  -1.160  -6.687 -18.956
  538   2HB   GLU  71          1HB       GLU  71  -1.438  -7.225 -17.299
  539   1HG   GLU  71          2HG       GLU  71  -1.943  -9.541 -18.407
  540   2HG   GLU  71          1HG       GLU  71  -1.052  -8.881 -19.779
  541    H    GLU  72           H        GLU  72  -5.163  -8.878 -18.845
  542    HA   GLU  72           HA       GLU  72  -6.447  -9.106 -16.471
  543   1HB   GLU  72          2HB       GLU  72  -5.576 -11.313 -18.336
  544   2HB   GLU  72          1HB       GLU  72  -6.575 -11.647 -16.921
  545   1HG   GLU  72          2HG       GLU  72  -8.193  -9.901 -17.737
  546   2HG   GLU  72          1HG       GLU  72  -7.239  -9.782 -19.216
  547    H    THR  73           H        THR  73  -5.565  -9.047 -14.458
  548    HA   THR  73           HA       THR  73  -3.268 -10.887 -13.903
  549    HB   THR  73           HB       THR  73  -2.712  -8.444 -13.750
  550    HG1  THR  73           HG1      THR  73  -2.512  -9.020 -11.144
  551   1HG2  THR  73          1HG2      THR  73  -4.743  -8.523 -11.502
  552   2HG2  THR  73          2HG2      THR  73  -4.928  -7.656 -13.026
  553   3HG2  THR  73          3HG2      THR  73  -3.686  -7.163 -11.876
  554    H    GLU  74           H        GLU  74  -3.364 -10.596 -11.088
  555    HA   GLU  74           HA       GLU  74  -6.045 -11.767 -10.458
  556   1HB   GLU  74          2HB       GLU  74  -3.279 -12.639  -9.622
  557   2HB   GLU  74          1HB       GLU  74  -4.702 -13.080  -8.677
  558   1HG   GLU  74          2HG       GLU  74  -5.628 -14.349 -10.426
  559   2HG   GLU  74          1HG       GLU  74  -4.634 -13.557 -11.649
  560    H    ASP  75           H        ASP  75  -7.025 -10.984  -8.601
  561    HA   ASP  75           HA       ASP  75  -6.169  -8.486  -7.522
  562   1HB   ASP  75          2HB       ASP  75  -8.510  -9.742  -7.461
  563   2HB   ASP  75          1HB       ASP  75  -7.910 -10.307  -5.902
  564    H    GLU  76           H        GLU  76  -6.830  -9.731  -4.680
  565    HA   GLU  76           HA       GLU  76  -3.962 -10.297  -4.066
  566   1HB   GLU  76          2HB       GLU  76  -6.118  -8.820  -2.682
  567   2HB   GLU  76          1HB       GLU  76  -5.138  -9.851  -1.638
  568   1HG   GLU  76          2HG       GLU  76  -3.997  -7.837  -3.597
  569   2HG   GLU  76          1HG       GLU  76  -4.218  -7.530  -1.873
  570    H    ASP  77           H        ASP  77  -7.075 -11.707  -4.212
  571    HA   ASP  77           HA       ASP  77  -6.236 -13.922  -2.395
  572   1HB   ASP  77          2HB       ASP  77  -8.480 -12.761  -2.049
  573   2HB   ASP  77          1HB       ASP  77  -8.985 -13.475  -3.581
  574    H    GLY  78           H        GLY  78  -6.894 -13.092  -5.705
  575   1HA   GLY  78          2HA       GLY  78  -5.773 -14.640  -7.351
  576   2HA   GLY  78          1HA       GLY  78  -6.509 -15.965  -6.449
  577    H    ASN  79           H        ASN  79  -7.185 -13.263  -8.613
  578    HA   ASN  79           HA       ASN  79  -9.630 -14.684  -9.501
  579   1HB   ASN  79          2HB       ASN  79  -9.546 -12.023  -8.156
  580   2HB   ASN  79          1HB       ASN  79 -10.632 -12.194  -9.535
  581   1HD2  ASN  79          1HD2      ASN  79  -9.744 -14.036  -6.553
  582   2HD2  ASN  79          2HD2      ASN  79 -11.329 -14.547  -6.224
  583    H    LYS  80           H        LYS  80 -10.538 -12.591 -11.198
  584    HA   LYS  80           HA       LYS  80  -8.184 -12.069 -12.952
  585   1HB   LYS  80          2HB       LYS  80 -10.826 -13.300 -13.789
  586   2HB   LYS  80          1HB       LYS  80  -9.613 -12.697 -14.920
  587   1HG   LYS  80          2HG       LYS  80  -8.015 -14.258 -13.455
  588   2HG   LYS  80          1HG       LYS  80  -9.532 -15.111 -13.165
  589   1HD   LYS  80          2HD       LYS  80  -8.438 -16.058 -15.131
  590   2HD   LYS  80          1HD       LYS  80  -9.905 -15.213 -15.628
  591   1HE   LYS  80          2HE       LYS  80  -8.735 -13.751 -16.885
  592   2HE   LYS  80          1HE       LYS  80  -7.613 -13.419 -15.564
  593   1HZ   LYS  80          1HZ       LYS  80  -7.387 -15.303 -17.763
  594   2HZ   LYS  80          2HZ       LYS  80  -6.843 -15.861 -16.254
  595   3HZ   LYS  80          3HZ       LYS  80  -6.177 -14.452 -16.932
  596    H    LEU  81           H        LEU  81  -8.123  -9.886 -13.129
  597    HA   LEU  81           HA       LEU  81 -10.668  -8.463 -13.739
  598   1HB   LEU  81          2HB       LEU  81  -9.768  -6.581 -12.233
  599   2HB   LEU  81          1HB       LEU  81 -10.428  -8.001 -11.419
  600    HG   LEU  81           HG       LEU  81  -7.542  -8.127 -12.094
  601   1HD1  LEU  81          1HD1      LEU  81  -7.080  -6.821  -9.923
  602   2HD1  LEU  81          2HD1      LEU  81  -8.708  -6.170 -10.109
  603   3HD1  LEU  81          3HD1      LEU  81  -7.491  -5.872 -11.351
  604   1HD2  LEU  81          1HD2      LEU  81  -9.126  -8.719  -9.573
  605   2HD2  LEU  81          2HD2      LEU  81  -7.463  -9.209  -9.898
  606   3HD2  LEU  81          3HD2      LEU  81  -8.784  -9.892 -10.845
  607    H    LEU  82           H        LEU  82 -10.278  -6.364 -14.799
  608    HA   LEU  82           HA       LEU  82  -7.874  -6.483 -16.508
  609   1HB   LEU  82          2HB       LEU  82 -10.374  -4.777 -16.526
  610   2HB   LEU  82          1HB       LEU  82  -9.015  -4.473 -17.610
  611    HG   LEU  82           HG       LEU  82  -9.222  -6.999 -18.204
  612   1HD1  LEU  82          1HD1      LEU  82 -11.910  -6.403 -16.938
  613   2HD1  LEU  82          2HD1      LEU  82 -10.770  -7.666 -16.473
  614   3HD1  LEU  82          3HD1      LEU  82 -11.619  -7.769 -18.015
  615   1HD2  LEU  82          1HD2      LEU  82  -9.717  -5.297 -19.835
  616   2HD2  LEU  82          2HD2      LEU  82 -11.231  -4.886 -19.031
  617   3HD2  LEU  82          3HD2      LEU  82 -11.064  -6.435 -19.857
  618    H    CYS  83           H        CYS  83  -6.095  -5.253 -16.115
  619    HA   CYS  83           HA       CYS  83  -6.410  -2.920 -14.272
  620   1HB   CYS  83          2HB       CYS  83  -4.176  -3.428 -13.380
  621   2HB   CYS  83          1HB       CYS  83  -5.255  -4.806 -13.161
  622    HG   CYS  83           HG       CYS  83  -2.823  -4.715 -15.053
  623    H    PHE  84           H        PHE  84  -6.244  -1.183 -15.649
  624    HA   PHE  84           HA       PHE  84  -4.186  -1.278 -17.793
  625   1HB   PHE  84          2HB       PHE  84  -5.270   0.846 -18.565
  626   2HB   PHE  84          1HB       PHE  84  -6.382  -0.522 -18.521
  627    HD1  PHE  84           HD1      PHE  84  -5.756   2.813 -17.373
  628    HD2  PHE  84           HD2      PHE  84  -7.810  -0.828 -16.384
  629    HE1  PHE  84           HE1      PHE  84  -7.242   4.069 -15.836
  630    HE2  PHE  84           HE2      PHE  84  -9.296   0.429 -14.846
  631    HZ   PHE  84           HZ       PHE  84  -9.011   2.877 -14.573
  632    H    ASP  85           H        ASP  85  -2.666   0.540 -17.981
  633    HA   ASP  85           HA       ASP  85  -2.230   1.935 -15.369
  634   1HB   ASP  85          2HB       ASP  85   0.233   1.556 -16.838
  635   2HB   ASP  85          1HB       ASP  85  -0.172   1.041 -15.200
  636    H    ALA  86           H        ALA  86  -0.770   3.893 -15.656
  637    HA   ALA  86           HA       ALA  86  -0.977   5.123 -18.352
  638   1HB   ALA  86          1HB       ALA  86  -1.567   7.201 -16.552
  639   2HB   ALA  86          2HB       ALA  86  -2.578   5.849 -16.040
  640   3HB   ALA  86          3HB       ALA  86  -2.682   6.451 -17.696
  641    H    THR  87           H        THR  87   0.586   6.831 -18.660
  642    HA   THR  87           HA       THR  87   2.606   7.058 -16.470
  643    HB   THR  87           HB       THR  87   4.264   7.214 -18.515
  644    HG1  THR  87           HG1      THR  87   3.513   5.753 -20.159
  645   1HG2  THR  87          1HG2      THR  87   4.470   4.675 -18.419
  646   2HG2  THR  87          2HG2      THR  87   3.045   4.691 -17.382
  647   3HG2  THR  87          3HG2      THR  87   4.520   5.506 -16.863
  648    H    MET  88           H        MET  88   3.877   9.047 -16.566
  649    HA   MET  88           HA       MET  88   2.984  11.147 -18.427
  650   1HB   MET  88          2HB       MET  88   1.288  11.307 -16.673
  651   2HB   MET  88          1HB       MET  88   2.542  11.351 -15.433
  652   1HG   MET  88          2HG       MET  88   3.434  13.444 -16.494
  653   2HG   MET  88          1HG       MET  88   2.052  13.425 -17.589
  654   1HE   MET  88          1HE       MET  88   0.284  15.408 -16.891
  655   2HE   MET  88          2HE       MET  88  -0.867  14.562 -15.860
  656   3HE   MET  88          3HE       MET  88  -0.105  13.711 -17.202
  657    H    GLN  89           H        GLN  89   4.891  12.037 -19.047
  658    HA   GLN  89           HA       GLN  89   7.229  11.913 -17.260
  659   1HB   GLN  89          2HB       GLN  89   6.742  12.603 -20.129
  660   2HB   GLN  89          1HB       GLN  89   8.173  13.281 -19.351
  661   1HG   GLN  89          2HG       GLN  89   8.660  11.099 -20.428
  662   2HG   GLN  89          1HG       GLN  89   8.900  11.036 -18.682
  663   1HE2  GLN  89          1HE2      GLN  89   5.633  11.115 -20.000
  664   2HE2  GLN  89          2HE2      GLN  89   5.247   9.504 -19.633
  665    H    SER  90           H        SER  90   7.977  13.633 -16.066
  666    HA   SER  90           HA       SER  90   7.388  16.387 -16.772
  667   1HB   SER  90          2HB       SER  90   5.863  16.959 -15.054
  668   2HB   SER  90          1HB       SER  90   5.226  15.453 -15.708
  669    HG   SER  90           HG       SER  90   6.525  15.970 -13.283
  670    H    ALA  91           H        ALA  91   7.859  17.697 -14.459
  671    HA   ALA  91           HA       ALA  91  10.596  16.792 -13.780
  672   1HB   ALA  91          1HB       ALA  91  10.697  19.066 -12.644
  673   2HB   ALA  91          2HB       ALA  91   9.091  19.376 -13.305
  674   3HB   ALA  91          3HB       ALA  91  10.455  19.108 -14.391
  675    H    LEU  92           H        LEU  92  10.895  15.617 -11.959
  676    HA   LEU  92           HA       LEU  92   9.073  14.739 -10.124
  677   1HB   LEU  92          2HB       LEU  92  11.417  14.044 -10.041
  678   2HB   LEU  92          1HB       LEU  92  11.901  15.652  -9.504
  679    HG   LEU  92           HG       LEU  92  10.357  15.306  -7.499
  680   1HD1  LEU  92          1HD1      LEU  92  10.552  12.431  -7.545
  681   2HD1  LEU  92          2HD1      LEU  92   9.689  12.982  -8.980
  682   3HD1  LEU  92          3HD1      LEU  92   9.113  13.434  -7.376
  683   1HD2  LEU  92          1HD2      LEU  92  12.854  15.068  -7.448
  684   2HD2  LEU  92          2HD2      LEU  92  12.657  13.348  -7.786
  685   3HD2  LEU  92          3HD2      LEU  92  12.033  14.029  -6.283
  686    H    ASP  93           H        ASP  93   7.856  15.598  -8.483
  687    HA   ASP  93           HA       ASP  93   8.541  17.895  -6.942
  688   1HB   ASP  93          2HB       ASP  93   7.039  18.380  -9.477
  689   2HB   ASP  93          1HB       ASP  93   6.521  19.267  -8.043
  690    H    ALA  94           H        ALA  94   7.536  17.215  -5.111
  691    HA   ALA  94           HA       ALA  94   5.442  15.412  -4.850
  692   1HB   ALA  94          1HB       ALA  94   5.726  17.835  -3.058
  693   2HB   ALA  94          2HB       ALA  94   6.835  16.466  -2.991
  694   3HB   ALA  94          3HB       ALA  94   5.125  16.235  -2.623
  695    H    LYS  95           H        LYS  95   4.882  18.924  -4.415
  696    HA   LYS  95           HA       LYS  95   2.144  19.009  -4.533
  697   1HB   LYS  95          2HB       LYS  95   3.716  20.938  -6.233
  698   2HB   LYS  95          1HB       LYS  95   2.294  21.253  -5.237
  699   1HG   LYS  95          2HG       LYS  95   4.165  20.253  -3.429
  700   2HG   LYS  95          1HG       LYS  95   5.115  21.291  -4.492
  701   1HD   LYS  95          2HD       LYS  95   2.522  22.143  -3.174
  702   2HD   LYS  95          1HD       LYS  95   4.122  22.504  -2.525
  703   1HE   LYS  95          2HE       LYS  95   4.636  23.521  -4.836
  704   2HE   LYS  95          1HE       LYS  95   2.895  23.468  -5.109
  705   1HZ   LYS  95          1HZ       LYS  95   2.630  25.256  -3.856
  706   2HZ   LYS  95          2HZ       LYS  95   4.319  25.401  -3.739
  707   3HZ   LYS  95          3HZ       LYS  95   3.454  24.543  -2.555
  708    H    LEU  96           H        LEU  96   4.261  18.910  -7.417
  709    HA   LEU  96           HA       LEU  96   2.185  18.921  -9.353
  710   1HB   LEU  96          2HB       LEU  96   4.898  18.882  -9.480
  711   2HB   LEU  96          1HB       LEU  96   4.538  17.215  -9.936
  712    HG   LEU  96           HG       LEU  96   3.200  19.621 -11.200
  713   1HD1  LEU  96          1HD1      LEU  96   5.682  19.536 -11.609
  714   2HD1  LEU  96          2HD1      LEU  96   4.716  19.339 -13.072
  715   3HD1  LEU  96          3HD1      LEU  96   5.461  17.933 -12.311
  716   1HD2  LEU  96          1HD2      LEU  96   3.089  17.546 -12.975
  717   2HD2  LEU  96          2HD2      LEU  96   1.809  17.919 -11.822
  718   3HD2  LEU  96          3HD2      LEU  96   3.001  16.677 -11.444
  719    H    ILE  97           H        ILE  97   3.927  16.093  -7.999
  720    HA   ILE  97           HA       ILE  97   2.335  14.115  -9.258
  721    HB   ILE  97           HB       ILE  97   3.682  13.988  -6.542
  722   1HG1  ILE  97          2HG1      ILE  97   4.788  12.860  -9.098
  723   2HG1  ILE  97          1HG1      ILE  97   4.995  14.577  -8.754
  724   1HG2  ILE  97          1HG2      ILE  97   2.616  11.872  -8.428
  725   2HG2  ILE  97          2HG2      ILE  97   2.157  12.146  -6.747
  726   3HG2  ILE  97          3HG2      ILE  97   3.758  11.513  -7.132
  727   1HD1  ILE  97          1HD1      ILE  97   5.817  12.310  -6.915
  728   2HD1  ILE  97          2HD1      ILE  97   6.037  14.030  -6.591
  729   3HD1  ILE  97          3HD1      ILE  97   6.914  13.263  -7.915
  730    H    ASP  98           H        ASP  98   1.730  16.062  -6.395
  731    HA   ASP  98           HA       ASP  98  -0.410  14.509  -5.305
  732   1HB   ASP  98          2HB       ASP  98   0.184  17.478  -5.191
  733   2HB   ASP  98          1HB       ASP  98  -1.118  16.715  -4.279
  734    H    GLU  99           H        GLU  99  -0.360  17.117  -7.727
  735    HA   GLU  99           HA       GLU  99  -3.208  17.275  -8.051
  736   1HB   GLU  99          2HB       GLU  99  -0.812  18.207  -9.529
  737   2HB   GLU  99          1HB       GLU  99  -2.269  18.001 -10.501
  738   1HG   GLU  99          2HG       GLU  99  -3.513  19.363  -8.782
  739   2HG   GLU  99          1HG       GLU  99  -1.961  19.701  -8.013
  740    H    GLN 100           H        GLN 100  -0.701  15.338  -9.668
  741    HA   GLN 100           HA       GLN 100  -2.430  14.145 -11.614
  742   1HB   GLN 100          2HB       GLN 100  -0.019  12.803 -10.376
  743   2HB   GLN 100          1HB       GLN 100  -0.660  12.591 -12.005
  744   1HG   GLN 100          2HG       GLN 100   0.791  14.978 -10.864
  745   2HG   GLN 100          1HG       GLN 100   1.203  14.028 -12.292
  746   1HE2  GLN 100          1HE2      GLN 100   0.321  17.025 -11.757
  747   2HE2  GLN 100          2HE2      GLN 100  -0.825  17.290 -12.981
  748    H    VAL 101           H        VAL 101  -1.352  12.967  -8.409
  749    HA   VAL 101           HA       VAL 101  -2.932  10.571  -8.495
  750    HB   VAL 101           HB       VAL 101  -1.959  12.136  -6.083
  751   1HG1  VAL 101          1HG1      VAL 101  -2.021   9.396  -5.528
  752   2HG1  VAL 101          2HG1      VAL 101  -3.522   9.695  -6.404
  753   3HG1  VAL 101          3HG1      VAL 101  -3.162  10.605  -4.937
  754   1HG2  VAL 101          1HG2      VAL 101  -0.693   9.721  -7.401
  755   2HG2  VAL 101          2HG2      VAL 101   0.006  10.771  -6.168
  756   3HG2  VAL 101          3HG2      VAL 101  -0.230  11.373  -7.810
  757    H    GLU 102           H        GLU 102  -3.499  13.561  -6.591
  758    HA   GLU 102           HA       GLU 102  -6.060  13.024  -5.666
  759   1HB   GLU 102          2HB       GLU 102  -4.771  15.108  -5.179
  760   2HB   GLU 102          1HB       GLU 102  -5.159  15.691  -6.799
  761   1HG   GLU 102          2HG       GLU 102  -7.585  15.476  -6.254
  762   2HG   GLU 102          1HG       GLU 102  -7.145  15.018  -4.608
  763    H    LYS 103           H        LYS 103  -5.098  13.887  -8.943
  764    HA   LYS 103           HA       LYS 103  -7.795  14.349  -9.901
  765   1HB   LYS 103          2HB       LYS 103  -5.116  13.915 -11.193
  766   2HB   LYS 103          1HB       LYS 103  -6.580  13.858 -12.177
  767   1HG   LYS 103          2HG       LYS 103  -7.139  16.096 -11.693
  768   2HG   LYS 103          1HG       LYS 103  -6.081  16.149 -10.283
  769   1HD   LYS 103          2HD       LYS 103  -4.255  16.666 -11.527
  770   2HD   LYS 103          1HD       LYS 103  -4.682  15.516 -12.794
  771   1HE   LYS 103          2HE       LYS 103  -6.349  17.984 -12.500
  772   2HE   LYS 103          1HE       LYS 103  -4.760  18.130 -13.253
  773   1HZ   LYS 103          1HZ       LYS 103  -6.271  17.675 -14.978
  774   2HZ   LYS 103          2HZ       LYS 103  -7.031  16.431 -14.107
  775   3HZ   LYS 103          3HZ       LYS 103  -5.453  16.216 -14.701
  776    H    LEU 104           H        LEU 104  -5.520  11.655 -10.571
  777    HA   LEU 104           HA       LEU 104  -7.437   9.929 -11.739
  778   1HB   LEU 104          2HB       LEU 104  -4.890   9.363 -10.207
  779   2HB   LEU 104          1HB       LEU 104  -5.847   8.084 -10.954
  780    HG   LEU 104           HG       LEU 104  -5.105  10.472 -12.605
  781   1HD1  LEU 104          1HD1      LEU 104  -3.271   8.172 -11.876
  782   2HD1  LEU 104          2HD1      LEU 104  -2.972   9.892 -11.631
  783   3HD1  LEU 104          3HD1      LEU 104  -3.008   9.227 -13.264
  784   1HD2  LEU 104          1HD2      LEU 104  -4.917   7.697 -13.616
  785   2HD2  LEU 104          2HD2      LEU 104  -5.691   9.107 -14.338
  786   3HD2  LEU 104          3HD2      LEU 104  -6.527   8.185 -13.088
  787    H    VAL 105           H        VAL 105  -7.105  10.945  -8.487
  788    HA   VAL 105           HA       VAL 105  -8.416   8.582  -7.330
  789    HB   VAL 105           HB       VAL 105  -7.758  11.299  -6.149
  790   1HG1  VAL 105          1HG1      VAL 105  -9.462  10.499  -4.762
  791   2HG1  VAL 105          2HG1      VAL 105  -8.029   9.821  -3.991
  792   3HG1  VAL 105          3HG1      VAL 105  -9.031   8.812  -5.037
  793   1HG2  VAL 105          1HG2      VAL 105  -6.004   9.366  -6.901
  794   2HG2  VAL 105          2HG2      VAL 105  -6.401   8.808  -5.276
  795   3HG2  VAL 105          3HG2      VAL 105  -5.739  10.425  -5.515
  796    H    ASN 106           H        ASN 106  -9.319  12.046  -7.215
  797    HA   ASN 106           HA       ASN 106 -12.029  11.685  -6.613
  798   1HB   ASN 106          2HB       ASN 106 -11.338  13.830  -8.572
  799   2HB   ASN 106          1HB       ASN 106 -12.281  13.929  -7.084
  800   1HD2  ASN 106          1HD2      ASN 106 -10.234  12.554  -5.432
  801   2HD2  ASN 106          2HD2      ASN 106  -8.959  13.659  -5.240
  802    H    LEU 107           H        LEU 107 -10.429  11.569  -9.778
  803    HA   LEU 107           HA       LEU 107 -12.898  11.313 -11.276
  804   1HB   LEU 107          2HB       LEU 107 -10.996  12.089 -12.492
  805   2HB   LEU 107          1HB       LEU 107 -10.000  10.745 -11.931
  806    HG   LEU 107           HG       LEU 107 -12.455   9.905 -13.320
  807   1HD1  LEU 107          1HD1      LEU 107 -10.246  11.201 -14.937
  808   2HD1  LEU 107          2HD1      LEU 107 -11.764  12.014 -14.557
  809   3HD1  LEU 107          3HD1      LEU 107 -11.771  10.545 -15.534
  810   1HD2  LEU 107          1HD2      LEU 107  -9.649   9.222 -14.128
  811   2HD2  LEU 107          2HD2      LEU 107 -11.073   8.184 -14.055
  812   3HD2  LEU 107          3HD2      LEU 107 -10.242   8.647 -12.570
  813    H    ALA 108           H        ALA 108 -10.533   9.023  -9.946
  814    HA   ALA 108           HA       ALA 108 -11.486   6.640 -11.097
  815   1HB   ALA 108          1HB       ALA 108  -9.566   6.317  -9.828
  816   2HB   ALA 108          2HB       ALA 108 -10.790   5.679  -8.729
  817   3HB   ALA 108          3HB       ALA 108 -10.158   7.309  -8.496
  818    H    GLU 109           H        GLU 109 -12.499   8.062  -7.966
  819    HA   GLU 109           HA       GLU 109 -14.676   6.186  -7.640
  820   1HB   GLU 109          2HB       GLU 109 -14.107   8.868  -6.342
  821   2HB   GLU 109          1HB       GLU 109 -15.417   7.791  -5.850
  822   1HG   GLU 109          2HG       GLU 109 -12.468   7.077  -5.874
  823   2HG   GLU 109          1HG       GLU 109 -13.419   7.456  -4.437
  824    H    LYS 110           H        LYS 110 -14.377   9.411  -9.056
  825    HA   LYS 110           HA       LYS 110 -17.145  10.021  -9.284
  826   1HB   LYS 110          2HB       LYS 110 -15.206  11.575  -9.788
  827   2HB   LYS 110          1HB       LYS 110 -15.016  10.725 -11.321
  828   1HG   LYS 110          2HG       LYS 110 -17.194  11.382 -12.061
  829   2HG   LYS 110          1HG       LYS 110 -17.638  11.956 -10.453
  830   1HD   LYS 110          2HD       LYS 110 -15.638  13.584 -10.704
  831   2HD   LYS 110          1HD       LYS 110 -15.717  13.193 -12.422
  832   1HE   LYS 110          2HE       LYS 110 -17.809  14.525 -10.703
  833   2HE   LYS 110          1HE       LYS 110 -17.103  15.095 -12.216
  834   1HZ   LYS 110          1HZ       LYS 110 -18.965  12.814 -11.855
  835   2HZ   LYS 110          2HZ       LYS 110 -18.157  13.153 -13.310
  836   3HZ   LYS 110          3HZ       LYS 110 -19.270  14.267 -12.673
  837    H    PHE 111           H        PHE 111 -15.172   7.712 -10.953
  838    HA   PHE 111           HA       PHE 111 -17.273   7.317 -13.028
  839   1HB   PHE 111          2HB       PHE 111 -14.403   6.424 -12.760
  840   2HB   PHE 111          1HB       PHE 111 -15.497   5.621 -13.886
  841    HD1  PHE 111           HD1      PHE 111 -14.854   9.173 -12.845
  842    HD2  PHE 111           HD2      PHE 111 -15.287   6.375 -16.073
  843    HE1  PHE 111           HE1      PHE 111 -14.513  11.008 -14.478
  844    HE2  PHE 111           HE2      PHE 111 -14.946   8.209 -17.707
  845    HZ   PHE 111           HZ       PHE 111 -14.559  10.525 -16.910
  846    H    ASP 112           H        ASP 112 -15.134   4.970 -11.411
  847    HA   ASP 112           HA       ASP 112 -16.863   3.706  -9.666
  848   1HB   ASP 112          2HB       ASP 112 -17.715   3.327 -12.435
  849   2HB   ASP 112          1HB       ASP 112 -17.425   1.793 -11.612
  850    H    ILE 113           H        ILE 113 -14.032   4.021 -10.343
  851    HA   ILE 113           HA       ILE 113 -13.249   1.133 -10.431
  852    HB   ILE 113           HB       ILE 113 -11.049   1.955 -11.327
  853   1HG1  ILE 113          2HG1      ILE 113 -12.590   4.567 -11.437
  854   2HG1  ILE 113          1HG1      ILE 113 -11.111   4.250 -10.528
  855   1HG2  ILE 113          1HG2      ILE 113 -13.227   2.961 -13.135
  856   2HG2  ILE 113          2HG2      ILE 113 -13.183   1.253 -12.697
  857   3HG2  ILE 113          3HG2      ILE 113 -11.813   1.985 -13.533
  858   1HD1  ILE 113          1HD1      ILE 113 -10.370   5.356 -12.491
  859   2HD1  ILE 113          2HD1      ILE 113 -11.463   4.432 -13.521
  860   3HD1  ILE 113          3HD1      ILE 113 -10.056   3.649 -12.802
  861    H    ILE 114           H        ILE 114 -10.876   0.990  -9.397
  862    HA   ILE 114           HA       ILE 114 -10.974   2.528  -6.831
  863    HB   ILE 114           HB       ILE 114 -11.485   0.277  -6.266
  864   1HG1  ILE 114          2HG1      ILE 114  -9.540  -0.455  -4.990
  865   2HG1  ILE 114          1HG1      ILE 114  -8.471   0.518  -6.000
  866   1HG2  ILE 114          1HG2      ILE 114 -11.100  -1.145  -8.012
  867   2HG2  ILE 114          2HG2      ILE 114  -9.579  -1.439  -7.170
  868   3HG2  ILE 114          3HG2      ILE 114  -9.639  -0.295  -8.512
  869   1HD1  ILE 114          1HD1      ILE 114 -10.746   1.922  -4.680
  870   2HD1  ILE 114          2HD1      ILE 114  -9.113   2.497  -5.017
  871   3HD1  ILE 114          3HD1      ILE 114  -9.404   1.417  -3.654
  872    H    TYR 115           H        TYR 115  -9.345   4.006  -6.932
  873    HA   TYR 115           HA       TYR 115  -6.891   3.404  -8.449
  874   1HB   TYR 115          2HB       TYR 115  -7.605   5.641  -8.737
  875   2HB   TYR 115          1HB       TYR 115  -7.953   5.840  -7.019
  876    HD1  TYR 115           HD1      TYR 115  -5.394   5.962  -9.610
  877    HD2  TYR 115           HD2      TYR 115  -6.079   5.984  -5.370
  878    HE1  TYR 115           HE1      TYR 115  -3.098   6.826  -9.243
  879    HE2  TYR 115           HE2      TYR 115  -3.783   6.846  -5.003
  880    HH   TYR 115           HH       TYR 115  -1.566   6.775  -6.293
  881    H    ASP 116           H        ASP 116  -5.102   2.559  -7.499
  882    HA   ASP 116           HA       ASP 116  -4.157   3.287  -4.900
  883   1HB   ASP 116          2HB       ASP 116  -6.090   1.984  -4.113
  884   2HB   ASP 116          1HB       ASP 116  -5.556   0.600  -5.069
  885    H    GLY 117           H        GLY 117  -2.319   3.406  -6.414
  886   1HA   GLY 117          2HA       GLY 117  -0.382   1.476  -6.157
  887   2HA   GLY 117          1HA       GLY 117  -1.288   0.923  -7.566
  888    H    TRP 118           H        TRP 118   0.571   3.666  -6.287
  889    HA   TRP 118           HA       TRP 118   1.104   4.458  -9.122
  890   1HB   TRP 118          2HB       TRP 118   0.840   6.688  -8.622
  891   2HB   TRP 118          1HB       TRP 118  -0.255   6.025  -7.409
  892    HD1  TRP 118           HD1      TRP 118   0.527   6.045  -4.886
  893    HE1  TRP 118           HE1      TRP 118   2.409   7.310  -3.657
  894    HE3  TRP 118           HE3      TRP 118   3.284   7.626  -8.883
  895    HZ2  TRP 118           HZ2      TRP 118   4.771   8.796  -4.288
  896    HZ3  TRP 118           HZ3      TRP 118   5.342   8.963  -8.542
  897    HH2  TRP 118           HH2      TRP 118   6.089   9.550  -6.250
  898    H    GLY 119           H        GLY 119   3.270   5.018  -9.607
  899   1HA   GLY 119          2HA       GLY 119   5.300   5.108  -7.513
  900   2HA   GLY 119          1HA       GLY 119   5.356   3.623  -8.465
  901    H    THR 120           H        THR 120   7.562   5.172  -8.634
  902    HA   THR 120           HA       THR 120   7.344   6.285 -11.389
  903    HB   THR 120           HB       THR 120   7.416   8.310 -10.224
  904    HG1  THR 120           HG1      THR 120   9.134   8.733 -11.353
  905   1HG2  THR 120          1HG2      THR 120   8.696   8.654  -8.157
  906   2HG2  THR 120          2HG2      THR 120   9.334   7.014  -8.266
  907   3HG2  THR 120          3HG2      THR 120   7.612   7.273  -7.985
  908    H    TYR 121           H        TYR 121   9.763   6.715 -12.167
  909    HA   TYR 121           HA       TYR 121  11.383   4.355 -11.291
  910   1HB   TYR 121          2HB       TYR 121  10.286   4.450 -13.687
  911   2HB   TYR 121          1HB       TYR 121  11.628   5.538 -14.040
  912    HD1  TYR 121           HD1      TYR 121  13.996   4.751 -13.658
  913    HD2  TYR 121           HD2      TYR 121  10.622   2.099 -13.466
  914    HE1  TYR 121           HE1      TYR 121  15.512   2.804 -13.897
  915    HE2  TYR 121           HE2      TYR 121  12.140   0.151 -13.705
  916    HH   TYR 121           HH       TYR 121  15.149   0.084 -13.087
  917    H    TYR 122           H        TYR 122  13.334   4.904 -10.455
  918    HA   TYR 122           HA       TYR 122  14.221   7.654 -10.392
  919   1HB   TYR 122          2HB       TYR 122  14.877   6.342  -8.533
  920   2HB   TYR 122          1HB       TYR 122  15.459   5.030  -9.558
  921    HD1  TYR 122           HD1      TYR 122  17.663   5.058 -10.499
  922    HD2  TYR 122           HD2      TYR 122  16.143   8.500  -8.428
  923    HE1  TYR 122           HE1      TYR 122  19.932   6.061 -10.501
  924    HE2  TYR 122           HE2      TYR 122  18.412   9.503  -8.430
  925    HH   TYR 122           HH       TYR 122  20.567   9.169 -10.047
  926    H    GLU 123           H        GLU 123  15.804   8.657 -11.634
  927    HA   GLU 123           HA       GLU 123  16.960   7.022 -13.859
  928   1HB   GLU 123          2HB       GLU 123  15.167   9.092 -14.147
  929   2HB   GLU 123          1HB       GLU 123  16.716   9.915 -14.337
  930   1HG   GLU 123          2HG       GLU 123  17.370   8.462 -16.128
  931   2HG   GLU 123          1HG       GLU 123  16.021   7.368 -15.818
  932    H    GLY 124           H        GLY 124  18.918   8.373 -14.838
  933   1HA   GLY 124          2HA       GLY 124  20.686  10.039 -14.131
  934   2HA   GLY 124          1HA       GLY 124  20.551   9.333 -12.519
  935    H    LEU 125           H        LEU 125  20.235   6.597 -13.710
  936    HA   LEU 125           HA       LEU 125  23.063   5.932 -13.783
  937   1HB   LEU 125          2HB       LEU 125  22.132   3.606 -14.331
  938   2HB   LEU 125          1HB       LEU 125  21.635   4.303 -12.788
  939    HG   LEU 125           HG       LEU 125  19.800   5.205 -14.787
  940   1HD1  LEU 125          1HD1      LEU 125  18.865   2.935 -15.404
  941   2HD1  LEU 125          2HD1      LEU 125  20.364   2.228 -14.801
  942   3HD1  LEU 125          3HD1      LEU 125  20.400   3.328 -16.178
  943   1HD2  LEU 125          1HD2      LEU 125  19.541   4.751 -12.261
  944   2HD2  LEU 125          2HD2      LEU 125  19.308   3.062 -12.711
  945   3HD2  LEU 125          3HD2      LEU 125  18.188   4.293 -13.296
  946    H    GLU 126           H        GLU 126  24.310   6.083 -15.580
  947    HA   GLU 126           HA       GLU 126  23.239   6.671 -18.178
  948   1HB   GLU 126          2HB       GLU 126  25.831   6.462 -16.957
  949   2HB   GLU 126          1HB       GLU 126  25.839   5.538 -18.459
  950   1HG   GLU 126          2HG       GLU 126  24.816   8.382 -18.235
  951   2HG   GLU 126          1HG       GLU 126  26.446   7.962 -18.761
  952    H    HIS 127           H        HIS 127  24.676   3.681 -16.838
  953    HA   HIS 127           HA       HIS 127  24.410   1.450 -17.504
  954   1HB   HIS 127          2HB       HIS 127  21.979   2.092 -17.230
  955   2HB   HIS 127          1HB       HIS 127  21.946   2.448 -18.958
  956    HD2  HIS 127           HD2      HIS 127  22.435  -0.718 -16.620
  957    HE1  HIS 127           HE1      HIS 127  21.588  -2.043 -20.540
  958    HE2  HIS 127           HE2      HIS 127  21.945  -2.781 -18.140
  959    H    HIS 128           H        HIS 128  26.272   2.677 -18.974
  960    HA   HIS 128           HA       HIS 128  26.023   1.368 -21.577
  961   1HB   HIS 128          2HB       HIS 128  24.967   3.365 -22.289
  962   2HB   HIS 128          1HB       HIS 128  26.029   4.375 -21.308
  963    HD2  HIS 128           HD2      HIS 128  28.481   5.045 -22.526
  964    HE1  HIS 128           HE1      HIS 128  27.874   2.871 -26.096
  965    HE2  HIS 128           HE2      HIS 128  29.374   4.548 -24.926
  966    H    HIS 129           H        HIS 129  27.863   3.615 -19.526
  967    HA   HIS 129           HA       HIS 129  30.367   2.352 -20.572
  968   1HB   HIS 129          2HB       HIS 129  31.516   4.433 -19.915
  969   2HB   HIS 129          1HB       HIS 129  30.205   4.778 -21.043
  970    HD2  HIS 129           HD2      HIS 129  27.791   5.820 -19.712
  971    HE1  HIS 129           HE1      HIS 129  29.909   7.048 -16.270
  972    HE2  HIS 129           HE2      HIS 129  27.710   7.233 -17.522
  973    H    HIS 130           H        HIS 130  32.059   3.281 -18.509
  974    HA   HIS 130           HA       HIS 130  32.782   2.652 -16.365
  975   1HB   HIS 130          2HB       HIS 130  30.773   4.066 -15.756
  976   2HB   HIS 130          1HB       HIS 130  29.826   2.580 -15.695
  977    HD2  HIS 130           HD2      HIS 130  31.905   0.651 -14.044
  978    HE1  HIS 130           HE1      HIS 130  31.952   3.733 -11.157
  979    HE2  HIS 130           HE2      HIS 130  32.477   1.287 -11.580
  980    H    HIS 131           H        HIS 131  33.621   0.598 -16.598
  981    HA   HIS 131           HA       HIS 131  31.694  -1.664 -16.244
  982   1HB   HIS 131          2HB       HIS 131  33.243  -3.021 -17.671
  983   2HB   HIS 131          1HB       HIS 131  32.483  -1.692 -18.545
  984    HD2  HIS 131           HD2      HIS 131  35.767  -3.036 -18.862
  985    HE1  HIS 131           HE1      HIS 131  36.658   1.057 -18.309
  986    HE2  HIS 131           HE2      HIS 131  37.580  -1.173 -19.089
  987    H    HIS 132           HN       HIS 132  35.240  -1.129 -16.218
  988    HA   HIS 132           HA       HIS 132  35.509  -2.985 -13.960
  989   1HB   HIS 132          2HB       HIS 132  37.169  -2.583 -15.950
  990   2HB   HIS 132          1HB       HIS 132  37.727  -1.226 -14.972
  991    HD2  HIS 132           HD2      HIS 132  38.858  -2.003 -12.412
  992    HE1  HIS 132           HE1      HIS 132  39.235  -6.082 -13.442
  993    HE2  HIS 132           HE2      HIS 132  39.887  -4.306 -11.751
  Start of MODEL   12
    1   1H    MET   1          1H        MET   1 -21.834  17.847   5.846
    2   2H    MET   1          2H        MET   1 -21.426  17.164   7.348
    3   3H    MET   1          3H        MET   1 -20.826  18.694   6.915
    4    HA   MET   1           HA       MET   1 -22.879  18.437   8.512
    5   1HB   MET   1          2HB       MET   1 -21.809  20.556   7.768
    6   2HB   MET   1          1HB       MET   1 -22.732  20.474   6.268
    7   1HG   MET   1          2HG       MET   1 -24.571  20.123   8.418
    8   2HG   MET   1          1HG       MET   1 -23.562  21.516   8.806
    9   1HE   MET   1          1HE       MET   1 -22.643  22.826   7.009
   10   2HE   MET   1          2HE       MET   1 -23.889  24.071   7.007
   11   3HE   MET   1          3HE       MET   1 -23.422  23.300   5.493
   12    H    SER   2           H        SER   2 -24.366  19.943   5.846
   13    HA   SER   2           HA       SER   2 -26.150  17.571   5.463
   14   1HB   SER   2          2HB       SER   2 -26.973  19.740   6.785
   15   2HB   SER   2          1HB       SER   2 -27.231  20.341   5.149
   16    HG   SER   2           HG       SER   2 -29.042  19.190   6.076
   17    H    HIS   3           H        HIS   3 -24.337  20.155   4.030
   18    HA   HIS   3           HA       HIS   3 -25.518  19.559   1.358
   19   1HB   HIS   3          2HB       HIS   3 -24.886  21.970   2.518
   20   2HB   HIS   3          1HB       HIS   3 -23.457  21.656   1.534
   21    HD2  HIS   3           HD2      HIS   3 -27.342  22.178   1.005
   22    HE1  HIS   3           HE1      HIS   3 -25.425  22.436  -2.749
   23    HE2  HIS   3           HE2      HIS   3 -27.633  22.710  -1.531
   24    H    GLN   4           H        GLN   4 -24.384  18.280  -0.021
   25    HA   GLN   4           HA       GLN   4 -22.608  17.040  -0.925
   26   1HB   GLN   4          2HB       GLN   4 -20.677  18.970   0.333
   27   2HB   GLN   4          1HB       GLN   4 -20.604  18.196  -1.251
   28   1HG   GLN   4          2HG       GLN   4 -22.289  20.536  -0.376
   29   2HG   GLN   4          1HG       GLN   4 -21.221  20.405  -1.774
   30   1HE2  GLN   4          1HE2      GLN   4 -22.096  17.932  -2.859
   31   2HE2  GLN   4          2HE2      GLN   4 -23.706  18.095  -3.372
   32    H    ASP   5           H        ASP   5 -23.301  15.520   0.914
   33    HA   ASP   5           HA       ASP   5 -20.890  14.918   2.538
   34   1HB   ASP   5          2HB       ASP   5 -22.842  16.251   3.778
   35   2HB   ASP   5          1HB       ASP   5 -23.543  14.636   3.888
   36    H    ASP   6           H        ASP   6 -20.413  12.795   2.280
   37    HA   ASP   6           HA       ASP   6 -22.656  10.884   1.812
   38   1HB   ASP   6          2HB       ASP   6 -21.006   9.717   0.192
   39   2HB   ASP   6          1HB       ASP   6 -21.829  11.166  -0.386
   40    H    TYR   7           H        TYR   7 -19.135  10.397   1.761
   41    HA   TYR   7           HA       TYR   7 -19.276   9.099   4.425
   42   1HB   TYR   7          2HB       TYR   7 -18.459   7.724   1.855
   43   2HB   TYR   7          1HB       TYR   7 -17.992   7.122   3.446
   44    HD1  TYR   7           HD1      TYR   7 -20.822   7.748   1.158
   45    HD2  TYR   7           HD2      TYR   7 -19.624   6.158   4.964
   46    HE1  TYR   7           HE1      TYR   7 -23.035   6.655   1.396
   47    HE2  TYR   7           HE2      TYR   7 -21.837   5.064   5.203
   48    HH   TYR   7           HH       TYR   7 -23.727   4.481   4.100
   49    H    LEU   8           H        LEU   8 -16.916   8.352   5.009
   50    HA   LEU   8           HA       LEU   8 -15.023  10.432   3.984
   51   1HB   LEU   8          2HB       LEU   8 -15.415   9.325   6.772
   52   2HB   LEU   8          1HB       LEU   8 -13.953  10.194   6.300
   53    HG   LEU   8           HG       LEU   8 -16.700  11.359   5.837
   54   1HD1  LEU   8          1HD1      LEU   8 -14.933  11.700   8.280
   55   2HD1  LEU   8          2HD1      LEU   8 -16.480  10.854   8.244
   56   3HD1  LEU   8          3HD1      LEU   8 -16.419  12.592   7.955
   57   1HD2  LEU   8          1HD2      LEU   8 -14.015  12.122   5.231
   58   2HD2  LEU   8          2HD2      LEU   8 -14.619  13.235   6.458
   59   3HD2  LEU   8          3HD2      LEU   8 -15.494  13.037   4.940
   60    H    SER   9           H        SER   9 -13.922   9.138   2.491
   61    HA   SER   9           HA       SER   9 -12.122   7.121   3.656
   62   1HB   SER   9          2HB       SER   9 -13.317   6.037   1.230
   63   2HB   SER   9          1HB       SER   9 -13.089   5.271   2.800
   64    HG   SER   9           HG       SER   9 -15.163   5.518   2.999
   65    H    VAL  10           H        VAL  10 -13.256   7.942   0.357
   66    HA   VAL  10           HA       VAL  10 -10.867   7.778  -1.010
   67    HB   VAL  10           HB       VAL  10 -12.846  10.053  -1.338
   68   1HG1  VAL  10          1HG1      VAL  10 -11.637   8.883  -3.722
   69   2HG1  VAL  10          2HG1      VAL  10 -10.424   9.544  -2.626
   70   3HG1  VAL  10          3HG1      VAL  10 -11.724  10.573  -3.228
   71   1HG2  VAL  10          1HG2      VAL  10 -13.834   7.707  -1.276
   72   2HG2  VAL  10          2HG2      VAL  10 -12.859   7.348  -2.702
   73   3HG2  VAL  10          3HG2      VAL  10 -14.104   8.595  -2.776
   74    H    GLU  11           H        GLU  11 -11.824  10.307   1.250
   75    HA   GLU  11           HA       GLU  11  -9.571  12.040   0.605
   76   1HB   GLU  11          2HB       GLU  11 -10.259  13.278   2.640
   77   2HB   GLU  11          1HB       GLU  11 -11.631  12.968   1.575
   78   1HG   GLU  11          2HG       GLU  11 -12.611  12.171   3.471
   79   2HG   GLU  11          1HG       GLU  11 -11.671  10.721   3.118
   80    H    GLU  12           H        GLU  12 -10.187   9.419   2.864
   81    HA   GLU  12           HA       GLU  12  -7.944   9.903   4.592
   82   1HB   GLU  12          2HB       GLU  12  -9.095   7.181   3.949
   83   2HB   GLU  12          1HB       GLU  12  -8.340   7.713   5.452
   84   1HG   GLU  12          2HG       GLU  12 -10.855   9.010   4.393
   85   2HG   GLU  12          1HG       GLU  12 -10.909   7.585   5.431
   86    H    LEU  13           H        LEU  13  -8.339   7.765   1.750
   87    HA   LEU  13           HA       LEU  13  -5.718   6.697   1.730
   88   1HB   LEU  13          2HB       LEU  13  -7.311   7.410  -0.745
   89   2HB   LEU  13          1HB       LEU  13  -6.117   6.124  -0.569
   90    HG   LEU  13           HG       LEU  13  -8.856   6.285   0.707
   91   1HD1  LEU  13          1HD1      LEU  13  -9.438   4.909  -0.976
   92   2HD1  LEU  13          2HD1      LEU  13  -8.176   3.772  -0.502
   93   3HD1  LEU  13          3HD1      LEU  13  -7.815   5.062  -1.648
   94   1HD2  LEU  13          1HD2      LEU  13  -6.480   4.521   1.334
   95   2HD2  LEU  13          2HD2      LEU  13  -8.131   4.031   1.711
   96   3HD2  LEU  13          3HD2      LEU  13  -7.448   5.478   2.455
   97    H    ILE  14           H        ILE  14  -6.938   9.801   0.564
   98    HA   ILE  14           HA       ILE  14  -4.582  10.564  -0.888
   99    HB   ILE  14           HB       ILE  14  -6.738  12.209   0.462
  100   1HG1  ILE  14          2HG1      ILE  14  -6.183  11.591  -2.458
  101   2HG1  ILE  14          1HG1      ILE  14  -7.401  10.777  -1.477
  102   1HG2  ILE  14          1HG2      ILE  14  -5.224  13.899   0.276
  103   2HG2  ILE  14          2HG2      ILE  14  -5.614  13.826  -1.442
  104   3HG2  ILE  14          3HG2      ILE  14  -4.195  12.981  -0.823
  105   1HD1  ILE  14          1HD1      ILE  14  -8.855  12.431  -1.934
  106   2HD1  ILE  14          2HD1      ILE  14  -7.621  13.273  -2.870
  107   3HD1  ILE  14          3HD1      ILE  14  -7.779  13.580  -1.140
  108    H    GLU  15           H        GLU  15  -5.647  11.362   2.441
  109    HA   GLU  15           HA       GLU  15  -3.418  12.871   3.238
  110   1HB   GLU  15          2HB       GLU  15  -5.551  11.398   4.556
  111   2HB   GLU  15          1HB       GLU  15  -4.045  11.287   5.467
  112   1HG   GLU  15          2HG       GLU  15  -4.960  13.943   4.390
  113   2HG   GLU  15          1HG       GLU  15  -5.630  13.321   5.899
  114    H    ILE  16           H        ILE  16  -3.833   9.376   3.925
  115    HA   ILE  16           HA       ILE  16  -1.188   8.879   4.754
  116    HB   ILE  16           HB       ILE  16  -3.333   7.187   3.511
  117   1HG1  ILE  16          2HG1      ILE  16  -3.280   6.095   5.661
  118   2HG1  ILE  16          1HG1      ILE  16  -1.768   6.896   6.090
  119   1HG2  ILE  16          1HG2      ILE  16  -1.555   6.075   2.496
  120   2HG2  ILE  16          2HG2      ILE  16  -1.615   5.258   4.057
  121   3HG2  ILE  16          3HG2      ILE  16  -0.417   6.521   3.767
  122   1HD1  ILE  16          1HD1      ILE  16  -2.814   9.010   6.302
  123   2HD1  ILE  16          2HD1      ILE  16  -3.941   7.889   7.064
  124   3HD1  ILE  16          3HD1      ILE  16  -4.252   8.478   5.431
  125    H    GLN  17           H        GLN  17  -2.564   8.701   1.468
  126    HA   GLN  17           HA       GLN  17  -0.210   7.838   0.138
  127   1HB   GLN  17          2HB       GLN  17  -2.288   7.828  -1.065
  128   2HB   GLN  17          1HB       GLN  17  -2.521   9.556  -0.796
  129   1HG   GLN  17          2HG       GLN  17  -1.643   8.869  -3.108
  130   2HG   GLN  17          1HG       GLN  17  -0.745  10.133  -2.269
  131   1HE2  GLN  17          1HE2      GLN  17  -0.665   6.593  -1.654
  132   2HE2  GLN  17          2HE2      GLN  17   0.990   6.419  -1.987
  133    H    LYS  18           H        LYS  18  -0.965  10.874   1.598
  134    HA   LYS  18           HA       LYS  18   0.978  12.387  -0.001
  135   1HB   LYS  18          2HB       LYS  18  -1.103  12.990   1.931
  136   2HB   LYS  18          1HB       LYS  18   0.391  13.839   2.330
  137   1HG   LYS  18          2HG       LYS  18   0.500  14.533  -0.123
  138   2HG   LYS  18          1HG       LYS  18  -1.153  13.935  -0.269
  139   1HD   LYS  18          2HD       LYS  18  -0.568  15.788   1.994
  140   2HD   LYS  18          1HD       LYS  18  -0.622  16.482   0.374
  141   1HE   LYS  18          2HE       LYS  18  -2.853  15.284   0.073
  142   2HE   LYS  18          1HE       LYS  18  -2.807  14.957   1.805
  143   1HZ   LYS  18          1HZ       LYS  18  -3.939  17.104   0.873
  144   2HZ   LYS  18          2HZ       LYS  18  -2.348  17.701   0.887
  145   3HZ   LYS  18          3HZ       LYS  18  -3.063  17.147   2.324
  146    H    GLU  19           H        GLU  19   0.756  11.614   3.502
  147    HA   GLU  19           HA       GLU  19   3.342  12.374   4.237
  148   1HB   GLU  19          2HB       GLU  19   1.839   9.926   5.222
  149   2HB   GLU  19          1HB       GLU  19   3.173  10.721   6.057
  150   1HG   GLU  19          2HG       GLU  19   0.712  12.273   5.273
  151   2HG   GLU  19          1HG       GLU  19   0.748  11.334   6.766
  152    H    GLU  20           H        GLU  20   2.299   9.409   2.614
  153    HA   GLU  20           HA       GLU  20   4.863   8.090   2.767
  154   1HB   GLU  20          2HB       GLU  20   2.477   7.140   2.183
  155   2HB   GLU  20          1HB       GLU  20   2.918   7.586   0.534
  156   1HG   GLU  20          2HG       GLU  20   3.630   5.320   0.814
  157   2HG   GLU  20          1HG       GLU  20   5.092   6.302   0.910
  158    H    THR  21           H        THR  21   3.230   9.858   0.112
  159    HA   THR  21           HA       THR  21   5.332   9.714  -1.766
  160    HB   THR  21           HB       THR  21   3.582  12.152  -1.394
  161    HG1  THR  21           HG1      THR  21   2.034  11.015  -2.577
  162   1HG2  THR  21          1HG2      THR  21   3.698  12.103  -3.907
  163   2HG2  THR  21          2HG2      THR  21   4.864  10.787  -3.772
  164   3HG2  THR  21          3HG2      THR  21   5.254  12.379  -3.122
  165    H    ARG  22           H        ARG  22   4.935  11.809   1.040
  166    HA   ARG  22           HA       ARG  22   7.024  13.667   0.356
  167   1HB   ARG  22          2HB       ARG  22   6.093  12.862   3.127
  168   2HB   ARG  22          1HB       ARG  22   6.925  14.352   2.683
  169   1HG   ARG  22          2HG       ARG  22   4.602  14.024   1.010
  170   2HG   ARG  22          1HG       ARG  22   4.129  13.880   2.702
  171   1HD   ARG  22          2HD       ARG  22   5.528  16.189   1.345
  172   2HD   ARG  22          1HD       ARG  22   4.007  16.207   2.237
  173    HE   ARG  22           HE       ARG  22   5.862  15.397   4.126
  174   1HH1  ARG  22          1HH2      ARG  22   5.538  18.002   1.892
  175   2HH1  ARG  22          2HH2      ARG  22   6.406  19.132   2.878
  176   1HH2  ARG  22          2HH1      ARG  22   7.002  16.855   5.425
  177   2HH2  ARG  22          1HH1      ARG  22   7.235  18.483   4.877
  178    H    ASP  23           H        ASP  23   7.001  10.753   2.429
  179    HA   ASP  23           HA       ASP  23   9.734  10.835   3.182
  180   1HB   ASP  23          2HB       ASP  23   7.585   8.823   3.133
  181   2HB   ASP  23          1HB       ASP  23   9.207   8.142   2.996
  182    H    ILE  24           H        ILE  24   8.211   9.133   0.424
  183    HA   ILE  24           HA       ILE  24  10.598   8.048  -0.659
  184    HB   ILE  24           HB       ILE  24   7.969   8.864  -1.896
  185   1HG1  ILE  24          2HG1      ILE  24   9.307   6.162  -1.552
  186   2HG1  ILE  24          1HG1      ILE  24   8.156   6.842  -0.402
  187   1HG2  ILE  24          1HG2      ILE  24   9.320   9.131  -3.776
  188   2HG2  ILE  24          2HG2      ILE  24   8.954   7.408  -3.862
  189   3HG2  ILE  24          3HG2      ILE  24  10.504   7.949  -3.218
  190   1HD1  ILE  24          1HD1      ILE  24   6.812   7.151  -2.774
  191   2HD1  ILE  24          2HD1      ILE  24   6.587   5.796  -1.668
  192   3HD1  ILE  24          3HD1      ILE  24   7.674   5.638  -3.048
  193    H    ILE  25           H        ILE  25   8.902  11.033  -1.708
  194    HA   ILE  25           HA       ILE  25  10.754  11.987  -3.544
  195    HB   ILE  25           HB       ILE  25   8.885  13.311  -1.626
  196   1HG1  ILE  25          2HG1      ILE  25   7.829  14.054  -3.625
  197   2HG1  ILE  25          1HG1      ILE  25   9.280  13.774  -4.588
  198   1HG2  ILE  25          1HG2      ILE  25  10.752  14.807  -1.414
  199   2HG2  ILE  25          2HG2      ILE  25   9.639  15.547  -2.563
  200   3HG2  ILE  25          3HG2      ILE  25  11.090  14.728  -3.142
  201   1HD1  ILE  25          1HD1      ILE  25   8.945  11.483  -4.680
  202   2HD1  ILE  25          2HD1      ILE  25   7.272  12.037  -4.618
  203   3HD1  ILE  25          3HD1      ILE  25   8.059  11.446  -3.157
  204    H    GLN  26           H        GLN  26  10.792  12.857  -0.061
  205    HA   GLN  26           HA       GLN  26  13.212  14.226   0.020
  206   1HB   GLN  26          2HB       GLN  26  12.009  12.309   2.027
  207   2HB   GLN  26          1HB       GLN  26  13.449  13.268   2.371
  208   1HG   GLN  26          2HG       GLN  26  10.940  14.578   1.336
  209   2HG   GLN  26          1HG       GLN  26  11.141  14.247   3.056
  210   1HE2  GLN  26          1HE2      GLN  26  13.434  15.029   3.917
  211   2HE2  GLN  26          2HE2      GLN  26  13.936  16.555   3.365
  212    H    ALA  27           H        ALA  27  12.734  10.703   0.031
  213    HA   ALA  27           HA       ALA  27  15.522  10.062   0.375
  214   1HB   ALA  27          1HB       ALA  27  13.692   8.238  -1.137
  215   2HB   ALA  27          2HB       ALA  27  13.328   8.573   0.556
  216   3HB   ALA  27          3HB       ALA  27  14.875   7.852   0.111
  217    H    LEU  28           H        LEU  28  13.523   9.612  -2.567
  218    HA   LEU  28           HA       LEU  28  15.448   9.141  -4.450
  219   1HB   LEU  28          2HB       LEU  28  13.129  11.078  -4.710
  220   2HB   LEU  28          1HB       LEU  28  14.071  10.473  -6.073
  221    HG   LEU  28           HG       LEU  28  12.514   8.762  -4.113
  222   1HD1  LEU  28          1HD1      LEU  28  11.103   8.286  -6.116
  223   2HD1  LEU  28          2HD1      LEU  28  12.021   9.493  -7.015
  224   3HD1  LEU  28          3HD1      LEU  28  11.040   9.982  -5.634
  225   1HD2  LEU  28          1HD2      LEU  28  14.116   7.267  -4.795
  226   2HD2  LEU  28          2HD2      LEU  28  14.513   8.197  -6.240
  227   3HD2  LEU  28          3HD2      LEU  28  13.086   7.162  -6.223
  228    H    LEU  29           H        LEU  29  14.743  12.317  -3.013
  229    HA   LEU  29           HA       LEU  29  16.576  13.789  -4.659
  230   1HB   LEU  29          2HB       LEU  29  14.733  14.428  -2.691
  231   2HB   LEU  29          1HB       LEU  29  16.275  14.802  -1.922
  232    HG   LEU  29           HG       LEU  29  15.388  16.755  -3.154
  233   1HD1  LEU  29          1HD1      LEU  29  17.412  17.296  -4.344
  234   2HD1  LEU  29          2HD1      LEU  29  17.790  15.593  -4.591
  235   3HD1  LEU  29          3HD1      LEU  29  17.868  16.287  -2.973
  236   1HD2  LEU  29          1HD2      LEU  29  14.569  16.615  -5.263
  237   2HD2  LEU  29          2HD2      LEU  29  14.560  14.870  -5.001
  238   3HD2  LEU  29          3HD2      LEU  29  15.927  15.633  -5.812
  239    H    GLU  30           H        GLU  30  16.962  12.866  -1.211
  240    HA   GLU  30           HA       GLU  30  19.629  13.467  -0.847
  241   1HB   GLU  30          2HB       GLU  30  17.885  12.184   0.690
  242   2HB   GLU  30          1HB       GLU  30  18.732  10.762   0.079
  243   1HG   GLU  30          2HG       GLU  30  19.916  13.107   1.583
  244   2HG   GLU  30          1HG       GLU  30  19.865  11.419   2.091
  245    H    ASP  31           H        ASP  31  18.299  10.835  -2.761
  246    HA   ASP  31           HA       ASP  31  20.797   9.426  -3.128
  247   1HB   ASP  31          2HB       ASP  31  18.856   8.161  -3.606
  248   2HB   ASP  31          1HB       ASP  31  18.158   9.445  -4.594
  249    H    GLY  32           H        GLY  32  19.490  12.331  -4.429
  250   1HA   GLY  32          2HA       GLY  32  20.678  13.900  -5.772
  251   2HA   GLY  32          1HA       GLY  32  21.885  12.658  -6.109
  252    H    SER  33           H        SER  33  18.408  12.204  -6.506
  253    HA   SER  33           HA       SER  33  18.669  11.121  -9.130
  254   1HB   SER  33          2HB       SER  33  16.190  11.452  -9.259
  255   2HB   SER  33          1HB       SER  33  16.702  10.653  -7.775
  256    HG   SER  33           HG       SER  33  15.285  12.295  -7.245
  257    H    ASP  34           H        ASP  34  18.414  14.405  -7.989
  258    HA   ASP  34           HA       ASP  34  18.466  16.446  -9.143
  259   1HB   ASP  34          2HB       ASP  34  19.310  15.280 -11.710
  260   2HB   ASP  34          1HB       ASP  34  20.098  16.509 -10.720
  261    HA   PRO  35           HA       PRO  35  14.352  15.504 -11.005
  262   1HB   PRO  35          2HB       PRO  35  13.891  18.287 -10.098
  263   2HB   PRO  35          1HB       PRO  35  12.937  16.827  -9.784
  264   1HG   PRO  35          2HG       PRO  35  14.449  17.991  -7.897
  265   2HG   PRO  35          1HG       PRO  35  14.181  16.242  -7.961
  266   1HD   PRO  35          2HD       PRO  35  16.613  17.804  -8.723
  267   2HD   PRO  35          1HD       PRO  35  16.489  16.169  -8.036
  268    H    ASP  36           H        ASP  36  16.910  17.493 -11.812
  269    HA   ASP  36           HA       ASP  36  15.706  19.305 -13.683
  270   1HB   ASP  36          2HB       ASP  36  18.381  18.523 -12.885
  271   2HB   ASP  36          1HB       ASP  36  18.280  18.675 -14.640
  272    H    ALA  37           H        ALA  37  16.639  15.926 -13.887
  273    HA   ALA  37           HA       ALA  37  16.328  15.871 -16.812
  274   1HB   ALA  37          1HB       ALA  37  16.810  13.705 -14.748
  275   2HB   ALA  37          2HB       ALA  37  17.978  14.371 -15.889
  276   3HB   ALA  37          3HB       ALA  37  16.640  13.380 -16.473
  277    H    LEU  38           H        LEU  38  14.073  16.602 -14.907
  278    HA   LEU  38           HA       LEU  38  11.767  16.196 -14.752
  279   1HB   LEU  38          2HB       LEU  38  12.574  15.138 -17.422
  280   2HB   LEU  38          1HB       LEU  38  10.978  14.681 -16.822
  281    HG   LEU  38           HG       LEU  38  11.962  17.544 -16.881
  282   1HD1  LEU  38          1HD1      LEU  38   9.923  16.550 -18.817
  283   2HD1  LEU  38          2HD1      LEU  38  11.607  16.140 -19.143
  284   3HD1  LEU  38          3HD1      LEU  38  11.122  17.829 -19.006
  285   1HD2  LEU  38          1HD2      LEU  38   9.275  17.661 -16.971
  286   2HD2  LEU  38          2HD2      LEU  38  10.158  17.576 -15.446
  287   3HD2  LEU  38          3HD2      LEU  38   9.450  16.116 -16.137
  288    H    TYR  39           H        TYR  39  10.164  14.387 -14.408
  289    HA   TYR  39           HA       TYR  39  11.541  11.826 -13.721
  290   1HB   TYR  39          2HB       TYR  39  10.292  13.712 -11.936
  291   2HB   TYR  39          1HB       TYR  39   9.377  12.205 -11.919
  292    HD1  TYR  39           HD1      TYR  39  12.752  13.687 -11.447
  293    HD2  TYR  39           HD2      TYR  39  10.281  10.206 -10.967
  294    HE1  TYR  39           HE1      TYR  39  14.507  12.633 -10.047
  295    HE2  TYR  39           HE2      TYR  39  12.038   9.151  -9.569
  296    HH   TYR  39           HH       TYR  39  14.740   9.509  -9.439
  297    H    GLU  40           H        GLU  40  10.131   9.951 -13.778
  298    HA   GLU  40           HA       GLU  40   7.782  10.374 -15.568
  299   1HB   GLU  40          2HB       GLU  40   9.923   8.681 -15.877
  300   2HB   GLU  40          1HB       GLU  40   8.727   7.616 -15.135
  301   1HG   GLU  40          2HG       GLU  40   7.074   8.289 -16.851
  302   2HG   GLU  40          1HG       GLU  40   8.292   9.320 -17.607
  303    H    ILE  41           H        ILE  41   5.813  10.157 -14.634
  304    HA   ILE  41           HA       ILE  41   5.640   8.780 -12.001
  305    HB   ILE  41           HB       ILE  41   3.338  10.250 -13.240
  306   1HG1  ILE  41          2HG1      ILE  41   5.387  11.672 -13.573
  307   2HG1  ILE  41          1HG1      ILE  41   4.208  12.388 -12.476
  308   1HG2  ILE  41          1HG2      ILE  41   4.434   9.791 -10.460
  309   2HG2  ILE  41          2HG2      ILE  41   2.899   9.235 -11.125
  310   3HG2  ILE  41          3HG2      ILE  41   3.143  10.948 -10.787
  311   1HD1  ILE  41          1HD1      ILE  41   6.543  10.721 -11.514
  312   2HD1  ILE  41          2HD1      ILE  41   5.476  11.738 -10.547
  313   3HD1  ILE  41          3HD1      ILE  41   6.617  12.475 -11.672
  314    H    GLU  42           H        GLU  42   4.267   7.002 -11.702
  315    HA   GLU  42           HA       GLU  42   2.829   6.007 -14.123
  316   1HB   GLU  42          2HB       GLU  42   5.045   4.834 -13.777
  317   2HB   GLU  42          1HB       GLU  42   4.416   4.244 -12.237
  318   1HG   GLU  42          2HG       GLU  42   2.368   3.496 -13.765
  319   2HG   GLU  42          1HG       GLU  42   3.605   3.513 -15.022
  320    H    HIS  43           H        HIS  43   0.828   5.102 -13.682
  321    HA   HIS  43           HA       HIS  43   0.107   4.723 -10.808
  322   1HB   HIS  43          2HB       HIS  43  -1.508   6.152 -12.941
  323   2HB   HIS  43          1HB       HIS  43  -2.148   5.688 -11.364
  324    HD2  HIS  43           HD2      HIS  43   0.541   8.200 -12.827
  325    HE1  HIS  43           HE1      HIS  43  -0.254   9.258  -8.816
  326    HE2  HIS  43           HE2      HIS  43   0.975   9.935 -10.928
  327    H    HIS  44           H        HIS  44  -1.748   3.232 -10.532
  328    HA   HIS  44           HA       HIS  44  -2.234   1.498 -12.911
  329   1HB   HIS  44          2HB       HIS  44  -0.797   0.807 -10.485
  330   2HB   HIS  44          1HB       HIS  44  -2.226  -0.210 -10.674
  331    HD2  HIS  44           HD2      HIS  44  -2.297  -0.996 -13.729
  332    HE1  HIS  44           HE1      HIS  44   1.865  -1.685 -13.530
  333    HE2  HIS  44           HE2      HIS  44  -0.240  -2.113 -14.880
  334    H    LEU  45           H        LEU  45  -4.392   1.327 -13.228
  335    HA   LEU  45           HA       LEU  45  -6.173   1.403 -10.824
  336   1HB   LEU  45          2HB       LEU  45  -6.696   2.674 -13.530
  337   2HB   LEU  45          1HB       LEU  45  -7.828   2.643 -12.178
  338    HG   LEU  45           HG       LEU  45  -5.772   3.707 -10.875
  339   1HD1  LEU  45          1HD1      LEU  45  -4.117   3.686 -12.580
  340   2HD1  LEU  45          2HD1      LEU  45  -4.673   5.359 -12.512
  341   3HD1  LEU  45          3HD1      LEU  45  -5.244   4.291 -13.793
  342   1HD2  LEU  45          1HD2      LEU  45  -6.668   5.974 -11.562
  343   2HD2  LEU  45          2HD2      LEU  45  -7.906   4.819 -11.070
  344   3HD2  LEU  45          3HD2      LEU  45  -7.638   5.146 -12.782
  345    H    PHE  46           H        PHE  46  -8.084   0.084 -11.008
  346    HA   PHE  46           HA       PHE  46  -8.120  -1.746 -13.365
  347   1HB   PHE  46          2HB       PHE  46  -9.009  -3.194 -11.084
  348   2HB   PHE  46          1HB       PHE  46  -7.572  -3.493 -12.062
  349    HD1  PHE  46           HD1      PHE  46  -5.546  -1.829 -11.590
  350    HD2  PHE  46           HD2      PHE  46  -8.721  -2.686  -8.828
  351    HE1  PHE  46           HE1      PHE  46  -4.109  -1.090  -9.711
  352    HE2  PHE  46           HE2      PHE  46  -7.284  -1.946  -6.947
  353    HZ   PHE  46           HZ       PHE  46  -4.978  -1.147  -7.388
  354    H    ALA  47           H        ALA  47 -10.232  -2.826 -13.656
  355    HA   ALA  47           HA       ALA  47 -12.510  -1.574 -12.237
  356   1HB   ALA  47          1HB       ALA  47 -12.617  -1.602 -15.234
  357   2HB   ALA  47          2HB       ALA  47 -11.764  -0.285 -14.427
  358   3HB   ALA  47          3HB       ALA  47 -13.475  -0.562 -14.096
  359    H    GLU  48           H        GLU  48 -14.590  -2.691 -12.854
  360    HA   GLU  48           HA       GLU  48 -14.024  -5.536 -13.582
  361   1HB   GLU  48          2HB       GLU  48 -16.498  -4.623 -12.126
  362   2HB   GLU  48          1HB       GLU  48 -15.731  -6.211 -12.117
  363   1HG   GLU  48          2HG       GLU  48 -14.444  -3.725 -10.959
  364   2HG   GLU  48          1HG       GLU  48 -15.368  -4.883 -10.003
  365    H    ASP  49           H        ASP  49 -15.291  -2.745 -14.843
  366    HA   ASP  49           HA       ASP  49 -17.268  -4.268 -16.497
  367   1HB   ASP  49          2HB       ASP  49 -17.233  -1.286 -15.948
  368   2HB   ASP  49          1HB       ASP  49 -18.486  -2.187 -16.802
  369    H    PHE  50           H        PHE  50 -16.679  -4.494 -18.600
  370    HA   PHE  50           HA       PHE  50 -14.267  -3.360 -19.655
  371   1HB   PHE  50          2HB       PHE  50 -16.646  -4.705 -20.949
  372   2HB   PHE  50          1HB       PHE  50 -15.267  -4.133 -21.889
  373    HD1  PHE  50           HD1      PHE  50 -16.462  -6.618 -19.477
  374    HD2  PHE  50           HD2      PHE  50 -13.024  -5.120 -21.571
  375    HE1  PHE  50           HE1      PHE  50 -15.211  -8.676 -18.893
  376    HE2  PHE  50           HE2      PHE  50 -11.772  -7.180 -20.985
  377    HZ   PHE  50           HZ       PHE  50 -12.865  -8.958 -19.647
  378    H    ASP  51           H        ASP  51 -17.585  -2.263 -19.591
  379    HA   ASP  51           HA       ASP  51 -17.279  -0.260 -21.671
  380   1HB   ASP  51          2HB       ASP  51 -19.297  -0.361 -19.406
  381   2HB   ASP  51          1HB       ASP  51 -19.438   0.575 -20.896
  382    H    LYS  52           H        LYS  52 -17.506  -0.018 -18.099
  383    HA   LYS  52           HA       LYS  52 -16.819   2.755 -17.993
  384   1HB   LYS  52          2HB       LYS  52 -17.778   1.157 -16.146
  385   2HB   LYS  52          1HB       LYS  52 -16.079   0.844 -15.793
  386   1HG   LYS  52          2HG       LYS  52 -16.171   2.709 -14.512
  387   2HG   LYS  52          1HG       LYS  52 -16.152   3.597 -16.036
  388   1HD   LYS  52          2HD       LYS  52 -18.680   2.612 -14.689
  389   2HD   LYS  52          1HD       LYS  52 -18.047   4.249 -14.519
  390   1HE   LYS  52          2HE       LYS  52 -18.091   4.400 -17.061
  391   2HE   LYS  52          1HE       LYS  52 -19.013   2.896 -17.047
  392   1HZ   LYS  52          1HZ       LYS  52 -20.790   4.181 -16.780
  393   2HZ   LYS  52          2HZ       LYS  52 -19.859   5.557 -16.423
  394   3HZ   LYS  52          3HZ       LYS  52 -20.258   4.454 -15.194
  395    H    LEU  53           H        LEU  53 -14.876  -0.168 -18.157
  396    HA   LEU  53           HA       LEU  53 -12.367   0.995 -17.406
  397   1HB   LEU  53          2HB       LEU  53 -13.023  -1.502 -17.733
  398   2HB   LEU  53          1HB       LEU  53 -12.634  -1.224 -19.429
  399    HG   LEU  53           HG       LEU  53 -10.713  -0.456 -17.232
  400   1HD1  LEU  53          1HD1      LEU  53 -11.271  -2.867 -17.001
  401   2HD1  LEU  53          2HD1      LEU  53  -9.609  -2.623 -17.539
  402   3HD1  LEU  53          3HD1      LEU  53 -10.847  -3.109 -18.696
  403   1HD2  LEU  53          1HD2      LEU  53 -10.646  -0.805 -20.214
  404   2HD2  LEU  53          2HD2      LEU  53  -9.170  -1.088 -19.292
  405   3HD2  LEU  53          3HD2      LEU  53  -9.963   0.486 -19.226
  406    H    GLU  54           H        GLU  54 -13.973   0.609 -20.564
  407    HA   GLU  54           HA       GLU  54 -11.786   1.826 -22.036
  408   1HB   GLU  54          2HB       GLU  54 -13.429   0.257 -23.067
  409   2HB   GLU  54          1HB       GLU  54 -14.684   1.479 -22.857
  410   1HG   GLU  54          2HG       GLU  54 -12.242   2.467 -24.181
  411   2HG   GLU  54          1HG       GLU  54 -13.121   1.241 -25.096
  412    H    LYS  55           H        LYS  55 -14.494   3.043 -20.239
  413    HA   LYS  55           HA       LYS  55 -14.512   5.643 -21.595
  414   1HB   LYS  55          2HB       LYS  55 -15.946   4.449 -19.238
  415   2HB   LYS  55          1HB       LYS  55 -15.951   6.199 -19.467
  416   1HG   LYS  55          2HG       LYS  55 -16.778   5.835 -21.806
  417   2HG   LYS  55          1HG       LYS  55 -16.909   4.113 -21.448
  418   1HD   LYS  55          2HD       LYS  55 -18.514   4.554 -19.672
  419   2HD   LYS  55          1HD       LYS  55 -18.315   6.295 -19.881
  420   1HE   LYS  55          2HE       LYS  55 -18.984   4.914 -22.379
  421   2HE   LYS  55          1HE       LYS  55 -20.230   4.743 -21.142
  422   1HZ   LYS  55          1HZ       LYS  55 -19.211   7.176 -22.432
  423   2HZ   LYS  55          2HZ       LYS  55 -19.805   7.279 -20.845
  424   3HZ   LYS  55          3HZ       LYS  55 -20.811   6.724 -22.096
  425    H    ALA  56           H        ALA  56 -13.773   4.639 -18.231
  426    HA   ALA  56           HA       ALA  56 -12.572   7.079 -17.447
  427   1HB   ALA  56          1HB       ALA  56 -12.958   4.516 -16.317
  428   2HB   ALA  56          2HB       ALA  56 -12.385   5.969 -15.497
  429   3HB   ALA  56          3HB       ALA  56 -11.229   4.842 -16.208
  430    H    ALA  57           H        ALA  57 -11.210   4.304 -19.166
  431    HA   ALA  57           HA       ALA  57  -8.469   5.229 -18.991
  432   1HB   ALA  57          1HB       ALA  57  -8.672   2.927 -19.433
  433   2HB   ALA  57          2HB       ALA  57  -8.229   3.595 -21.003
  434   3HB   ALA  57          3HB       ALA  57  -9.909   3.178 -20.665
  435    H    VAL  58           H        VAL  58 -10.939   5.346 -21.575
  436    HA   VAL  58           HA       VAL  58  -9.405   6.661 -23.537
  437    HB   VAL  58           HB       VAL  58 -12.343   6.683 -22.874
  438   1HG1  VAL  58          1HG1      VAL  58 -10.839   8.448 -24.774
  439   2HG1  VAL  58          2HG1      VAL  58 -12.265   8.812 -23.801
  440   3HG1  VAL  58          3HG1      VAL  58 -12.419   7.833 -25.261
  441   1HG2  VAL  58          1HG2      VAL  58 -11.117   5.880 -25.486
  442   2HG2  VAL  58          2HG2      VAL  58 -12.515   5.204 -24.652
  443   3HG2  VAL  58          3HG2      VAL  58 -10.887   4.819 -24.096
  444    H    GLU  59           H        GLU  59 -11.326   8.094 -20.887
  445    HA   GLU  59           HA       GLU  59 -10.719  10.816 -21.603
  446   1HB   GLU  59          2HB       GLU  59 -12.597  10.028 -20.078
  447   2HB   GLU  59          1HB       GLU  59 -11.371   9.802 -18.827
  448   1HG   GLU  59          2HG       GLU  59 -10.778  12.141 -18.885
  449   2HG   GLU  59          1HG       GLU  59 -11.793  12.414 -20.301
  450    H    ALA  60           H        ALA  60  -9.192   8.487 -19.395
  451    HA   ALA  60           HA       ALA  60  -7.364  10.160 -18.091
  452   1HB   ALA  60          1HB       ALA  60  -6.592   8.192 -17.312
  453   2HB   ALA  60          2HB       ALA  60  -6.046   7.717 -18.920
  454   3HB   ALA  60          3HB       ALA  60  -7.704   7.383 -18.416
  455    H    PHE  61           H        PHE  61  -6.970   8.582 -21.275
  456    HA   PHE  61           HA       PHE  61  -4.377   9.729 -21.778
  457   1HB   PHE  61          2HB       PHE  61  -4.897   7.845 -23.097
  458   2HB   PHE  61          1HB       PHE  61  -6.490   8.472 -23.522
  459    HD1  PHE  61           HD1      PHE  61  -6.774  10.118 -25.282
  460    HD2  PHE  61           HD2      PHE  61  -2.860   8.760 -24.146
  461    HE1  PHE  61           HE1      PHE  61  -5.820  11.164 -27.318
  462    HE2  PHE  61           HE2      PHE  61  -1.906   9.805 -26.182
  463    HZ   PHE  61           HZ       PHE  61  -3.386  11.008 -27.768
  464    H    LYS  62           H        LYS  62  -7.549  10.552 -23.245
  465    HA   LYS  62           HA       LYS  62  -6.949  12.783 -24.692
  466   1HB   LYS  62          2HB       LYS  62  -9.275  11.860 -24.113
  467   2HB   LYS  62          1HB       LYS  62  -9.206  12.894 -22.685
  468   1HG   LYS  62          2HG       LYS  62  -8.402  14.573 -24.755
  469   2HG   LYS  62          1HG       LYS  62  -9.703  13.619 -25.470
  470   1HD   LYS  62          2HD       LYS  62 -11.071  14.144 -23.391
  471   2HD   LYS  62          1HD       LYS  62  -9.818  15.308 -22.961
  472   1HE   LYS  62          2HE       LYS  62 -11.584  15.322 -25.417
  473   2HE   LYS  62          1HE       LYS  62 -11.496  16.541 -24.146
  474   1HZ   LYS  62          1HZ       LYS  62 -10.250  16.944 -26.340
  475   2HZ   LYS  62          2HZ       LYS  62  -9.103  15.854 -25.722
  476   3HZ   LYS  62          3HZ       LYS  62  -9.457  17.288 -24.882
  477    H    MET  63           H        MET  63  -6.953  12.596 -21.162
  478    HA   MET  63           HA       MET  63  -6.574  15.428 -20.732
  479   1HB   MET  63          2HB       MET  63  -6.517  12.964 -19.107
  480   2HB   MET  63          1HB       MET  63  -5.444  14.241 -18.532
  481   1HG   MET  63          2HG       MET  63  -7.422  15.831 -18.744
  482   2HG   MET  63          1HG       MET  63  -8.431  14.405 -18.989
  483   1HE   MET  63          1HE       MET  63  -6.880  12.240 -17.056
  484   2HE   MET  63          2HE       MET  63  -8.561  12.468 -17.534
  485   3HE   MET  63          3HE       MET  63  -8.143  12.373 -15.825
  486    H    GLY  64           H        GLY  64  -4.273  12.685 -20.534
  487   1HA   GLY  64          2HA       GLY  64  -2.187  13.678 -22.032
  488   2HA   GLY  64          1HA       GLY  64  -1.988  14.499 -20.483
  489    H    PHE  65           H        PHE  65  -3.205  12.081 -19.112
  490    HA   PHE  65           HA       PHE  65  -0.783  10.767 -18.397
  491   1HB   PHE  65          2HB       PHE  65  -3.684   9.946 -18.115
  492   2HB   PHE  65          1HB       PHE  65  -2.356   8.994 -17.452
  493    HD1  PHE  65           HD1      PHE  65  -1.080   9.763 -15.543
  494    HD2  PHE  65           HD2      PHE  65  -4.157  12.218 -17.264
  495    HE1  PHE  65           HE1      PHE  65  -1.003  11.251 -13.559
  496    HE2  PHE  65           HE2      PHE  65  -4.079  13.706 -15.280
  497    HZ   PHE  65           HZ       PHE  65  -2.502  13.221 -13.429
  498    H    GLU  66           H        GLU  66   0.389   9.333 -19.577
  499    HA   GLU  66           HA       GLU  66  -0.597   8.262 -22.075
  500   1HB   GLU  66          2HB       GLU  66   1.916   8.325 -20.611
  501   2HB   GLU  66          1HB       GLU  66   1.630   6.737 -21.323
  502   1HG   GLU  66          2HG       GLU  66   2.752   8.006 -23.007
  503   2HG   GLU  66          1HG       GLU  66   1.057   7.965 -23.490
  504    H    VAL  67           H        VAL  67  -2.515   7.111 -21.422
  505    HA   VAL  67           HA       VAL  67  -2.600   5.080 -19.437
  506    HB   VAL  67           HB       VAL  67  -4.494   6.200 -20.905
  507   1HG1  VAL  67          1HG1      VAL  67  -5.250   4.829 -22.735
  508   2HG1  VAL  67          2HG1      VAL  67  -4.044   3.593 -22.380
  509   3HG1  VAL  67          3HG1      VAL  67  -3.540   5.162 -23.008
  510   1HG2  VAL  67          1HG2      VAL  67  -4.418   3.382 -19.813
  511   2HG2  VAL  67          2HG2      VAL  67  -5.903   4.087 -20.451
  512   3HG2  VAL  67          3HG2      VAL  67  -5.100   4.826 -19.064
  513    H    LEU  68           H        LEU  68  -2.268   2.831 -19.559
  514    HA   LEU  68           HA       LEU  68  -0.907   1.867 -22.043
  515   1HB   LEU  68          2HB       LEU  68   0.223   2.133 -19.488
  516   2HB   LEU  68          1HB       LEU  68  -0.132   0.413 -19.647
  517    HG   LEU  68           HG       LEU  68   1.269   1.970 -21.828
  518   1HD1  LEU  68          1HD1      LEU  68   3.319   0.685 -20.806
  519   2HD1  LEU  68          2HD1      LEU  68   2.357   0.704 -19.327
  520   3HD1  LEU  68          3HD1      LEU  68   2.821   2.221 -20.097
  521   1HD2  LEU  68          1HD2      LEU  68   0.116  -0.409 -22.029
  522   2HD2  LEU  68          2HD2      LEU  68   1.588  -0.952 -21.225
  523   3HD2  LEU  68          3HD2      LEU  68   1.687  -0.115 -22.775
  524    H    GLU  69           H        GLU  69  -1.679  -0.058 -22.843
  525    HA   GLU  69           HA       GLU  69  -4.169  -1.079 -22.287
  526   1HB   GLU  69          2HB       GLU  69  -1.827  -2.885 -22.938
  527   2HB   GLU  69          1HB       GLU  69  -3.519  -3.120 -23.378
  528   1HG   GLU  69          2HG       GLU  69  -2.496  -0.541 -24.291
  529   2HG   GLU  69          1HG       GLU  69  -1.582  -1.894 -24.957
  530    H    ALA  70           H        ALA  70  -4.969  -2.859 -21.006
  531    HA   ALA  70           HA       ALA  70  -3.403  -3.236 -18.495
  532   1HB   ALA  70          1HB       ALA  70  -5.632  -3.961 -17.553
  533   2HB   ALA  70          2HB       ALA  70  -6.361  -3.504 -19.093
  534   3HB   ALA  70          3HB       ALA  70  -5.585  -2.282 -18.087
  535    H    GLU  71           H        GLU  71  -3.458  -5.408 -17.525
  536    HA   GLU  71           HA       GLU  71  -3.773  -7.550 -19.592
  537   1HB   GLU  71          2HB       GLU  71  -1.788  -7.444 -17.296
  538   2HB   GLU  71          1HB       GLU  71  -1.927  -8.739 -18.486
  539   1HG   GLU  71          2HG       GLU  71  -1.342  -5.850 -19.194
  540   2HG   GLU  71          1HG       GLU  71  -0.100  -7.088 -19.004
  541    H    GLU  72           H        GLU  72  -3.837  -9.798 -18.254
  542    HA   GLU  72           HA       GLU  72  -6.164  -9.495 -16.455
  543   1HB   GLU  72          2HB       GLU  72  -4.853 -12.011 -17.528
  544   2HB   GLU  72          1HB       GLU  72  -6.410 -11.914 -16.704
  545   1HG   GLU  72          2HG       GLU  72  -7.379 -10.645 -18.494
  546   2HG   GLU  72          1HG       GLU  72  -5.805 -10.397 -19.252
  547    H    THR  73           H        THR  73  -5.797  -9.330 -14.306
  548    HA   THR  73           HA       THR  73  -3.819 -11.115 -13.036
  549    HB   THR  73           HB       THR  73  -2.452  -9.162 -13.502
  550    HG1  THR  73           HG1      THR  73  -3.207  -8.710 -10.851
  551   1HG2  THR  73          1HG2      THR  73  -3.136  -6.926 -12.659
  552   2HG2  THR  73          2HG2      THR  73  -4.693  -7.605 -12.181
  553   3HG2  THR  73          3HG2      THR  73  -4.242  -7.542 -13.886
  554    H    GLU  74           H        GLU  74  -3.898  -9.892 -10.485
  555    HA   GLU  74           HA       GLU  74  -6.721  -9.447  -9.795
  556   1HB   GLU  74          2HB       GLU  74  -6.981 -11.368  -8.390
  557   2HB   GLU  74          1HB       GLU  74  -6.377 -11.971  -9.933
  558   1HG   GLU  74          2HG       GLU  74  -4.050 -11.877  -8.981
  559   2HG   GLU  74          1HG       GLU  74  -4.760 -11.471  -7.419
  560    H    ASP  75           H        ASP  75  -6.677  -9.676  -7.111
  561    HA   ASP  75           HA       ASP  75  -4.192  -8.378  -6.129
  562   1HB   ASP  75          2HB       ASP  75  -5.794  -6.745  -4.875
  563   2HB   ASP  75          1HB       ASP  75  -5.423  -6.423  -6.569
  564    H    GLU  76           H        GLU  76  -7.300  -8.402  -4.475
  565    HA   GLU  76           HA       GLU  76  -6.582 -10.814  -2.937
  566   1HB   GLU  76          2HB       GLU  76  -6.135  -8.095  -1.958
  567   2HB   GLU  76          1HB       GLU  76  -7.199  -9.023  -0.899
  568   1HG   GLU  76          2HG       GLU  76  -5.494 -10.901  -1.013
  569   2HG   GLU  76          1HG       GLU  76  -4.408  -9.763  -1.812
  570    H    ASP  77           H        ASP  77  -8.807  -9.581  -4.683
  571    HA   ASP  77           HA       ASP  77 -11.009 -10.794  -3.277
  572   1HB   ASP  77          2HB       ASP  77 -10.465  -8.121  -2.538
  573   2HB   ASP  77          1HB       ASP  77 -11.874  -8.054  -3.597
  574    H    GLY  78           H        GLY  78  -9.508  -9.785  -5.998
  575   1HA   GLY  78          2HA       GLY  78 -12.027  -9.502  -7.572
  576   2HA   GLY  78          1HA       GLY  78 -10.423  -9.036  -8.141
  577    H    ASN  79           H        ASN  79  -8.893 -11.228  -7.655
  578    HA   ASN  79           HA       ASN  79  -8.368 -13.356  -8.489
  579   1HB   ASN  79          2HB       ASN  79 -10.436 -13.899  -7.055
  580   2HB   ASN  79          1HB       ASN  79 -11.337 -13.902  -8.571
  581   1HD2  ASN  79          1HD2      ASN  79 -10.617 -15.496 -10.256
  582   2HD2  ASN  79          2HD2      ASN  79  -9.821 -16.914  -9.771
  583    H    LYS  80           H        LYS  80 -10.165 -11.082 -10.152
  584    HA   LYS  80           HA       LYS  80  -9.257 -11.956 -12.720
  585   1HB   LYS  80          2HB       LYS  80 -11.151 -13.634 -12.154
  586   2HB   LYS  80          1HB       LYS  80 -12.242 -12.275 -12.428
  587   1HG   LYS  80          2HG       LYS  80 -10.730 -12.033 -14.635
  588   2HG   LYS  80          1HG       LYS  80 -10.550 -13.767 -14.374
  589   1HD   LYS  80          2HD       LYS  80 -12.976 -14.054 -14.347
  590   2HD   LYS  80          1HD       LYS  80 -13.207 -12.312 -14.497
  591   1HE   LYS  80          2HE       LYS  80 -12.944 -12.397 -16.733
  592   2HE   LYS  80          1HE       LYS  80 -11.438 -13.301 -16.575
  593   1HZ   LYS  80          1HZ       LYS  80 -12.665 -15.329 -16.364
  594   2HZ   LYS  80          2HZ       LYS  80 -13.196 -14.526 -17.763
  595   3HZ   LYS  80          3HZ       LYS  80 -14.145 -14.500 -16.354
  596    H    LEU  81           H        LEU  81  -8.747  -9.789 -13.074
  597    HA   LEU  81           HA       LEU  81 -10.989  -8.044 -13.803
  598   1HB   LEU  81          2HB       LEU  81 -10.059  -6.171 -12.326
  599   2HB   LEU  81          1HB       LEU  81 -10.936  -7.454 -11.488
  600    HG   LEU  81           HG       LEU  81  -8.706  -8.586 -11.093
  601   1HD1  LEU  81          1HD1      LEU  81  -6.851  -6.640 -11.175
  602   2HD1  LEU  81          2HD1      LEU  81  -7.850  -6.122 -12.533
  603   3HD1  LEU  81          3HD1      LEU  81  -7.129  -7.731 -12.532
  604   1HD2  LEU  81          1HD2      LEU  81  -9.884  -7.176  -9.387
  605   2HD2  LEU  81          2HD2      LEU  81  -8.965  -5.783  -9.959
  606   3HD2  LEU  81          3HD2      LEU  81  -8.130  -7.145  -9.212
  607    H    LEU  82           H        LEU  82 -10.017  -5.849 -14.597
  608    HA   LEU  82           HA       LEU  82  -7.445  -6.467 -15.996
  609   1HB   LEU  82          2HB       LEU  82  -9.766  -4.696 -16.813
  610   2HB   LEU  82          1HB       LEU  82  -8.238  -4.789 -17.691
  611    HG   LEU  82           HG       LEU  82  -8.892  -7.445 -17.404
  612   1HD1  LEU  82          1HD1      LEU  82 -11.119  -6.760 -16.490
  613   2HD1  LEU  82          2HD1      LEU  82 -11.247  -7.679 -17.990
  614   3HD1  LEU  82          3HD1      LEU  82 -11.449  -5.928 -18.009
  615   1HD2  LEU  82          1HD2      LEU  82  -8.109  -6.178 -19.440
  616   2HD2  LEU  82          2HD2      LEU  82  -9.775  -5.656 -19.688
  617   3HD2  LEU  82          3HD2      LEU  82  -9.364  -7.369 -19.780
  618    H    CYS  83           H        CYS  83  -5.789  -4.936 -15.900
  619    HA   CYS  83           HA       CYS  83  -6.346  -2.437 -14.374
  620   1HB   CYS  83          2HB       CYS  83  -4.228  -2.747 -13.136
  621   2HB   CYS  83          1HB       CYS  83  -5.358  -4.064 -12.816
  622    HG   CYS  83           HG       CYS  83  -3.521  -5.545 -13.571
  623    H    PHE  84           H        PHE  84  -5.820  -0.785 -15.705
  624    HA   PHE  84           HA       PHE  84  -3.696  -1.201 -17.739
  625   1HB   PHE  84          2HB       PHE  84  -4.571   1.213 -18.384
  626   2HB   PHE  84          1HB       PHE  84  -5.495  -0.218 -18.836
  627    HD1  PHE  84           HD1      PHE  84  -7.187  -1.078 -16.966
  628    HD2  PHE  84           HD2      PHE  84  -5.671   2.930 -17.260
  629    HE1  PHE  84           HE1      PHE  84  -9.114  -0.251 -15.641
  630    HE2  PHE  84           HE2      PHE  84  -7.597   3.756 -15.936
  631    HZ   PHE  84           HZ       PHE  84  -9.320   2.165 -15.126
  632    H    ASP  85           H        ASP  85  -2.061   0.539 -17.999
  633    HA   ASP  85           HA       ASP  85  -1.413   1.766 -15.346
  634   1HB   ASP  85          2HB       ASP  85   0.598   1.214 -17.528
  635   2HB   ASP  85          1HB       ASP  85   0.888   1.467 -15.807
  636    H    ALA  86           H        ALA  86  -0.706   3.932 -15.319
  637    HA   ALA  86           HA       ALA  86  -1.081   5.416 -17.891
  638   1HB   ALA  86          1HB       ALA  86  -2.573   6.759 -16.864
  639   2HB   ALA  86          2HB       ALA  86  -1.433   7.090 -15.560
  640   3HB   ALA  86          3HB       ALA  86  -2.502   5.692 -15.462
  641    H    THR  87           H        THR  87   0.513   6.915 -18.414
  642    HA   THR  87           HA       THR  87   2.719   7.252 -16.420
  643    HB   THR  87           HB       THR  87   3.979   7.493 -18.850
  644    HG1  THR  87           HG1      THR  87   3.242   5.597 -19.979
  645   1HG2  THR  87          1HG2      THR  87   3.588   5.097 -17.047
  646   2HG2  THR  87          2HG2      THR  87   4.917   6.257 -17.027
  647   3HG2  THR  87          3HG2      THR  87   4.757   5.122 -18.368
  648    H    MET  88           H        MET  88   3.726   9.307 -16.423
  649    HA   MET  88           HA       MET  88   2.965  11.344 -18.375
  650   1HB   MET  88          2HB       MET  88   0.990  11.266 -16.821
  651   2HB   MET  88          1HB       MET  88   2.074  11.700 -15.498
  652   1HG   MET  88          2HG       MET  88   1.592  13.845 -16.054
  653   2HG   MET  88          1HG       MET  88   2.702  13.589 -17.400
  654   1HE   MET  88          1HE       MET  88  -0.761  13.817 -16.051
  655   2HE   MET  88          2HE       MET  88  -1.685  14.405 -17.432
  656   3HE   MET  88          3HE       MET  88  -0.329  15.349 -16.821
  657    H    GLN  89           H        GLN  89   4.728  12.644 -18.572
  658    HA   GLN  89           HA       GLN  89   6.912  12.414 -16.645
  659   1HB   GLN  89          2HB       GLN  89   6.493  13.771 -19.280
  660   2HB   GLN  89          1HB       GLN  89   7.803  14.341 -18.245
  661   1HG   GLN  89          2HG       GLN  89   8.772  12.651 -19.619
  662   2HG   GLN  89          1HG       GLN  89   8.517  11.890 -18.049
  663   1HE2  GLN  89          1HE2      GLN  89   8.663  10.345 -20.475
  664   2HE2  GLN  89          2HE2      GLN  89   7.136   9.657 -20.754
  665    H    SER  90           H        SER  90   7.120  13.681 -14.872
  666    HA   SER  90           HA       SER  90   6.069  16.463 -14.963
  667   1HB   SER  90          2HB       SER  90   4.721  16.237 -13.089
  668   2HB   SER  90          1HB       SER  90   4.518  14.640 -13.804
  669    HG   SER  90           HG       SER  90   5.740  15.395 -11.475
  670    H    ALA  91           H        ALA  91   6.722  17.333 -12.483
  671    HA   ALA  91           HA       ALA  91   9.669  16.907 -12.428
  672   1HB   ALA  91          1HB       ALA  91   9.057  18.986 -10.673
  673   2HB   ALA  91          2HB       ALA  91   7.903  19.190 -11.991
  674   3HB   ALA  91          3HB       ALA  91   9.634  19.164 -12.330
  675    H    LEU  92           H        LEU  92  10.671  16.070 -10.611
  676    HA   LEU  92           HA       LEU  92   9.195  14.510  -8.759
  677   1HB   LEU  92          2HB       LEU  92  11.690  14.355  -9.297
  678   2HB   LEU  92          1HB       LEU  92  11.915  15.710  -8.190
  679    HG   LEU  92           HG       LEU  92  10.351  14.080  -6.669
  680   1HD1  LEU  92          1HD1      LEU  92  10.884  11.807  -6.976
  681   2HD1  LEU  92          2HD1      LEU  92  12.260  12.176  -8.015
  682   3HD1  LEU  92          3HD1      LEU  92  10.617  12.384  -8.621
  683   1HD2  LEU  92          1HD2      LEU  92  12.494  13.402  -5.568
  684   2HD2  LEU  92          2HD2      LEU  92  12.433  15.127  -5.934
  685   3HD2  LEU  92          3HD2      LEU  92  13.372  14.040  -6.958
  686    H    ASP  93           H        ASP  93   7.627  15.515  -7.537
  687    HA   ASP  93           HA       ASP  93   8.487  17.287  -5.394
  688   1HB   ASP  93          2HB       ASP  93   7.071  18.364  -7.802
  689   2HB   ASP  93          1HB       ASP  93   6.633  19.008  -6.220
  690    H    ALA  94           H        ALA  94   7.018  17.182  -3.696
  691    HA   ALA  94           HA       ALA  94   4.990  15.149  -3.781
  692   1HB   ALA  94          1HB       ALA  94   5.870  17.217  -1.807
  693   2HB   ALA  94          2HB       ALA  94   5.748  15.469  -1.617
  694   3HB   ALA  94          3HB       ALA  94   4.293  16.463  -1.568
  695    H    LYS  95           H        LYS  95   4.432  18.591  -2.988
  696    HA   LYS  95           HA       LYS  95   1.745  18.808  -3.348
  697   1HB   LYS  95          2HB       LYS  95   3.817  20.697  -4.505
  698   2HB   LYS  95          1HB       LYS  95   2.111  21.094  -4.284
  699   1HG   LYS  95          2HG       LYS  95   2.307  20.731  -1.871
  700   2HG   LYS  95          1HG       LYS  95   3.994  20.247  -2.061
  701   1HD   LYS  95          2HD       LYS  95   4.299  22.474  -1.525
  702   2HD   LYS  95          1HD       LYS  95   4.157  22.615  -3.277
  703   1HE   LYS  95          2HE       LYS  95   2.667  24.253  -2.420
  704   2HE   LYS  95          1HE       LYS  95   1.632  22.901  -2.880
  705   1HZ   LYS  95          1HZ       LYS  95   1.704  24.081  -0.436
  706   2HZ   LYS  95          2HZ       LYS  95   2.640  22.681  -0.206
  707   3HZ   LYS  95          3HZ       LYS  95   1.044  22.556  -0.776
  708    H    LEU  96           H        LEU  96   4.092  18.749  -6.042
  709    HA   LEU  96           HA       LEU  96   2.202  18.990  -8.151
  710   1HB   LEU  96          2HB       LEU  96   4.867  18.892  -8.124
  711   2HB   LEU  96          1HB       LEU  96   4.570  17.194  -8.499
  712    HG   LEU  96           HG       LEU  96   4.787  18.488 -10.572
  713   1HD1  LEU  96          1HD1      LEU  96   2.756  17.751 -11.642
  714   2HD1  LEU  96          2HD1      LEU  96   1.876  17.786 -10.114
  715   3HD1  LEU  96          3HD1      LEU  96   3.137  16.582 -10.379
  716   1HD2  LEU  96          1HD2      LEU  96   2.274  19.970 -10.258
  717   2HD2  LEU  96          2HD2      LEU  96   3.834  20.525 -10.867
  718   3HD2  LEU  96          3HD2      LEU  96   3.526  20.494  -9.131
  719    H    ILE  97           H        ILE  97   3.650  16.004  -6.785
  720    HA   ILE  97           HA       ILE  97   2.082  14.166  -8.259
  721    HB   ILE  97           HB       ILE  97   3.397  14.041  -5.549
  722   1HG1  ILE  97          2HG1      ILE  97   3.931  12.167  -7.811
  723   2HG1  ILE  97          1HG1      ILE  97   4.451  13.840  -8.011
  724   1HG2  ILE  97          1HG2      ILE  97   2.831  11.472  -5.899
  725   2HG2  ILE  97          2HG2      ILE  97   1.452  12.125  -6.785
  726   3HG2  ILE  97          3HG2      ILE  97   1.686  12.541  -5.087
  727   1HD1  ILE  97          1HD1      ILE  97   6.288  12.645  -7.014
  728   2HD1  ILE  97          2HD1      ILE  97   5.232  11.930  -5.795
  729   3HD1  ILE  97          3HD1      ILE  97   5.583  13.658  -5.755
  730    H    ASP  98           H        ASP  98   1.284  16.120  -5.462
  731    HA   ASP  98           HA       ASP  98  -1.068  14.701  -4.642
  732   1HB   ASP  98          2HB       ASP  98   0.105  16.513  -3.328
  733   2HB   ASP  98          1HB       ASP  98  -0.591  17.688  -4.445
  734    H    GLU  99           H        GLU  99  -0.576  17.395  -6.927
  735    HA   GLU  99           HA       GLU  99  -3.321  17.781  -7.590
  736   1HB   GLU  99          2HB       GLU  99  -0.703  18.477  -8.790
  737   2HB   GLU  99          1HB       GLU  99  -2.053  18.398  -9.922
  738   1HG   GLU  99          2HG       GLU  99  -2.461  19.835  -7.329
  739   2HG   GLU  99          1HG       GLU  99  -1.527  20.637  -8.592
  740    H    GLN 100           H        GLN 100  -0.825  15.805  -9.237
  741    HA   GLN 100           HA       GLN 100  -2.547  14.693 -11.206
  742   1HB   GLN 100          2HB       GLN 100  -0.190  13.326  -9.873
  743   2HB   GLN 100          1HB       GLN 100  -0.868  12.946 -11.458
  744   1HG   GLN 100          2HG       GLN 100   0.427  15.572 -10.664
  745   2HG   GLN 100          1HG       GLN 100   1.139  14.340 -11.707
  746   1HE2  GLN 100          1HE2      GLN 100  -0.326  13.763 -13.699
  747   2HE2  GLN 100          2HE2      GLN 100  -1.116  15.064 -14.451
  748    H    VAL 101           H        VAL 101  -1.504  13.214  -8.109
  749    HA   VAL 101           HA       VAL 101  -3.194  10.963  -8.194
  750    HB   VAL 101           HB       VAL 101  -2.377  12.589  -5.765
  751   1HG1  VAL 101          1HG1      VAL 101  -2.601  10.167  -4.765
  752   2HG1  VAL 101          2HG1      VAL 101  -3.680   9.908  -6.135
  753   3HG1  VAL 101          3HG1      VAL 101  -4.041  11.166  -4.954
  754   1HG2  VAL 101          1HG2      VAL 101  -0.413  11.321  -5.698
  755   2HG2  VAL 101          2HG2      VAL 101  -0.622  11.559  -7.433
  756   3HG2  VAL 101          3HG2      VAL 101  -1.094  10.032  -6.691
  757    H    GLU 102           H        GLU 102  -3.964  14.307  -7.618
  758    HA   GLU 102           HA       GLU 102  -6.537  13.823  -6.361
  759   1HB   GLU 102          2HB       GLU 102  -4.910  16.081  -6.966
  760   2HB   GLU 102          1HB       GLU 102  -6.472  16.344  -7.742
  761   1HG   GLU 102          2HG       GLU 102  -7.649  16.134  -5.689
  762   2HG   GLU 102          1HG       GLU 102  -6.258  15.422  -4.873
  763    H    LYS 103           H        LYS 103  -5.503  14.664  -9.676
  764    HA   LYS 103           HA       LYS 103  -8.128  14.679 -10.812
  765   1HB   LYS 103          2HB       LYS 103  -5.996  15.558 -11.883
  766   2HB   LYS 103          1HB       LYS 103  -5.581  13.882 -12.242
  767   1HG   LYS 103          2HG       LYS 103  -6.679  14.518 -14.201
  768   2HG   LYS 103          1HG       LYS 103  -7.995  13.796 -13.276
  769   1HD   LYS 103          2HD       LYS 103  -8.186  16.303 -12.345
  770   2HD   LYS 103          1HD       LYS 103  -7.482  16.661 -13.923
  771   1HE   LYS 103          2HE       LYS 103  -9.272  15.377 -15.024
  772   2HE   LYS 103          1HE       LYS 103  -9.974  14.995 -13.451
  773   1HZ   LYS 103          1HZ       LYS 103 -11.045  16.896 -14.561
  774   2HZ   LYS 103          2HZ       LYS 103  -9.576  17.747 -14.492
  775   3HZ   LYS 103          3HZ       LYS 103 -10.375  17.308 -13.058
  776    H    LEU 104           H        LEU 104  -5.698  12.088 -10.500
  777    HA   LEU 104           HA       LEU 104  -7.255  10.097 -11.873
  778   1HB   LEU 104          2HB       LEU 104  -5.049   9.847  -9.808
  779   2HB   LEU 104          1HB       LEU 104  -5.726   8.482 -10.696
  780    HG   LEU 104           HG       LEU 104  -4.431  10.914 -11.964
  781   1HD1  LEU 104          1HD1      LEU 104  -3.049   9.051 -10.658
  782   2HD1  LEU 104          2HD1      LEU 104  -2.482   9.685 -12.203
  783   3HD1  LEU 104          3HD1      LEU 104  -3.327   8.138 -12.141
  784   1HD2  LEU 104          1HD2      LEU 104  -4.491   9.098 -13.917
  785   2HD2  LEU 104          2HD2      LEU 104  -5.869  10.157 -13.614
  786   3HD2  LEU 104          3HD2      LEU 104  -5.874   8.504 -12.998
  787    H    VAL 105           H        VAL 105  -7.198  11.251  -8.552
  788    HA   VAL 105           HA       VAL 105  -8.768   9.039  -7.502
  789    HB   VAL 105           HB       VAL 105  -7.871  11.713  -6.470
  790   1HG1  VAL 105          1HG1      VAL 105 -10.059   9.959  -5.339
  791   2HG1  VAL 105          2HG1      VAL 105 -10.106  11.695  -5.647
  792   3HG1  VAL 105          3HG1      VAL 105  -9.125  11.060  -4.327
  793   1HG2  VAL 105          1HG2      VAL 105  -6.701  10.391  -4.879
  794   2HG2  VAL 105          2HG2      VAL 105  -6.536   9.507  -6.396
  795   3HG2  VAL 105          3HG2      VAL 105  -7.710   8.978  -5.191
  796    H    ASN 106           H        ASN 106  -9.516  12.446  -8.304
  797    HA   ASN 106           HA       ASN 106 -12.316  12.250  -7.759
  798   1HB   ASN 106          2HB       ASN 106 -10.497  14.163  -9.039
  799   2HB   ASN 106          1HB       ASN 106 -12.108  14.154  -9.758
  800   1HD2  ASN 106          1HD2      ASN 106 -10.670  14.050  -6.438
  801   2HD2  ASN 106          2HD2      ASN 106 -11.805  15.115  -5.762
  802    H    LEU 107           H        LEU 107 -10.522  11.975 -10.842
  803    HA   LEU 107           HA       LEU 107 -12.806  11.421 -12.464
  804   1HB   LEU 107          2HB       LEU 107 -10.592  12.046 -13.383
  805   2HB   LEU 107          1HB       LEU 107  -9.941  10.497 -12.845
  806    HG   LEU 107           HG       LEU 107 -12.195   9.747 -14.253
  807   1HD1  LEU 107          1HD1      LEU 107 -12.552  11.993 -15.118
  808   2HD1  LEU 107          2HD1      LEU 107 -11.968  10.967 -16.428
  809   3HD1  LEU 107          3HD1      LEU 107 -10.868  12.097 -15.635
  810   1HD2  LEU 107          1HD2      LEU 107  -9.261   9.915 -14.856
  811   2HD2  LEU 107          2HD2      LEU 107 -10.360   9.378 -16.125
  812   3HD2  LEU 107          3HD2      LEU 107 -10.267   8.489 -14.605
  813    H    ALA 108           H        ALA 108 -10.525   9.224 -10.816
  814    HA   ALA 108           HA       ALA 108 -11.597   6.777 -11.716
  815   1HB   ALA 108          1HB       ALA 108 -10.334   7.521  -9.067
  816   2HB   ALA 108          2HB       ALA 108  -9.548   6.775 -10.458
  817   3HB   ALA 108          3HB       ALA 108 -10.727   5.862  -9.515
  818    H    GLU 109           H        GLU 109 -12.366   8.366  -8.590
  819    HA   GLU 109           HA       GLU 109 -14.575   6.644  -8.016
  820   1HB   GLU 109          2HB       GLU 109 -13.556   9.243  -6.971
  821   2HB   GLU 109          1HB       GLU 109 -15.228   8.824  -6.595
  822   1HG   GLU 109          2HG       GLU 109 -13.176   6.690  -6.240
  823   2HG   GLU 109          1HG       GLU 109 -13.190   8.002  -5.061
  824    H    LYS 110           H        LYS 110 -14.284   9.355 -10.147
  825    HA   LYS 110           HA       LYS 110 -17.080  10.105 -10.144
  826   1HB   LYS 110          2HB       LYS 110 -15.217  11.574 -10.974
  827   2HB   LYS 110          1HB       LYS 110 -15.049  10.497 -12.361
  828   1HG   LYS 110          2HG       LYS 110 -16.587  11.844 -13.346
  829   2HG   LYS 110          1HG       LYS 110 -17.755  10.982 -12.346
  830   1HD   LYS 110          2HD       LYS 110 -17.335  12.697 -10.535
  831   2HD   LYS 110          1HD       LYS 110 -16.388  13.609 -11.711
  832   1HE   LYS 110          2HE       LYS 110 -18.236  14.255 -12.900
  833   2HE   LYS 110          1HE       LYS 110 -19.089  12.742 -12.596
  834   1HZ   LYS 110          1HZ       LYS 110 -19.210  15.205 -11.165
  835   2HZ   LYS 110          2HZ       LYS 110 -18.831  13.909 -10.134
  836   3HZ   LYS 110          3HZ       LYS 110 -20.240  13.860 -11.083
  837    H    PHE 111           H        PHE 111 -15.172   7.690 -11.838
  838    HA   PHE 111           HA       PHE 111 -17.494   7.036 -13.574
  839   1HB   PHE 111          2HB       PHE 111 -14.578   6.307 -13.581
  840   2HB   PHE 111          1HB       PHE 111 -15.734   5.282 -14.433
  841    HD1  PHE 111           HD1      PHE 111 -13.948   8.445 -14.438
  842    HD2  PHE 111           HD2      PHE 111 -17.191   6.273 -16.229
  843    HE1  PHE 111           HE1      PHE 111 -13.981  10.053 -16.327
  844    HE2  PHE 111           HE2      PHE 111 -17.224   7.880 -18.119
  845    HZ   PHE 111           HZ       PHE 111 -15.619   9.770 -18.168
  846    H    ASP 112           H        ASP 112 -15.134   4.857 -12.026
  847    HA   ASP 112           HA       ASP 112 -16.737   3.722 -10.039
  848   1HB   ASP 112          2HB       ASP 112 -17.502   2.886 -12.776
  849   2HB   ASP 112          1HB       ASP 112 -17.293   1.572 -11.618
  850    H    ILE 113           H        ILE 113 -13.958   4.151 -10.767
  851    HA   ILE 113           HA       ILE 113 -12.984   1.329 -10.557
  852    HB   ILE 113           HB       ILE 113 -10.929   2.053 -11.724
  853   1HG1  ILE 113          2HG1      ILE 113 -12.416   4.690 -11.839
  854   2HG1  ILE 113          1HG1      ILE 113 -10.822   4.381 -11.150
  855   1HG2  ILE 113          1HG2      ILE 113 -11.846   1.995 -13.889
  856   2HG2  ILE 113          2HG2      ILE 113 -13.254   2.949 -13.418
  857   3HG2  ILE 113          3HG2      ILE 113 -13.116   1.266 -12.906
  858   1HD1  ILE 113          1HD1      ILE 113 -11.616   4.347 -14.068
  859   2HD1  ILE 113          2HD1      ILE 113 -10.098   3.661 -13.491
  860   3HD1  ILE 113          3HD1      ILE 113 -10.423   5.382 -13.284
  861    H    ILE 114           H        ILE 114 -10.668   1.360  -9.531
  862    HA   ILE 114           HA       ILE 114 -10.685   3.351  -7.296
  863    HB   ILE 114           HB       ILE 114 -11.183   1.256  -6.302
  864   1HG1  ILE 114          2HG1      ILE 114  -8.157   1.443  -6.182
  865   2HG1  ILE 114          1HG1      ILE 114  -9.235   2.525  -5.300
  866   1HG2  ILE 114          1HG2      ILE 114  -9.314  -0.621  -6.937
  867   2HG2  ILE 114          2HG2      ILE 114  -9.425   0.252  -8.466
  868   3HG2  ILE 114          3HG2      ILE 114 -10.868  -0.476  -7.758
  869   1HD1  ILE 114          1HD1      ILE 114  -9.078   0.951  -3.660
  870   2HD1  ILE 114          2HD1      ILE 114  -8.579  -0.312  -4.786
  871   3HD1  ILE 114          3HD1      ILE 114 -10.287   0.102  -4.624
  872    H    TYR 115           H        TYR 115  -8.676   4.234  -6.704
  873    HA   TYR 115           HA       TYR 115  -6.457   3.687  -8.631
  874   1HB   TYR 115          2HB       TYR 115  -6.826   5.936  -8.965
  875   2HB   TYR 115          1HB       TYR 115  -7.500   6.171  -7.353
  876    HD1  TYR 115           HD1      TYR 115  -4.259   5.321  -9.045
  877    HD2  TYR 115           HD2      TYR 115  -6.204   7.225  -5.722
  878    HE1  TYR 115           HE1      TYR 115  -2.069   6.171  -8.249
  879    HE2  TYR 115           HE2      TYR 115  -4.015   8.074  -4.926
  880    HH   TYR 115           HH       TYR 115  -1.786   7.927  -5.179
  881    H    ASP 116           H        ASP 116  -5.328   2.094  -7.497
  882    HA   ASP 116           HA       ASP 116  -4.102   2.997  -4.937
  883   1HB   ASP 116          2HB       ASP 116  -5.943   0.760  -5.307
  884   2HB   ASP 116          1HB       ASP 116  -4.399   0.243  -4.628
  885    H    GLY 117           H        GLY 117  -2.256   3.390  -6.415
  886   1HA   GLY 117          2HA       GLY 117  -0.220   1.533  -6.312
  887   2HA   GLY 117          1HA       GLY 117  -1.063   1.116  -7.804
  888    H    TRP 118           H        TRP 118   0.609   3.782  -6.146
  889    HA   TRP 118           HA       TRP 118   1.107   4.985  -8.840
  890   1HB   TRP 118          2HB       TRP 118   0.878   7.094  -7.954
  891   2HB   TRP 118          1HB       TRP 118  -0.145   6.236  -6.804
  892    HD1  TRP 118           HD1      TRP 118   0.821   5.786  -4.375
  893    HE1  TRP 118           HE1      TRP 118   2.774   6.846  -3.068
  894    HE3  TRP 118           HE3      TRP 118   3.270   8.134  -8.193
  895    HZ2  TRP 118           HZ2      TRP 118   5.069   8.475  -3.574
  896    HZ3  TRP 118           HZ3      TRP 118   5.334   9.432  -7.753
  897    HH2  TRP 118           HH2      TRP 118   6.237   9.604  -5.450
  898    H    GLY 119           H        GLY 119   3.160   4.552  -9.497
  899   1HA   GLY 119          2HA       GLY 119   5.329   4.690  -7.449
  900   2HA   GLY 119          1HA       GLY 119   5.279   3.354  -8.601
  901    H    THR 120           H        THR 120   7.448   5.221  -8.395
  902    HA   THR 120           HA       THR 120   7.235   6.509 -11.084
  903    HB   THR 120           HB       THR 120   7.214   8.340  -9.561
  904    HG1  THR 120           HG1      THR 120   9.938   8.349  -9.780
  905   1HG2  THR 120          1HG2      THR 120   7.747   7.169  -7.512
  906   2HG2  THR 120          2HG2      THR 120   8.905   8.485  -7.706
  907   3HG2  THR 120          3HG2      THR 120   9.381   6.829  -8.081
  908    H    TYR 121           H        TYR 121   9.465   6.858 -12.061
  909    HA   TYR 121           HA       TYR 121  11.147   4.476 -11.452
  910   1HB   TYR 121          2HB       TYR 121  10.246   5.659 -13.875
  911   2HB   TYR 121          1HB       TYR 121  11.993   5.895 -13.811
  912    HD1  TYR 121           HD1      TYR 121  13.438   4.130 -14.364
  913    HD2  TYR 121           HD2      TYR 121   9.363   3.277 -13.310
  914    HE1  TYR 121           HE1      TYR 121  13.783   1.748 -14.959
  915    HE2  TYR 121           HE2      TYR 121   9.706   0.895 -13.905
  916    HH   TYR 121           HH       TYR 121  12.688  -0.208 -15.424
  917    H    TYR 122           H        TYR 122  13.289   4.719 -10.839
  918    HA   TYR 122           HA       TYR 122  14.105   7.411  -9.980
  919   1HB   TYR 122          2HB       TYR 122  14.711   5.833  -8.373
  920   2HB   TYR 122          1HB       TYR 122  15.148   4.623  -9.580
  921    HD1  TYR 122           HD1      TYR 122  17.421   4.128  -9.470
  922    HD2  TYR 122           HD2      TYR 122  16.139   8.203  -9.031
  923    HE1  TYR 122           HE1      TYR 122  19.787   4.859  -9.354
  924    HE2  TYR 122           HE2      TYR 122  18.505   8.936  -8.913
  925    HH   TYR 122           HH       TYR 122  21.037   6.881  -8.341
  926    H    GLU 123           H        GLU 123  14.752   8.639 -11.736
  927    HA   GLU 123           HA       GLU 123  15.869   7.920 -14.142
  928   1HB   GLU 123          2HB       GLU 123  15.805  10.299 -12.563
  929   2HB   GLU 123          1HB       GLU 123  17.444  10.115 -13.186
  930   1HG   GLU 123          2HG       GLU 123  16.218  11.331 -14.850
  931   2HG   GLU 123          1HG       GLU 123  16.409   9.690 -15.468
  932    H    GLY 124           H        GLY 124  17.488   6.496 -14.549
  933   1HA   GLY 124          2HA       GLY 124  20.080   6.501 -14.358
  934   2HA   GLY 124          1HA       GLY 124  19.768   6.365 -12.626
  935    H    LEU 125           H        LEU 125  17.302   4.677 -13.418
  936    HA   LEU 125           HA       LEU 125  18.708   2.114 -13.266
  937   1HB   LEU 125          2HB       LEU 125  16.003   3.107 -12.795
  938   2HB   LEU 125          1HB       LEU 125  15.998   1.579 -13.677
  939    HG   LEU 125           HG       LEU 125  17.731   1.958 -11.240
  940   1HD1  LEU 125          1HD1      LEU 125  14.855   1.959 -11.311
  941   2HD1  LEU 125          2HD1      LEU 125  15.920   2.010  -9.906
  942   3HD1  LEU 125          3HD1      LEU 125  15.410   0.458 -10.570
  943   1HD2  LEU 125          1HD2      LEU 125  16.395  -0.543 -12.283
  944   2HD2  LEU 125          2HD2      LEU 125  17.804  -0.413 -11.233
  945   3HD2  LEU 125          3HD2      LEU 125  17.934   0.017 -12.938
  946    H    GLU 126           H        GLU 126  19.293   3.481 -15.661
  947    HA   GLU 126           HA       GLU 126  19.437   3.050 -17.962
  948   1HB   GLU 126          2HB       GLU 126  19.695   0.682 -17.049
  949   2HB   GLU 126          1HB       GLU 126  17.973   0.470 -17.367
  950   1HG   GLU 126          2HG       GLU 126  18.258   0.804 -19.710
  951   2HG   GLU 126          1HG       GLU 126  19.896   1.425 -19.495
  952    H    HIS 127           H        HIS 127  17.952   2.574 -19.920
  953    HA   HIS 127           HA       HIS 127  15.085   2.747 -19.526
  954   1HB   HIS 127          2HB       HIS 127  15.001   5.060 -20.709
  955   2HB   HIS 127          1HB       HIS 127  15.365   5.027 -18.983
  956    HD2  HIS 127           HD2      HIS 127  17.192   5.799 -22.374
  957    HE1  HIS 127           HE1      HIS 127  19.867   6.663 -19.221
  958    HE2  HIS 127           HE2      HIS 127  19.497   6.834 -21.725
  959    H    HIS 128           H        HIS 128  16.853   1.088 -21.030
  960    HA   HIS 128           HA       HIS 128  16.428   1.973 -23.841
  961   1HB   HIS 128          2HB       HIS 128  18.172  -0.136 -22.561
  962   2HB   HIS 128          1HB       HIS 128  17.875  -0.112 -24.300
  963    HD2  HIS 128           HD2      HIS 128  20.704   0.657 -24.535
  964    HE1  HIS 128           HE1      HIS 128  20.018   4.607 -23.210
  965    HE2  HIS 128           HE2      HIS 128  21.694   3.060 -24.320
  966    H    HIS 129           H        HIS 129  14.940   0.942 -25.130
  967    HA   HIS 129           HA       HIS 129  13.216  -1.081 -23.851
  968   1HB   HIS 129          2HB       HIS 129  12.297   0.851 -25.201
  969   2HB   HIS 129          1HB       HIS 129  12.989   0.093 -26.636
  970    HD2  HIS 129           HD2      HIS 129   9.714  -0.005 -24.764
  971    HE1  HIS 129           HE1      HIS 129   9.967  -3.746 -26.707
  972    HE2  HIS 129           HE2      HIS 129   8.424  -2.161 -25.466
  973    H    HIS 130           H        HIS 130  14.228  -3.071 -23.877
  974    HA   HIS 130           HA       HIS 130  14.604  -4.335 -26.499
  975   1HB   HIS 130          2HB       HIS 130  16.802  -3.115 -25.758
  976   2HB   HIS 130          1HB       HIS 130  16.954  -4.458 -24.626
  977    HD2  HIS 130           HD2      HIS 130  16.274  -4.249 -28.565
  978    HE1  HIS 130           HE1      HIS 130  18.787  -7.542 -27.740
  979    HE2  HIS 130           HE2      HIS 130  17.625  -6.236 -29.579
  980    H    HIS 131           H        HIS 131  13.537  -4.440 -23.418
  981    HA   HIS 131           HA       HIS 131  12.786  -6.188 -22.043
  982   1HB   HIS 131          2HB       HIS 131  11.953  -7.012 -24.301
  983   2HB   HIS 131          1HB       HIS 131  13.414  -7.996 -24.390
  984    HD2  HIS 131           HD2      HIS 131  11.518 -10.260 -24.129
  985    HE1  HIS 131           HE1      HIS 131  11.011  -9.645 -19.980
  986    HE2  HIS 131           HE2      HIS 131  10.627 -11.267 -21.893
  987    H    HIS 132           HN       HIS 132  14.001  -8.995 -22.624
  988    HA   HIS 132           HA       HIS 132  16.733  -8.470 -21.544
  989   1HB   HIS 132          2HB       HIS 132  15.441  -8.980 -19.587
  990   2HB   HIS 132          1HB       HIS 132  14.625 -10.317 -20.396
  991    HD2  HIS 132           HD2      HIS 132  15.833 -12.737 -19.852
  992    HE1  HIS 132           HE1      HIS 132  19.675 -11.290 -18.860
  993    HE2  HIS 132           HE2      HIS 132  18.231 -13.368 -19.041
  Start of MODEL   13
    1   1H    MET   1          1H        MET   1 -31.523  18.799   6.727
    2   2H    MET   1          2H        MET   1 -32.793  19.909   6.932
    3   3H    MET   1          3H        MET   1 -31.785  19.515   8.242
    4    HA   MET   1           HA       MET   1 -30.235  20.457   6.065
    5   1HB   MET   1          2HB       MET   1 -32.437  21.633   5.604
    6   2HB   MET   1          1HB       MET   1 -32.261  22.417   7.174
    7   1HG   MET   1          2HG       MET   1 -29.824  22.576   5.563
    8   2HG   MET   1          1HG       MET   1 -31.205  23.342   4.778
    9   1HE   MET   1          1HE       MET   1 -31.307  25.779   4.971
   10   2HE   MET   1          2HE       MET   1 -31.876  26.459   6.494
   11   3HE   MET   1          3HE       MET   1 -32.704  25.071   5.793
   12    H    SER   2           H        SER   2 -29.114  19.478   8.108
   13    HA   SER   2           HA       SER   2 -28.540  21.746   9.968
   14   1HB   SER   2          2HB       SER   2 -29.673  20.331  11.424
   15   2HB   SER   2          1HB       SER   2 -29.165  18.876  10.572
   16    HG   SER   2           HG       SER   2 -28.127  19.702  12.725
   17    H    HIS   3           H        HIS   3 -27.059  21.277   7.645
   18    HA   HIS   3           HA       HIS   3 -24.898  20.745   6.869
   19   1HB   HIS   3          2HB       HIS   3 -24.395  22.591   8.396
   20   2HB   HIS   3          1HB       HIS   3 -24.333  21.473   9.760
   21    HD2  HIS   3           HD2      HIS   3 -21.700  23.202   8.052
   22    HE1  HIS   3           HE1      HIS   3 -20.228  19.245   7.997
   23    HE2  HIS   3           HE2      HIS   3 -19.609  21.686   7.694
   24    H    GLN   4           H        GLN   4 -25.264  18.458   6.552
   25    HA   GLN   4           HA       GLN   4 -24.487  16.667   8.786
   26   1HB   GLN   4          2HB       GLN   4 -26.219  16.449   6.496
   27   2HB   GLN   4          1HB       GLN   4 -24.994  15.182   6.418
   28   1HG   GLN   4          2HG       GLN   4 -26.642  15.778   8.891
   29   2HG   GLN   4          1HG       GLN   4 -27.056  14.532   7.714
   30   1HE2  GLN   4          1HE2      GLN   4 -26.623  12.670   9.007
   31   2HE2  GLN   4          2HE2      GLN   4 -25.083  12.305   9.619
   32    H    ASP   5           H        ASP   5 -22.495  15.710   8.864
   33    HA   ASP   5           HA       ASP   5 -20.547  16.419   6.776
   34   1HB   ASP   5          2HB       ASP   5 -19.009  15.040   8.357
   35   2HB   ASP   5          1HB       ASP   5 -19.630  16.586   8.940
   36    H    ASP   6           H        ASP   6 -20.714  13.282   8.431
   37    HA   ASP   6           HA       ASP   6 -20.568  11.115   7.531
   38   1HB   ASP   6          2HB       ASP   6 -22.905  12.130   6.728
   39   2HB   ASP   6          1HB       ASP   6 -22.141  11.990   5.144
   40    H    TYR   7           H        TYR   7 -18.401  12.810   6.875
   41    HA   TYR   7           HA       TYR   7 -17.817  12.854   4.066
   42   1HB   TYR   7          2HB       TYR   7 -16.284  13.223   6.590
   43   2HB   TYR   7          1HB       TYR   7 -15.351  12.814   5.150
   44    HD1  TYR   7           HD1      TYR   7 -16.944  15.442   6.955
   45    HD2  TYR   7           HD2      TYR   7 -15.885  14.178   2.988
   46    HE1  TYR   7           HE1      TYR   7 -17.151  17.781   6.154
   47    HE2  TYR   7           HE2      TYR   7 -16.093  16.516   2.188
   48    HH   TYR   7           HH       TYR   7 -17.284  18.591   2.875
   49    H    LEU   8           H        LEU   8 -16.732  11.355   2.778
   50    HA   LEU   8           HA       LEU   8 -16.770   8.583   3.733
   51   1HB   LEU   8          2HB       LEU   8 -15.621   9.486   1.097
   52   2HB   LEU   8          1HB       LEU   8 -16.433   7.969   1.484
   53    HG   LEU   8           HG       LEU   8 -18.313   9.955   2.096
   54   1HD1  LEU   8          1HD1      LEU   8 -18.452  11.251  -0.008
   55   2HD1  LEU   8          2HD1      LEU   8 -16.940  10.523  -0.550
   56   3HD1  LEU   8          3HD1      LEU   8 -16.951  11.589   0.856
   57   1HD2  LEU   8          1HD2      LEU   8 -17.941   8.107  -0.275
   58   2HD2  LEU   8          2HD2      LEU   8 -19.407   9.056  -0.027
   59   3HD2  LEU   8          3HD2      LEU   8 -18.934   7.838   1.157
   60    H    SER   9           H        SER   9 -14.567   7.450   2.512
   61    HA   SER   9           HA       SER   9 -12.383   8.495   4.221
   62   1HB   SER   9          2HB       SER   9 -12.289   5.968   2.578
   63   2HB   SER   9          1HB       SER   9 -11.387   6.358   4.040
   64    HG   SER   9           HG       SER   9 -13.849   6.582   4.755
   65    H    VAL  10           H        VAL  10 -13.445   8.715   1.028
   66    HA   VAL  10           HA       VAL  10 -11.215   8.511  -0.602
   67    HB   VAL  10           HB       VAL  10 -13.297  10.715  -0.547
   68   1HG1  VAL  10          1HG1      VAL  10 -12.310  10.452  -3.145
   69   2HG1  VAL  10          2HG1      VAL  10 -10.866  10.410  -2.133
   70   3HG1  VAL  10          3HG1      VAL  10 -11.972  11.780  -2.035
   71   1HG2  VAL  10          1HG2      VAL  10 -14.177   8.450  -0.942
   72   2HG2  VAL  10          2HG2      VAL  10 -12.983   8.197  -2.217
   73   3HG2  VAL  10          3HG2      VAL  10 -14.256   9.400  -2.426
   74    H    GLU  11           H        GLU  11 -11.895  10.967   1.830
   75    HA   GLU  11           HA       GLU  11  -9.599  12.620   1.118
   76   1HB   GLU  11          2HB       GLU  11 -11.210  12.551   3.692
   77   2HB   GLU  11          1HB       GLU  11 -10.113  13.836   3.185
   78   1HG   GLU  11          2HG       GLU  11 -12.196  13.119   1.211
   79   2HG   GLU  11          1HG       GLU  11 -12.795  13.855   2.697
   80    H    GLU  12           H        GLU  12 -10.142   9.755   2.936
   81    HA   GLU  12           HA       GLU  12  -7.883   9.987   4.735
   82   1HB   GLU  12          2HB       GLU  12  -9.416   7.559   3.746
   83   2HB   GLU  12          1HB       GLU  12  -8.227   7.533   5.048
   84   1HG   GLU  12          2HG       GLU  12 -10.467   9.513   5.199
   85   2HG   GLU  12          1HG       GLU  12 -10.804   7.825   5.587
   86    H    LEU  13           H        LEU  13  -8.391   8.002   1.790
   87    HA   LEU  13           HA       LEU  13  -5.795   7.003   1.507
   88   1HB   LEU  13          2HB       LEU  13  -7.610   7.974  -0.723
   89   2HB   LEU  13          1HB       LEU  13  -6.262   6.851  -0.906
   90    HG   LEU  13           HG       LEU  13  -8.289   6.151   1.152
   91   1HD1  LEU  13          1HD1      LEU  13  -9.629   6.986  -0.808
   92   2HD1  LEU  13          2HD1      LEU  13  -9.864   5.271  -0.469
   93   3HD1  LEU  13          3HD1      LEU  13  -8.831   5.772  -1.808
   94   1HD2  LEU  13          1HD2      LEU  13  -6.692   4.688  -0.969
   95   2HD2  LEU  13          2HD2      LEU  13  -7.866   3.889   0.077
   96   3HD2  LEU  13          3HD2      LEU  13  -6.439   4.653   0.776
   97    H    ILE  14           H        ILE  14  -7.066  10.102   0.260
   98    HA   ILE  14           HA       ILE  14  -4.745  11.050  -1.001
   99    HB   ILE  14           HB       ILE  14  -6.930  12.474   0.521
  100   1HG1  ILE  14          2HG1      ILE  14  -6.281  12.749  -2.399
  101   2HG1  ILE  14          1HG1      ILE  14  -7.113  11.299  -1.836
  102   1HG2  ILE  14          1HG2      ILE  14  -5.907  14.523  -0.760
  103   2HG2  ILE  14          2HG2      ILE  14  -4.422  13.570  -0.724
  104   3HG2  ILE  14          3HG2      ILE  14  -5.209  14.036   0.785
  105   1HD1  ILE  14          1HD1      ILE  14  -8.594  13.268  -2.580
  106   2HD1  ILE  14          2HD1      ILE  14  -8.071  14.066  -1.096
  107   3HD1  ILE  14          3HD1      ILE  14  -8.960  12.544  -1.014
  108    H    GLU  15           H        GLU  15  -5.717  12.006   2.315
  109    HA   GLU  15           HA       GLU  15  -3.386  13.204   3.169
  110   1HB   GLU  15          2HB       GLU  15  -5.179  11.293   4.688
  111   2HB   GLU  15          1HB       GLU  15  -3.896  12.226   5.459
  112   1HG   GLU  15          2HG       GLU  15  -5.772  13.737   3.711
  113   2HG   GLU  15          1HG       GLU  15  -6.420  13.146   5.242
  114    H    ILE  16           H        ILE  16  -4.017   9.693   3.544
  115    HA   ILE  16           HA       ILE  16  -1.489   8.913   4.448
  116    HB   ILE  16           HB       ILE  16  -3.196   7.409   2.439
  117   1HG1  ILE  16          2HG1      ILE  16  -3.243   7.366   5.475
  118   2HG1  ILE  16          1HG1      ILE  16  -4.458   8.140   4.458
  119   1HG2  ILE  16          1HG2      ILE  16  -1.447   5.971   2.551
  120   2HG2  ILE  16          2HG2      ILE  16  -2.021   5.611   4.179
  121   3HG2  ILE  16          3HG2      ILE  16  -0.746   6.804   3.939
  122   1HD1  ILE  16          1HD1      ILE  16  -5.531   6.153   4.445
  123   2HD1  ILE  16          2HD1      ILE  16  -4.140   5.318   5.135
  124   3HD1  ILE  16          3HD1      ILE  16  -4.239   5.575   3.393
  125    H    GLN  17           H        GLN  17  -2.460   8.602   1.009
  126    HA   GLN  17           HA       GLN  17  -0.018   8.146  -0.158
  127   1HB   GLN  17          2HB       GLN  17  -2.473   9.525  -1.010
  128   2HB   GLN  17          1HB       GLN  17  -1.032  10.049  -1.880
  129   1HG   GLN  17          2HG       GLN  17  -1.946   8.173  -3.084
  130   2HG   GLN  17          1HG       GLN  17  -0.488   7.610  -2.266
  131   1HE2  GLN  17          1HE2      GLN  17  -1.281   5.388  -2.149
  132   2HE2  GLN  17          2HE2      GLN  17  -2.539   4.954  -1.095
  133    H    LYS  18           H        LYS  18  -1.272  11.435   0.529
  134    HA   LYS  18           HA       LYS  18   0.820  13.026  -0.237
  135   1HB   LYS  18          2HB       LYS  18  -1.288  13.260   1.632
  136   2HB   LYS  18          1HB       LYS  18   0.174  13.748   2.488
  137   1HG   LYS  18          2HG       LYS  18  -0.505  15.752   1.484
  138   2HG   LYS  18          1HG       LYS  18   0.672  15.136   0.325
  139   1HD   LYS  18          2HD       LYS  18  -0.968  15.352  -1.219
  140   2HD   LYS  18          1HD       LYS  18  -1.682  13.917  -0.480
  141   1HE   LYS  18          2HE       LYS  18  -2.296  16.808   0.187
  142   2HE   LYS  18          1HE       LYS  18  -3.385  15.631  -0.547
  143   1HZ   LYS  18          1HZ       LYS  18  -2.434  14.495   1.795
  144   2HZ   LYS  18          2HZ       LYS  18  -4.007  15.054   1.481
  145   3HZ   LYS  18          3HZ       LYS  18  -2.860  16.089   2.187
  146    H    GLU  19           H        GLU  19   0.716  11.490   3.001
  147    HA   GLU  19           HA       GLU  19   3.373  12.124   3.739
  148   1HB   GLU  19          2HB       GLU  19   1.268  10.350   4.681
  149   2HB   GLU  19          1HB       GLU  19   2.859   9.611   4.866
  150   1HG   GLU  19          2HG       GLU  19   3.641  11.338   6.253
  151   2HG   GLU  19          1HG       GLU  19   2.402  12.467   5.704
  152    H    GLU  20           H        GLU  20   2.282   8.882   2.669
  153    HA   GLU  20           HA       GLU  20   4.650   7.604   2.248
  154   1HB   GLU  20          2HB       GLU  20   2.063   7.583   0.827
  155   2HB   GLU  20          1HB       GLU  20   3.419   6.965  -0.117
  156   1HG   GLU  20          2HG       GLU  20   2.895   6.063   2.721
  157   2HG   GLU  20          1HG       GLU  20   2.172   5.255   1.330
  158    H    THR  21           H        THR  21   3.301  10.072   0.058
  159    HA   THR  21           HA       THR  21   5.320   9.941  -1.935
  160    HB   THR  21           HB       THR  21   4.084  12.559  -1.117
  161    HG1  THR  21           HG1      THR  21   2.240  11.560  -1.182
  162   1HG2  THR  21          1HG2      THR  21   5.592  11.647  -3.297
  163   2HG2  THR  21          2HG2      THR  21   4.706  13.168  -3.194
  164   3HG2  THR  21          3HG2      THR  21   3.938  11.747  -3.901
  165    H    ARG  22           H        ARG  22   5.086  12.357   0.708
  166    HA   ARG  22           HA       ARG  22   7.540  13.594   0.445
  167   1HB   ARG  22          2HB       ARG  22   5.724  13.922   2.263
  168   2HB   ARG  22          1HB       ARG  22   6.602  12.688   3.167
  169   1HG   ARG  22          2HG       ARG  22   8.575  14.008   3.264
  170   2HG   ARG  22          1HG       ARG  22   7.991  15.111   2.017
  171   1HD   ARG  22          2HD       ARG  22   7.849  15.746   4.605
  172   2HD   ARG  22          1HD       ARG  22   6.590  16.234   3.469
  173    HE   ARG  22           HE       ARG  22   5.738  13.755   4.354
  174   1HH1  ARG  22          1HH2      ARG  22   6.765  16.704   5.816
  175   2HH1  ARG  22          2HH2      ARG  22   5.751  16.523   7.207
  176   1HH2  ARG  22          2HH1      ARG  22   4.404  13.503   6.163
  177   2HH2  ARG  22          1HH1      ARG  22   4.414  14.711   7.403
  178    H    ASP  23           H        ASP  23   6.943  10.475   2.076
  179    HA   ASP  23           HA       ASP  23   9.572   9.966   2.968
  180   1HB   ASP  23          2HB       ASP  23   7.149   8.449   2.569
  181   2HB   ASP  23          1HB       ASP  23   8.534   7.502   2.027
  182    H    ILE  24           H        ILE  24   8.086   9.156  -0.176
  183    HA   ILE  24           HA       ILE  24  10.523   8.063  -1.280
  184    HB   ILE  24           HB       ILE  24   7.934   9.036  -2.505
  185   1HG1  ILE  24          2HG1      ILE  24   9.021   6.256  -2.708
  186   2HG1  ILE  24          1HG1      ILE  24   8.386   6.778  -1.148
  187   1HG2  ILE  24          1HG2      ILE  24  10.442   7.994  -3.836
  188   2HG2  ILE  24          2HG2      ILE  24   9.540   9.461  -4.214
  189   3HG2  ILE  24          3HG2      ILE  24   8.855   7.882  -4.601
  190   1HD1  ILE  24          1HD1      ILE  24   6.571   5.768  -2.396
  191   2HD1  ILE  24          2HD1      ILE  24   6.919   6.778  -3.800
  192   3HD1  ILE  24          3HD1      ILE  24   6.285   7.507  -2.324
  193    H    ILE  25           H        ILE  25   8.781  11.026  -2.292
  194    HA   ILE  25           HA       ILE  25  10.663  12.272  -3.823
  195    HB   ILE  25           HB       ILE  25   9.236  13.727  -1.580
  196   1HG1  ILE  25          2HG1      ILE  25   7.559  12.411  -2.662
  197   2HG1  ILE  25          1HG1      ILE  25   7.443  14.015  -3.387
  198   1HG2  ILE  25          1HG2      ILE  25  10.635  14.487  -4.095
  199   2HG2  ILE  25          2HG2      ILE  25  10.477  15.378  -2.581
  200   3HG2  ILE  25          3HG2      ILE  25   9.142  15.353  -3.731
  201   1HD1  ILE  25          1HD1      ILE  25   8.701  11.527  -4.552
  202   2HD1  ILE  25          2HD1      ILE  25   9.061  13.134  -5.184
  203   3HD1  ILE  25          3HD1      ILE  25   7.410  12.517  -5.231
  204    H    GLN  26           H        GLN  26  10.891  11.734  -0.364
  205    HA   GLN  26           HA       GLN  26  13.182  13.497   0.005
  206   1HB   GLN  26          2HB       GLN  26  11.930  11.321   1.694
  207   2HB   GLN  26          1HB       GLN  26  13.377  12.196   2.198
  208   1HG   GLN  26          2HG       GLN  26  11.169  13.913   1.248
  209   2HG   GLN  26          1HG       GLN  26  10.826  13.026   2.733
  210   1HE2  GLN  26          1HE2      GLN  26  12.441  15.779   1.466
  211   2HE2  GLN  26          2HE2      GLN  26  13.322  16.187   2.859
  212    H    ALA  27           H        ALA  27  12.791   9.936  -0.077
  213    HA   ALA  27           HA       ALA  27  15.495   9.219   0.104
  214   1HB   ALA  27          1HB       ALA  27  14.615   7.344  -1.635
  215   2HB   ALA  27          2HB       ALA  27  13.067   7.989  -1.088
  216   3HB   ALA  27          3HB       ALA  27  14.206   7.323   0.082
  217    H    LEU  28           H        LEU  28  13.645   9.939  -2.878
  218    HA   LEU  28           HA       LEU  28  15.823   9.601  -4.678
  219   1HB   LEU  28          2HB       LEU  28  13.582  11.609  -5.017
  220   2HB   LEU  28          1HB       LEU  28  14.491  10.785  -6.284
  221    HG   LEU  28           HG       LEU  28  12.508   9.565  -4.349
  222   1HD1  LEU  28          1HD1      LEU  28  12.599  10.214  -7.260
  223   2HD1  LEU  28          2HD1      LEU  28  11.238  10.268  -6.140
  224   3HD1  LEU  28          3HD1      LEU  28  11.783   8.722  -6.791
  225   1HD2  LEU  28          1HD2      LEU  28  14.328   8.000  -4.478
  226   2HD2  LEU  28          2HD2      LEU  28  14.510   8.260  -6.212
  227   3HD2  LEU  28          3HD2      LEU  28  13.090   7.418  -5.591
  228    H    LEU  29           H        LEU  29  14.475  12.728  -3.544
  229    HA   LEU  29           HA       LEU  29  16.457  14.424  -4.475
  230   1HB   LEU  29          2HB       LEU  29  14.516  14.488  -2.295
  231   2HB   LEU  29          1HB       LEU  29  15.972  15.407  -1.912
  232    HG   LEU  29           HG       LEU  29  14.625  15.713  -4.589
  233   1HD1  LEU  29          1HD1      LEU  29  13.251  17.485  -3.734
  234   2HD1  LEU  29          2HD1      LEU  29  14.027  17.407  -2.151
  235   3HD1  LEU  29          3HD1      LEU  29  12.980  16.092  -2.686
  236   1HD2  LEU  29          1HD2      LEU  29  16.902  16.630  -4.246
  237   2HD2  LEU  29          2HD2      LEU  29  16.315  17.552  -2.862
  238   3HD2  LEU  29          3HD2      LEU  29  15.721  17.920  -4.482
  239    H    GLU  30           H        GLU  30  16.516  12.833  -1.261
  240    HA   GLU  30           HA       GLU  30  19.084  13.667  -0.480
  241   1HB   GLU  30          2HB       GLU  30  17.717  12.502   1.109
  242   2HB   GLU  30          1HB       GLU  30  17.607  11.082   0.068
  243   1HG   GLU  30          2HG       GLU  30  19.871  10.495   0.434
  244   2HG   GLU  30          1HG       GLU  30  20.269  12.092   1.068
  245    H    ASP  31           H        ASP  31  18.143  11.137  -2.744
  246    HA   ASP  31           HA       ASP  31  20.722   9.871  -2.917
  247   1HB   ASP  31          2HB       ASP  31  18.155   9.650  -4.219
  248   2HB   ASP  31          1HB       ASP  31  19.438   9.649  -5.430
  249    H    GLY  32           H        GLY  32  19.415  12.808  -4.244
  250   1HA   GLY  32          2HA       GLY  32  20.767  14.561  -5.173
  251   2HA   GLY  32          1HA       GLY  32  22.054  13.387  -5.449
  252    H    SER  33           H        SER  33  18.702  12.859  -6.397
  253    HA   SER  33           HA       SER  33  19.522  12.280  -9.124
  254   1HB   SER  33          2HB       SER  33  17.648  11.040  -8.829
  255   2HB   SER  33          1HB       SER  33  17.086  12.058  -7.507
  256    HG   SER  33           HG       SER  33  16.526  13.607  -9.207
  257    H    ASP  34           H        ASP  34  19.689  13.717 -10.767
  258    HA   ASP  34           HA       ASP  34  19.623  16.456 -10.613
  259   1HB   ASP  34          2HB       ASP  34  19.705  14.572 -12.700
  260   2HB   ASP  34          1HB       ASP  34  18.402  15.682 -13.121
  261    HA   PRO  35           HA       PRO  35  15.246  16.912  -9.365
  262   1HB   PRO  35          2HB       PRO  35  16.087  19.760  -9.323
  263   2HB   PRO  35          1HB       PRO  35  15.292  18.799  -8.063
  264   1HG   PRO  35          2HG       PRO  35  17.872  19.501  -7.917
  265   2HG   PRO  35          1HG       PRO  35  17.264  17.972  -7.262
  266   1HD   PRO  35          2HD       PRO  35  18.864  18.457  -9.732
  267   2HD   PRO  35          1HD       PRO  35  18.839  17.040  -8.658
  268    H    ASP  36           H        ASP  36  16.942  18.067 -12.101
  269    HA   ASP  36           HA       ASP  36  14.383  19.094 -13.266
  270   1HB   ASP  36          2HB       ASP  36  16.383  20.714 -12.949
  271   2HB   ASP  36          1HB       ASP  36  17.117  19.839 -14.293
  272    H    ALA  37           H        ALA  37  15.918  16.344 -13.226
  273    HA   ALA  37           HA       ALA  37  16.364  15.936 -16.107
  274   1HB   ALA  37          1HB       ALA  37  16.516  13.451 -15.176
  275   2HB   ALA  37          2HB       ALA  37  16.692  14.285 -13.631
  276   3HB   ALA  37          3HB       ALA  37  17.842  14.589 -14.934
  277    H    LEU  38           H        LEU  38  13.658  16.290 -14.346
  278    HA   LEU  38           HA       LEU  38  11.420  15.700 -14.732
  279   1HB   LEU  38          2HB       LEU  38  12.796  15.280 -17.268
  280   2HB   LEU  38          1HB       LEU  38  11.444  14.164 -17.066
  281    HG   LEU  38           HG       LEU  38  11.129  17.100 -16.462
  282   1HD1  LEU  38          1HD1      LEU  38  10.603  15.776 -19.139
  283   2HD1  LEU  38          2HD1      LEU  38  12.009  16.787 -18.802
  284   3HD1  LEU  38          3HD1      LEU  38  10.389  17.479 -18.737
  285   1HD2  LEU  38          1HD2      LEU  38   9.220  14.903 -17.331
  286   2HD2  LEU  38          2HD2      LEU  38   8.765  16.568 -16.969
  287   3HD2  LEU  38          3HD2      LEU  38   9.390  15.528 -15.690
  288    H    TYR  39           H        TYR  39  10.109  13.952 -14.145
  289    HA   TYR  39           HA       TYR  39  11.465  11.293 -13.969
  290   1HB   TYR  39          2HB       TYR  39  10.372  12.964 -11.843
  291   2HB   TYR  39          1HB       TYR  39   9.614  11.372 -11.877
  292    HD1  TYR  39           HD1      TYR  39  13.082  12.644 -12.576
  293    HD2  TYR  39           HD2      TYR  39  10.612   9.910 -10.368
  294    HE1  TYR  39           HE1      TYR  39  15.105  11.657 -11.535
  295    HE2  TYR  39           HE2      TYR  39  12.635   8.923  -9.327
  296    HH   TYR  39           HH       TYR  39  15.381  10.231  -9.045
  297    H    GLU  40           H        GLU  40   9.911   9.466 -13.915
  298    HA   GLU  40           HA       GLU  40   7.429  10.155 -15.431
  299   1HB   GLU  40          2HB       GLU  40   8.325   7.337 -15.352
  300   2HB   GLU  40          1HB       GLU  40   7.755   8.299 -16.716
  301   1HG   GLU  40          2HG       GLU  40  10.035   9.568 -16.421
  302   2HG   GLU  40          1HG       GLU  40  10.524   8.106 -15.566
  303    H    ILE  41           H        ILE  41   5.521   9.803 -14.401
  304    HA   ILE  41           HA       ILE  41   5.582   8.244 -11.864
  305    HB   ILE  41           HB       ILE  41   3.166   9.786 -12.714
  306   1HG1  ILE  41          2HG1      ILE  41   5.152  11.248 -13.250
  307   2HG1  ILE  41          1HG1      ILE  41   4.111  11.897 -11.984
  308   1HG2  ILE  41          1HG2      ILE  41   4.650   9.430 -10.091
  309   2HG2  ILE  41          2HG2      ILE  41   3.218   8.532 -10.595
  310   3HG2  ILE  41          3HG2      ILE  41   3.109  10.265 -10.288
  311   1HD1  ILE  41          1HD1      ILE  41   6.700  11.870 -11.601
  312   2HD1  ILE  41          2HD1      ILE  41   6.454  10.160 -11.251
  313   3HD1  ILE  41          3HD1      ILE  41   5.634  11.386 -10.283
  314    H    GLU  42           H        GLU  42   4.524   6.309 -11.740
  315    HA   GLU  42           HA       GLU  42   2.816   5.541 -14.074
  316   1HB   GLU  42          2HB       GLU  42   4.941   4.245 -13.847
  317   2HB   GLU  42          1HB       GLU  42   4.414   3.720 -12.248
  318   1HG   GLU  42          2HG       GLU  42   2.954   2.206 -13.096
  319   2HG   GLU  42          1HG       GLU  42   2.397   3.315 -14.349
  320    H    HIS  43           H        HIS  43   0.701   5.239 -13.566
  321    HA   HIS  43           HA       HIS  43   0.028   4.681 -10.704
  322   1HB   HIS  43          2HB       HIS  43  -1.756   5.974 -12.786
  323   2HB   HIS  43          1HB       HIS  43  -2.061   5.845 -11.053
  324    HD2  HIS  43           HD2      HIS  43   1.092   7.345 -13.009
  325    HE1  HIS  43           HE1      HIS  43  -0.123  10.051 -10.003
  326    HE2  HIS  43           HE2      HIS  43   1.571   9.629 -11.843
  327    H    HIS  44           H        HIS  44  -1.290   2.925 -10.274
  328    HA   HIS  44           HA       HIS  44  -1.941   1.191 -12.609
  329   1HB   HIS  44          2HB       HIS  44  -2.015   0.389  -9.694
  330   2HB   HIS  44          1HB       HIS  44  -1.903  -0.660 -11.107
  331    HD2  HIS  44           HD2      HIS  44   0.674   0.279 -12.658
  332    HE1  HIS  44           HE1      HIS  44   2.673   0.556  -8.949
  333    HE2  HIS  44           HE2      HIS  44   2.987   0.434 -11.463
  334    H    LEU  45           H        LEU  45  -4.036   1.207 -13.259
  335    HA   LEU  45           HA       LEU  45  -6.141   1.652 -11.180
  336   1HB   LEU  45          2HB       LEU  45  -5.917   2.824 -13.961
  337   2HB   LEU  45          1HB       LEU  45  -7.453   2.750 -13.100
  338    HG   LEU  45           HG       LEU  45  -5.906   3.820 -11.157
  339   1HD1  LEU  45          1HD1      LEU  45  -4.859   5.166 -13.642
  340   2HD1  LEU  45          2HD1      LEU  45  -4.005   3.797 -12.931
  341   3HD1  LEU  45          3HD1      LEU  45  -4.247   5.269 -11.991
  342   1HD2  LEU  45          1HD2      LEU  45  -6.878   5.976 -11.781
  343   2HD2  LEU  45          2HD2      LEU  45  -8.054   4.697 -12.083
  344   3HD2  LEU  45          3HD2      LEU  45  -7.155   5.404 -13.425
  345    H    PHE  46           H        PHE  46  -7.815   0.174 -11.255
  346    HA   PHE  46           HA       PHE  46  -7.867  -1.673 -13.604
  347   1HB   PHE  46          2HB       PHE  46  -8.848  -3.038 -11.311
  348   2HB   PHE  46          1HB       PHE  46  -7.376  -3.378 -12.221
  349    HD1  PHE  46           HD1      PHE  46  -5.381  -1.653 -11.735
  350    HD2  PHE  46           HD2      PHE  46  -8.626  -2.514  -9.056
  351    HE1  PHE  46           HE1      PHE  46  -4.015  -0.855  -9.826
  352    HE2  PHE  46           HE2      PHE  46  -7.260  -1.715  -7.146
  353    HZ   PHE  46           HZ       PHE  46  -4.955  -0.887  -7.530
  354    H    ALA  47           H        ALA  47 -10.015  -2.865 -13.733
  355    HA   ALA  47           HA       ALA  47 -12.299  -1.457 -12.509
  356   1HB   ALA  47          1HB       ALA  47 -13.251  -0.643 -14.493
  357   2HB   ALA  47          2HB       ALA  47 -12.264  -1.695 -15.510
  358   3HB   ALA  47          3HB       ALA  47 -11.538  -0.293 -14.725
  359    H    GLU  48           H        GLU  48 -14.410  -2.548 -13.530
  360    HA   GLU  48           HA       GLU  48 -13.837  -5.482 -13.666
  361   1HB   GLU  48          2HB       GLU  48 -15.152  -4.524 -11.667
  362   2HB   GLU  48          1HB       GLU  48 -16.461  -4.250 -12.816
  363   1HG   GLU  48          2HG       GLU  48 -16.540  -6.611 -13.376
  364   2HG   GLU  48          1HG       GLU  48 -15.120  -6.932 -12.381
  365    H    ASP  49           H        ASP  49 -15.550  -2.790 -15.125
  366    HA   ASP  49           HA       ASP  49 -16.513  -4.661 -17.253
  367   1HB   ASP  49          2HB       ASP  49 -18.148  -3.183 -15.736
  368   2HB   ASP  49          1HB       ASP  49 -17.736  -1.956 -16.935
  369    H    PHE  50           H        PHE  50 -15.146  -4.471 -18.965
  370    HA   PHE  50           HA       PHE  50 -13.321  -2.438 -19.515
  371   1HB   PHE  50          2HB       PHE  50 -13.170  -3.303 -21.715
  372   2HB   PHE  50          1HB       PHE  50 -13.703  -4.680 -20.750
  373    HD1  PHE  50           HD1      PHE  50 -14.557  -2.381 -23.427
  374    HD2  PHE  50           HD2      PHE  50 -16.148  -5.288 -20.695
  375    HE1  PHE  50           HE1      PHE  50 -16.599  -2.574 -24.822
  376    HE2  PHE  50           HE2      PHE  50 -18.189  -5.482 -22.089
  377    HZ   PHE  50           HZ       PHE  50 -18.415  -4.124 -24.152
  378    H    ASP  51           H        ASP  51 -16.763  -2.344 -19.783
  379    HA   ASP  51           HA       ASP  51 -17.010  -0.239 -21.720
  380   1HB   ASP  51          2HB       ASP  51 -18.872  -1.744 -20.848
  381   2HB   ASP  51          1HB       ASP  51 -18.882  -0.743 -19.395
  382    H    LYS  52           H        LYS  52 -17.617   0.073 -18.203
  383    HA   LYS  52           HA       LYS  52 -17.293   2.895 -18.169
  384   1HB   LYS  52          2HB       LYS  52 -17.657   2.719 -15.915
  385   2HB   LYS  52          1HB       LYS  52 -18.104   1.068 -16.336
  386   1HG   LYS  52          2HG       LYS  52 -15.695   0.409 -15.949
  387   2HG   LYS  52          1HG       LYS  52 -15.420   2.031 -15.315
  388   1HD   LYS  52          2HD       LYS  52 -16.122   1.277 -13.311
  389   2HD   LYS  52          1HD       LYS  52 -17.735   1.133 -14.009
  390   1HE   LYS  52          2HE       LYS  52 -16.849  -1.154 -14.927
  391   2HE   LYS  52          1HE       LYS  52 -15.631  -0.986 -13.664
  392   1HZ   LYS  52          1HZ       LYS  52 -17.503  -2.193 -12.813
  393   2HZ   LYS  52          2HZ       LYS  52 -18.577  -0.968 -13.297
  394   3HZ   LYS  52          3HZ       LYS  52 -17.450  -0.674 -12.061
  395    H    LEU  53           H        LEU  53 -14.958   0.305 -18.126
  396    HA   LEU  53           HA       LEU  53 -12.724   1.774 -17.089
  397   1HB   LEU  53          2HB       LEU  53 -12.934  -0.766 -17.496
  398   2HB   LEU  53          1HB       LEU  53 -12.515  -0.405 -19.171
  399    HG   LEU  53           HG       LEU  53 -10.846   0.483 -16.805
  400   1HD1  LEU  53          1HD1      LEU  53  -9.719  -1.586 -18.530
  401   2HD1  LEU  53          2HD1      LEU  53 -11.178  -2.133 -17.703
  402   3HD1  LEU  53          3HD1      LEU  53  -9.812  -1.525 -16.770
  403   1HD2  LEU  53          1HD2      LEU  53 -10.286   1.856 -18.617
  404   2HD2  LEU  53          2HD2      LEU  53 -10.596   0.586 -19.801
  405   3HD2  LEU  53          3HD2      LEU  53  -9.143   0.526 -18.803
  406    H    GLU  54           H        GLU  54 -13.474   0.937 -20.497
  407    HA   GLU  54           HA       GLU  54 -11.539   2.538 -21.732
  408   1HB   GLU  54          2HB       GLU  54 -14.195   1.470 -22.510
  409   2HB   GLU  54          1HB       GLU  54 -13.611   2.833 -23.467
  410   1HG   GLU  54          2HG       GLU  54 -11.788   1.661 -24.284
  411   2HG   GLU  54          1HG       GLU  54 -11.708   0.600 -22.875
  412    H    LYS  55           H        LYS  55 -14.716   3.485 -20.473
  413    HA   LYS  55           HA       LYS  55 -14.785   6.136 -21.482
  414   1HB   LYS  55          2HB       LYS  55 -15.868   5.023 -18.877
  415   2HB   LYS  55          1HB       LYS  55 -16.286   6.604 -19.537
  416   1HG   LYS  55          2HG       LYS  55 -16.890   5.246 -21.697
  417   2HG   LYS  55          1HG       LYS  55 -16.979   3.876 -20.589
  418   1HD   LYS  55          2HD       LYS  55 -18.493   5.351 -19.135
  419   2HD   LYS  55          1HD       LYS  55 -18.601   6.425 -20.531
  420   1HE   LYS  55          2HE       LYS  55 -19.037   3.808 -21.515
  421   2HE   LYS  55          1HE       LYS  55 -20.007   3.954 -20.048
  422   1HZ   LYS  55          1HZ       LYS  55 -20.064   5.685 -22.450
  423   2HZ   LYS  55          2HZ       LYS  55 -20.775   6.144 -20.976
  424   3HZ   LYS  55          3HZ       LYS  55 -21.329   4.762 -21.797
  425    H    ALA  56           H        ALA  56 -13.527   4.952 -18.343
  426    HA   ALA  56           HA       ALA  56 -12.543   7.526 -17.519
  427   1HB   ALA  56          1HB       ALA  56 -10.936   5.607 -16.271
  428   2HB   ALA  56          2HB       ALA  56 -12.472   4.784 -16.537
  429   3HB   ALA  56          3HB       ALA  56 -12.427   6.295 -15.629
  430    H    ALA  57           H        ALA  57 -10.643   4.654 -18.517
  431    HA   ALA  57           HA       ALA  57  -8.153   5.782 -18.815
  432   1HB   ALA  57          1HB       ALA  57  -8.034   3.591 -19.458
  433   2HB   ALA  57          2HB       ALA  57  -8.190   4.278 -21.074
  434   3HB   ALA  57          3HB       ALA  57  -9.610   3.634 -20.251
  435    H    VAL  58           H        VAL  58 -10.757   5.932 -21.262
  436    HA   VAL  58           HA       VAL  58  -9.367   7.397 -23.229
  437    HB   VAL  58           HB       VAL  58 -12.261   7.235 -22.431
  438   1HG1  VAL  58          1HG1      VAL  58 -12.411   9.410 -23.184
  439   2HG1  VAL  58          2HG1      VAL  58 -12.467   8.579 -24.738
  440   3HG1  VAL  58          3HG1      VAL  58 -10.953   9.280 -24.168
  441   1HG2  VAL  58          1HG2      VAL  58 -11.370   5.387 -23.714
  442   2HG2  VAL  58          2HG2      VAL  58 -10.620   6.488 -24.869
  443   3HG2  VAL  58          3HG2      VAL  58 -12.377   6.349 -24.796
  444    H    GLU  59           H        GLU  59 -11.336   8.673 -20.520
  445    HA   GLU  59           HA       GLU  59 -10.847  11.424 -21.054
  446   1HB   GLU  59          2HB       GLU  59 -11.470   9.925 -18.504
  447   2HB   GLU  59          1HB       GLU  59 -11.289  11.679 -18.539
  448   1HG   GLU  59          2HG       GLU  59 -13.085  10.412 -20.566
  449   2HG   GLU  59          1HG       GLU  59 -13.667  10.542 -18.905
  450    H    ALA  60           H        ALA  60  -8.992   9.052 -19.169
  451    HA   ALA  60           HA       ALA  60  -7.101  10.852 -18.043
  452   1HB   ALA  60          1HB       ALA  60  -6.546   8.022 -18.979
  453   2HB   ALA  60          2HB       ALA  60  -7.346   8.414 -17.456
  454   3HB   ALA  60          3HB       ALA  60  -5.677   8.916 -17.731
  455    H    PHE  61           H        PHE  61  -6.713   8.823 -20.975
  456    HA   PHE  61           HA       PHE  61  -4.302   9.872 -21.904
  457   1HB   PHE  61          2HB       PHE  61  -5.571   8.008 -22.982
  458   2HB   PHE  61          1HB       PHE  61  -6.701   9.196 -23.632
  459    HD1  PHE  61           HD1      PHE  61  -6.225  10.341 -25.636
  460    HD2  PHE  61           HD2      PHE  61  -3.078   8.284 -23.556
  461    HE1  PHE  61           HE1      PHE  61  -4.692  10.759 -27.541
  462    HE2  PHE  61           HE2      PHE  61  -1.546   8.704 -25.460
  463    HZ   PHE  61           HZ       PHE  61  -2.352   9.941 -27.452
  464    H    LYS  62           H        LYS  62  -7.581  11.152 -22.516
  465    HA   LYS  62           HA       LYS  62  -6.951  13.312 -24.170
  466   1HB   LYS  62          2HB       LYS  62  -9.119  12.604 -22.367
  467   2HB   LYS  62          1HB       LYS  62  -8.827  14.343 -22.356
  468   1HG   LYS  62          2HG       LYS  62  -8.926  14.358 -24.837
  469   2HG   LYS  62          1HG       LYS  62  -9.287  12.631 -24.817
  470   1HD   LYS  62          2HD       LYS  62 -11.400  13.744 -24.992
  471   2HD   LYS  62          1HD       LYS  62 -11.274  13.194 -23.321
  472   1HE   LYS  62          2HE       LYS  62 -10.289  15.936 -24.055
  473   2HE   LYS  62          1HE       LYS  62 -12.015  15.667 -23.813
  474   1HZ   LYS  62          1HZ       LYS  62  -9.932  15.849 -21.883
  475   2HZ   LYS  62          2HZ       LYS  62 -10.790  14.392 -21.717
  476   3HZ   LYS  62          3HZ       LYS  62 -11.613  15.877 -21.656
  477    H    MET  63           H        MET  63  -7.197  13.508 -20.594
  478    HA   MET  63           HA       MET  63  -6.197  16.084 -20.238
  479   1HB   MET  63          2HB       MET  63  -5.806  13.584 -18.581
  480   2HB   MET  63          1HB       MET  63  -5.205  15.159 -18.058
  481   1HG   MET  63          2HG       MET  63  -7.578  16.033 -18.446
  482   2HG   MET  63          1HG       MET  63  -8.070  14.345 -18.575
  483   1HE   MET  63          1HE       MET  63  -8.183  12.751 -17.053
  484   2HE   MET  63          2HE       MET  63  -9.468  13.713 -16.324
  485   3HE   MET  63          3HE       MET  63  -8.269  12.932 -15.295
  486    H    GLY  64           H        GLY  64  -4.173  13.124 -20.116
  487   1HA   GLY  64          2HA       GLY  64  -2.173  13.744 -21.874
  488   2HA   GLY  64          1HA       GLY  64  -1.749  14.728 -20.474
  489    H    PHE  65           H        PHE  65  -3.324  11.586 -20.238
  490    HA   PHE  65           HA       PHE  65  -0.924  10.603 -18.771
  491   1HB   PHE  65          2HB       PHE  65  -3.828   9.755 -18.778
  492   2HB   PHE  65          1HB       PHE  65  -2.564   8.791 -18.015
  493    HD1  PHE  65           HD1      PHE  65  -4.860  11.472 -17.568
  494    HD2  PHE  65           HD2      PHE  65  -0.994  10.057 -16.339
  495    HE1  PHE  65           HE1      PHE  65  -4.971  12.917 -15.558
  496    HE2  PHE  65           HE2      PHE  65  -1.105  11.505 -14.327
  497    HZ   PHE  65           HZ       PHE  65  -3.095  12.935 -13.937
  498    H    GLU  66           H        GLU  66  -0.009   8.561 -19.319
  499    HA   GLU  66           HA       GLU  66  -0.597   7.713 -22.109
  500   1HB   GLU  66          2HB       GLU  66   1.785   7.669 -20.344
  501   2HB   GLU  66          1HB       GLU  66   1.588   6.262 -21.390
  502   1HG   GLU  66          2HG       GLU  66   2.892   7.954 -22.568
  503   2HG   GLU  66          1HG       GLU  66   1.313   7.796 -23.339
  504    H    VAL  67           H        VAL  67  -2.573   6.571 -21.453
  505    HA   VAL  67           HA       VAL  67  -2.639   4.503 -19.502
  506    HB   VAL  67           HB       VAL  67  -4.734   5.236 -20.337
  507   1HG1  VAL  67          1HG1      VAL  67  -3.570   4.648 -23.071
  508   2HG1  VAL  67          2HG1      VAL  67  -4.045   6.220 -22.428
  509   3HG1  VAL  67          3HG1      VAL  67  -5.275   5.013 -22.801
  510   1HG2  VAL  67          1HG2      VAL  67  -5.722   3.194 -20.605
  511   2HG2  VAL  67          2HG2      VAL  67  -4.093   2.581 -20.322
  512   3HG2  VAL  67          3HG2      VAL  67  -4.691   2.769 -21.971
  513    H    LEU  68           H        LEU  68  -1.625   2.564 -19.493
  514    HA   LEU  68           HA       LEU  68  -0.504   1.555 -22.065
  515   1HB   LEU  68          2HB       LEU  68   0.674   1.851 -19.579
  516   2HB   LEU  68          1HB       LEU  68   0.254   0.138 -19.607
  517    HG   LEU  68           HG       LEU  68   1.765   1.573 -21.809
  518   1HD1  LEU  68          1HD1      LEU  68   3.063   1.391 -19.696
  519   2HD1  LEU  68          2HD1      LEU  68   3.733   0.375 -20.971
  520   3HD1  LEU  68          3HD1      LEU  68   2.767  -0.347 -19.684
  521   1HD2  LEU  68          1HD2      LEU  68   0.763  -1.222 -21.373
  522   2HD2  LEU  68          2HD2      LEU  68   2.274  -0.990 -22.253
  523   3HD2  LEU  68          3HD2      LEU  68   0.784  -0.263 -22.853
  524    H    GLU  69           H        GLU  69  -1.020  -0.538 -22.779
  525    HA   GLU  69           HA       GLU  69  -3.529  -1.597 -22.450
  526   1HB   GLU  69          2HB       GLU  69  -1.046  -2.549 -23.492
  527   2HB   GLU  69          1HB       GLU  69  -1.755  -3.846 -22.529
  528   1HG   GLU  69          2HG       GLU  69  -2.662  -4.112 -24.718
  529   2HG   GLU  69          1HG       GLU  69  -3.945  -3.370 -23.763
  530    H    ALA  70           H        ALA  70  -4.263  -3.564 -21.215
  531    HA   ALA  70           HA       ALA  70  -3.130  -3.491 -18.448
  532   1HB   ALA  70          1HB       ALA  70  -5.406  -2.717 -18.430
  533   2HB   ALA  70          2HB       ALA  70  -5.426  -4.362 -17.794
  534   3HB   ALA  70          3HB       ALA  70  -5.932  -4.052 -19.455
  535    H    GLU  71           H        GLU  71  -3.726  -5.683 -17.271
  536    HA   GLU  71           HA       GLU  71  -3.300  -7.967 -19.144
  537   1HB   GLU  71          2HB       GLU  71  -1.108  -7.309 -18.195
  538   2HB   GLU  71          1HB       GLU  71  -1.767  -7.493 -16.569
  539   1HG   GLU  71          2HG       GLU  71  -2.285  -9.852 -18.190
  540   2HG   GLU  71          1HG       GLU  71  -0.559  -9.498 -18.105
  541    H    GLU  72           H        GLU  72  -4.052 -10.008 -18.289
  542    HA   GLU  72           HA       GLU  72  -6.364  -9.725 -16.543
  543   1HB   GLU  72          2HB       GLU  72  -5.081 -12.309 -17.465
  544   2HB   GLU  72          1HB       GLU  72  -6.759 -12.050 -16.983
  545   1HG   GLU  72          2HG       GLU  72  -6.057 -10.211 -19.097
  546   2HG   GLU  72          1HG       GLU  72  -5.682 -11.862 -19.591
  547    H    THR  73           H        THR  73  -5.879  -9.322 -14.413
  548    HA   THR  73           HA       THR  73  -4.025 -11.254 -13.080
  549    HB   THR  73           HB       THR  73  -2.878  -9.135 -13.140
  550    HG1  THR  73           HG1      THR  73  -2.510  -9.048 -11.050
  551   1HG2  THR  73          1HG2      THR  73  -4.131  -7.150 -11.988
  552   2HG2  THR  73          2HG2      THR  73  -5.586  -8.066 -12.385
  553   3HG2  THR  73          3HG2      THR  73  -4.501  -7.533 -13.670
  554    H    GLU  74           H        GLU  74  -4.727  -9.741 -10.530
  555    HA   GLU  74           HA       GLU  74  -7.566 -10.022 -10.114
  556   1HB   GLU  74          2HB       GLU  74  -7.688 -12.065  -8.928
  557   2HB   GLU  74          1HB       GLU  74  -6.693 -12.451 -10.332
  558   1HG   GLU  74          2HG       GLU  74  -4.685 -11.811  -8.808
  559   2HG   GLU  74          1HG       GLU  74  -5.828 -12.010  -7.478
  560    H    ASP  75           H        ASP  75  -8.046  -9.879  -7.679
  561    HA   ASP  75           HA       ASP  75  -5.777  -8.780  -6.115
  562   1HB   ASP  75          2HB       ASP  75  -8.365  -7.236  -6.320
  563   2HB   ASP  75          1HB       ASP  75  -6.815  -6.693  -5.674
  564    H    GLU  76           H        GLU  76  -8.540  -7.718  -4.685
  565    HA   GLU  76           HA       GLU  76  -8.592 -10.078  -2.889
  566   1HB   GLU  76          2HB       GLU  76  -9.235  -7.185  -2.623
  567   2HB   GLU  76          1HB       GLU  76 -10.196  -8.301  -1.653
  568   1HG   GLU  76          2HG       GLU  76  -8.294  -9.150  -0.531
  569   2HG   GLU  76          1HG       GLU  76  -7.187  -8.491  -1.735
  570    H    ASP  77           H        ASP  77 -10.030  -9.647  -5.632
  571    HA   ASP  77           HA       ASP  77 -12.240 -11.296  -5.213
  572   1HB   ASP  77          2HB       ASP  77 -12.709  -8.625  -4.218
  573   2HB   ASP  77          1HB       ASP  77 -13.803  -8.963  -5.561
  574    H    GLY  78           H        GLY  78 -10.232  -9.685  -7.125
  575   1HA   GLY  78          2HA       GLY  78 -11.953  -9.053  -9.389
  576   2HA   GLY  78          1HA       GLY  78 -10.189  -9.120  -9.419
  577    H    ASN  79           H        ASN  79  -9.610 -11.666  -8.690
  578    HA   ASN  79           HA       ASN  79  -9.499 -13.855  -9.518
  579   1HB   ASN  79          2HB       ASN  79 -11.946 -13.746  -8.727
  580   2HB   ASN  79          1HB       ASN  79 -12.359 -13.499 -10.425
  581   1HD2  ASN  79          1HD2      ASN  79 -13.054 -15.882  -8.828
  582   2HD2  ASN  79          2HD2      ASN  79 -12.289 -17.203  -9.572
  583    H    LYS  80           H        LYS  80 -11.024 -11.461 -11.643
  584    HA   LYS  80           HA       LYS  80  -9.221 -12.115 -13.802
  585   1HB   LYS  80          2HB       LYS  80 -10.991 -14.007 -13.794
  586   2HB   LYS  80          1HB       LYS  80 -12.103 -12.776 -14.393
  587   1HG   LYS  80          2HG       LYS  80 -11.295 -13.549 -16.410
  588   2HG   LYS  80          1HG       LYS  80 -10.086 -12.308 -16.080
  589   1HD   LYS  80          2HD       LYS  80  -8.560 -13.948 -15.164
  590   2HD   LYS  80          1HD       LYS  80  -9.787 -15.211 -15.264
  591   1HE   LYS  80          2HE       LYS  80  -9.593 -15.412 -17.559
  592   2HE   LYS  80          1HE       LYS  80  -9.087 -13.735 -17.769
  593   1HZ   LYS  80          1HZ       LYS  80  -7.499 -16.084 -17.279
  594   2HZ   LYS  80          2HZ       LYS  80  -7.101 -14.777 -16.270
  595   3HZ   LYS  80          3HZ       LYS  80  -7.053 -14.596 -17.959
  596    H    LEU  81           H        LEU  81  -9.175  -9.718 -13.205
  597    HA   LEU  81           HA       LEU  81 -11.311  -8.270 -14.720
  598   1HB   LEU  81          2HB       LEU  81 -10.398  -6.293 -13.208
  599   2HB   LEU  81          1HB       LEU  81 -11.600  -7.420 -12.578
  600    HG   LEU  81           HG       LEU  81  -9.736  -8.794 -11.626
  601   1HD1  LEU  81          1HD1      LEU  81  -7.843  -8.273 -12.917
  602   2HD1  LEU  81          2HD1      LEU  81  -7.538  -7.403 -11.413
  603   3HD1  LEU  81          3HD1      LEU  81  -8.144  -6.538 -12.826
  604   1HD2  LEU  81          1HD2      LEU  81  -9.852  -5.880 -10.785
  605   2HD2  LEU  81          2HD2      LEU  81  -9.192  -7.185  -9.800
  606   3HD2  LEU  81          3HD2      LEU  81 -10.908  -7.171 -10.211
  607    H    LEU  82           H        LEU  82 -10.064  -5.805 -14.951
  608    HA   LEU  82           HA       LEU  82  -7.592  -6.491 -16.492
  609   1HB   LEU  82          2HB       LEU  82  -9.781  -4.491 -17.113
  610   2HB   LEU  82          1HB       LEU  82  -8.236  -4.533 -17.962
  611    HG   LEU  82           HG       LEU  82  -8.903  -7.136 -18.161
  612   1HD1  LEU  82          1HD1      LEU  82 -11.575  -5.794 -18.501
  613   2HD1  LEU  82          2HD1      LEU  82 -11.102  -6.439 -16.929
  614   3HD1  LEU  82          3HD1      LEU  82 -11.213  -7.511 -18.326
  615   1HD2  LEU  82          1HD2      LEU  82  -9.957  -4.920 -19.952
  616   2HD2  LEU  82          2HD2      LEU  82  -9.718  -6.601 -20.428
  617   3HD2  LEU  82          3HD2      LEU  82  -8.329  -5.597 -20.016
  618    H    CYS  83           H        CYS  83  -5.823  -5.134 -16.220
  619    HA   CYS  83           HA       CYS  83  -6.179  -2.797 -14.393
  620   1HB   CYS  83          2HB       CYS  83  -5.127  -4.191 -12.886
  621   2HB   CYS  83          1HB       CYS  83  -4.345  -5.139 -14.150
  622    HG   CYS  83           HG       CYS  83  -3.214  -2.331 -14.084
  623    H    PHE  84           H        PHE  84  -5.890  -1.173 -15.915
  624    HA   PHE  84           HA       PHE  84  -3.692  -1.435 -17.880
  625   1HB   PHE  84          2HB       PHE  84  -4.599   0.799 -18.690
  626   2HB   PHE  84          1HB       PHE  84  -5.724  -0.553 -18.798
  627    HD1  PHE  84           HD1      PHE  84  -7.345  -0.911 -16.804
  628    HD2  PHE  84           HD2      PHE  84  -5.192   2.740 -17.506
  629    HE1  PHE  84           HE1      PHE  84  -8.959   0.316 -15.375
  630    HE2  PHE  84           HE2      PHE  84  -6.806   3.966 -16.078
  631    HZ   PHE  84           HZ       PHE  84  -8.689   2.755 -15.012
  632    H    ASP  85           H        ASP  85  -1.951   0.074 -17.979
  633    HA   ASP  85           HA       ASP  85  -1.396   1.389 -15.360
  634   1HB   ASP  85          2HB       ASP  85   0.703   1.123 -17.472
  635   2HB   ASP  85          1HB       ASP  85   0.853   0.998 -15.719
  636    H    ALA  86           H        ALA  86  -0.455   3.549 -15.395
  637    HA   ALA  86           HA       ALA  86  -0.977   5.058 -17.919
  638   1HB   ALA  86          1HB       ALA  86  -2.602   6.245 -16.912
  639   2HB   ALA  86          2HB       ALA  86  -1.458   6.760 -15.673
  640   3HB   ALA  86          3HB       ALA  86  -2.398   5.285 -15.447
  641    H    THR  87           H        THR  87   0.711   6.365 -18.483
  642    HA   THR  87           HA       THR  87   2.814   6.845 -16.408
  643    HB   THR  87           HB       THR  87   4.015   7.234 -18.886
  644    HG1  THR  87           HG1      THR  87   3.319   4.905 -19.604
  645   1HG2  THR  87          1HG2      THR  87   5.261   5.244 -18.337
  646   2HG2  THR  87          2HG2      THR  87   3.952   4.644 -17.321
  647   3HG2  THR  87          3HG2      THR  87   4.874   6.062 -16.824
  648    H    MET  88           H        MET  88   3.624   8.952 -16.226
  649    HA   MET  88           HA       MET  88   2.704  11.008 -18.141
  650   1HB   MET  88          2HB       MET  88   1.119  10.568 -15.983
  651   2HB   MET  88          1HB       MET  88   2.259  11.726 -15.296
  652   1HG   MET  88          2HG       MET  88   1.792  12.969 -17.622
  653   2HG   MET  88          1HG       MET  88   0.266  12.096 -17.484
  654   1HE   MET  88          1HE       MET  88  -1.678  14.637 -15.841
  655   2HE   MET  88          2HE       MET  88  -1.549  13.161 -16.794
  656   3HE   MET  88          3HE       MET  88  -0.873  14.664 -17.415
  657    H    GLN  89           H        GLN  89   4.527  12.152 -18.573
  658    HA   GLN  89           HA       GLN  89   6.850  12.059 -16.847
  659   1HB   GLN  89          2HB       GLN  89   6.480  14.168 -18.959
  660   2HB   GLN  89          1HB       GLN  89   7.943  13.294 -18.506
  661   1HG   GLN  89          2HG       GLN  89   5.547  12.063 -19.900
  662   2HG   GLN  89          1HG       GLN  89   7.051  12.530 -20.692
  663   1HE2  GLN  89          1HE2      GLN  89   6.716   9.957 -21.086
  664   2HE2  GLN  89          2HE2      GLN  89   7.562   8.977 -19.989
  665    H    SER  90           H        SER  90   7.069  13.240 -15.004
  666    HA   SER  90           HA       SER  90   5.993  16.011 -14.971
  667   1HB   SER  90          2HB       SER  90   4.256  15.297 -13.699
  668   2HB   SER  90          1HB       SER  90   5.015  13.738 -13.387
  669    HG   SER  90           HG       SER  90   5.091  16.097 -11.943
  670    H    ALA  91           H        ALA  91   7.275  17.422 -13.787
  671    HA   ALA  91           HA       ALA  91   9.963  16.698 -13.199
  672   1HB   ALA  91          1HB       ALA  91   8.372  19.015 -12.055
  673   2HB   ALA  91          2HB       ALA  91   9.199  19.033 -13.613
  674   3HB   ALA  91          3HB       ALA  91  10.131  18.892 -12.122
  675    H    LEU  92           H        LEU  92  10.972  16.115 -11.258
  676    HA   LEU  92           HA       LEU  92   9.480  14.633  -9.353
  677   1HB   LEU  92          2HB       LEU  92  12.135  14.932  -9.881
  678   2HB   LEU  92          1HB       LEU  92  11.998  15.857  -8.385
  679    HG   LEU  92           HG       LEU  92  10.850  13.073  -8.674
  680   1HD1  LEU  92          1HD1      LEU  92  12.890  12.158  -8.407
  681   2HD1  LEU  92          2HD1      LEU  92  13.253  13.238  -7.061
  682   3HD1  LEU  92          3HD1      LEU  92  13.582  13.750  -8.717
  683   1HD2  LEU  92          1HD2      LEU  92  11.582  14.837  -6.314
  684   2HD2  LEU  92          2HD2      LEU  92  11.019  13.170  -6.181
  685   3HD2  LEU  92          3HD2      LEU  92   9.952  14.411  -6.838
  686    H    ASP  93           H        ASP  93   7.918  15.545  -8.098
  687    HA   ASP  93           HA       ASP  93   8.609  17.533  -6.121
  688   1HB   ASP  93          2HB       ASP  93   7.622  18.469  -8.683
  689   2HB   ASP  93          1HB       ASP  93   6.494  18.888  -7.393
  690    H    ALA  94           H        ALA  94   7.259  17.171  -4.410
  691    HA   ALA  94           HA       ALA  94   5.217  15.176  -4.521
  692   1HB   ALA  94          1HB       ALA  94   6.412  15.795  -2.441
  693   2HB   ALA  94          2HB       ALA  94   4.663  15.899  -2.236
  694   3HB   ALA  94          3HB       ALA  94   5.613  17.367  -2.460
  695    H    LYS  95           H        LYS  95   4.955  18.740  -4.279
  696    HA   LYS  95           HA       LYS  95   2.154  18.947  -4.283
  697   1HB   LYS  95          2HB       LYS  95   4.148  20.760  -4.291
  698   2HB   LYS  95          1HB       LYS  95   3.644  20.893  -5.976
  699   1HG   LYS  95          2HG       LYS  95   1.409  21.470  -5.365
  700   2HG   LYS  95          1HG       LYS  95   1.671  20.999  -3.686
  701   1HD   LYS  95          2HD       LYS  95   1.771  23.404  -3.773
  702   2HD   LYS  95          1HD       LYS  95   3.420  22.820  -3.544
  703   1HE   LYS  95          2HE       LYS  95   2.449  23.185  -6.345
  704   2HE   LYS  95          1HE       LYS  95   2.844  24.630  -5.415
  705   1HZ   LYS  95          1HZ       LYS  95   5.001  24.204  -5.588
  706   2HZ   LYS  95          2HZ       LYS  95   4.612  23.009  -6.730
  707   3HZ   LYS  95          3HZ       LYS  95   4.810  22.592  -5.095
  708    H    LEU  96           H        LEU  96   4.329  18.190  -6.929
  709    HA   LEU  96           HA       LEU  96   2.356  18.601  -9.020
  710   1HB   LEU  96          2HB       LEU  96   5.064  18.289  -9.019
  711   2HB   LEU  96          1HB       LEU  96   4.552  16.672  -9.502
  712    HG   LEU  96           HG       LEU  96   4.871  18.110 -11.476
  713   1HD1  LEU  96          1HD1      LEU  96   3.154  16.376 -11.597
  714   2HD1  LEU  96          2HD1      LEU  96   2.603  17.809 -12.468
  715   3HD1  LEU  96          3HD1      LEU  96   1.974  17.458 -10.858
  716   1HD2  LEU  96          1HD2      LEU  96   3.906  20.124  -9.880
  717   2HD2  LEU  96          2HD2      LEU  96   2.507  19.782 -10.896
  718   3HD2  LEU  96          3HD2      LEU  96   4.046  20.228 -11.634
  719    H    ILE  97           H        ILE  97   3.702  15.680  -7.450
  720    HA   ILE  97           HA       ILE  97   1.969  13.841  -8.799
  721    HB   ILE  97           HB       ILE  97   3.402  13.651  -6.135
  722   1HG1  ILE  97          2HG1      ILE  97   4.083  12.184  -8.674
  723   2HG1  ILE  97          1HG1      ILE  97   4.618  13.851  -8.451
  724   1HG2  ILE  97          1HG2      ILE  97   3.054  11.111  -6.699
  725   2HG2  ILE  97          2HG2      ILE  97   1.698  11.699  -7.662
  726   3HG2  ILE  97          3HG2      ILE  97   1.748  12.009  -5.926
  727   1HD1  ILE  97          1HD1      ILE  97   5.991  11.652  -7.552
  728   2HD1  ILE  97          2HD1      ILE  97   5.075  12.109  -6.115
  729   3HD1  ILE  97          3HD1      ILE  97   6.156  13.273  -6.880
  730    H    ASP  98           H        ASP  98   1.542  15.859  -5.961
  731    HA   ASP  98           HA       ASP  98  -0.758  14.495  -4.898
  732   1HB   ASP  98          2HB       ASP  98   0.171  15.967  -3.357
  733   2HB   ASP  98          1HB       ASP  98   0.458  17.215  -4.568
  734    H    GLU  99           H        GLU  99  -0.469  17.394  -6.979
  735    HA   GLU  99           HA       GLU  99  -3.251  17.817  -7.340
  736   1HB   GLU  99          2HB       GLU  99  -0.968  18.360  -9.264
  737   2HB   GLU  99          1HB       GLU  99  -2.594  19.028  -9.411
  738   1HG   GLU  99          2HG       GLU  99  -1.505  19.439  -6.740
  739   2HG   GLU  99          1HG       GLU  99  -0.470  20.149  -7.980
  740    H    GLN 100           H        GLN 100  -0.968  15.919  -9.339
  741    HA   GLN 100           HA       GLN 100  -2.936  15.031 -11.221
  742   1HB   GLN 100          2HB       GLN 100  -0.165  14.272 -10.483
  743   2HB   GLN 100          1HB       GLN 100  -1.121  13.010 -11.260
  744   1HG   GLN 100          2HG       GLN 100   0.206  14.577 -12.811
  745   2HG   GLN 100          1HG       GLN 100  -1.499  14.333 -13.195
  746   1HE2  GLN 100          1HE2      GLN 100  -1.482  16.495 -14.269
  747   2HE2  GLN 100          2HE2      GLN 100  -1.551  17.905 -13.326
  748    H    VAL 101           H        VAL 101  -1.729  13.601  -8.189
  749    HA   VAL 101           HA       VAL 101  -3.137  11.142  -8.345
  750    HB   VAL 101           HB       VAL 101  -2.022  12.808  -6.124
  751   1HG1  VAL 101          1HG1      VAL 101  -3.941  12.174  -4.948
  752   2HG1  VAL 101          2HG1      VAL 101  -2.854  10.826  -4.614
  753   3HG1  VAL 101          3HG1      VAL 101  -4.111  10.662  -5.841
  754   1HG2  VAL 101          1HG2      VAL 101  -0.672  10.844  -5.766
  755   2HG2  VAL 101          2HG2      VAL 101  -0.721  11.122  -7.507
  756   3HG2  VAL 101          3HG2      VAL 101  -1.726   9.865  -6.786
  757    H    GLU 102           H        GLU 102  -4.120  14.033  -6.459
  758    HA   GLU 102           HA       GLU 102  -6.682  13.247  -5.743
  759   1HB   GLU 102          2HB       GLU 102  -5.718  15.973  -6.645
  760   2HB   GLU 102          1HB       GLU 102  -7.301  15.697  -5.919
  761   1HG   GLU 102          2HG       GLU 102  -5.767  14.426  -4.102
  762   2HG   GLU 102          1HG       GLU 102  -4.604  15.627  -4.666
  763    H    LYS 103           H        LYS 103  -5.720  14.716  -8.852
  764    HA   LYS 103           HA       LYS 103  -8.280  14.870 -10.030
  765   1HB   LYS 103          2HB       LYS 103  -5.528  14.429 -11.187
  766   2HB   LYS 103          1HB       LYS 103  -6.955  14.507 -12.221
  767   1HG   LYS 103          2HG       LYS 103  -6.735  16.660 -10.198
  768   2HG   LYS 103          1HG       LYS 103  -5.525  16.698 -11.482
  769   1HD   LYS 103          2HD       LYS 103  -7.151  16.890 -13.177
  770   2HD   LYS 103          1HD       LYS 103  -8.447  16.329 -12.119
  771   1HE   LYS 103          2HE       LYS 103  -7.920  18.443 -10.707
  772   2HE   LYS 103          1HE       LYS 103  -7.074  19.011 -12.146
  773   1HZ   LYS 103          1HZ       LYS 103  -9.496  19.639 -11.933
  774   2HZ   LYS 103          2HZ       LYS 103  -9.855  18.008 -12.248
  775   3HZ   LYS 103          3HZ       LYS 103  -9.029  18.938 -13.406
  776    H    LEU 104           H        LEU 104  -5.908  12.204 -10.390
  777    HA   LEU 104           HA       LEU 104  -7.679  10.465 -11.791
  778   1HB   LEU 104          2HB       LEU 104  -5.396   9.688  -9.953
  779   2HB   LEU 104          1HB       LEU 104  -6.095   8.696 -11.234
  780    HG   LEU 104           HG       LEU 104  -4.754  11.381 -11.665
  781   1HD1  LEU 104          1HD1      LEU 104  -3.437   9.130 -11.001
  782   2HD1  LEU 104          2HD1      LEU 104  -2.797  10.286 -12.170
  783   3HD1  LEU 104          3HD1      LEU 104  -3.631   8.836 -12.730
  784   1HD2  LEU 104          1HD2      LEU 104  -6.048   9.338 -13.469
  785   2HD2  LEU 104          2HD2      LEU 104  -4.807  10.430 -14.084
  786   3HD2  LEU 104          3HD2      LEU 104  -6.305  11.082 -13.421
  787    H    VAL 105           H        VAL 105  -7.183  11.007  -8.332
  788    HA   VAL 105           HA       VAL 105  -8.676   8.724  -7.433
  789    HB   VAL 105           HB       VAL 105  -7.899  11.352  -6.182
  790   1HG1  VAL 105          1HG1      VAL 105  -9.745   9.224  -5.079
  791   2HG1  VAL 105          2HG1      VAL 105 -10.039  10.959  -5.193
  792   3HG1  VAL 105          3HG1      VAL 105  -8.858  10.338  -4.040
  793   1HG2  VAL 105          1HG2      VAL 105  -6.713   9.729  -4.640
  794   2HG2  VAL 105          2HG2      VAL 105  -6.153   9.687  -6.312
  795   3HG2  VAL 105          3HG2      VAL 105  -7.235   8.431  -5.712
  796    H    ASN 106           H        ASN 106  -9.623  12.118  -8.016
  797    HA   ASN 106           HA       ASN 106 -12.349  11.804  -7.212
  798   1HB   ASN 106          2HB       ASN 106 -11.242  13.698  -9.306
  799   2HB   ASN 106          1HB       ASN 106 -12.758  13.881  -8.422
  800   1HD2  ASN 106          1HD2      ASN 106 -10.336  12.526  -6.430
  801   2HD2  ASN 106          2HD2      ASN 106  -9.870  13.946  -5.626
  802    H    LEU 107           H        LEU 107 -10.965  11.853 -10.521
  803    HA   LEU 107           HA       LEU 107 -13.354  11.118 -11.860
  804   1HB   LEU 107          2HB       LEU 107 -11.286  11.951 -12.983
  805   2HB   LEU 107          1HB       LEU 107 -10.520  10.395 -12.658
  806    HG   LEU 107           HG       LEU 107 -12.657   9.416 -13.834
  807   1HD1  LEU 107          1HD1      LEU 107 -13.928  11.447 -14.064
  808   2HD1  LEU 107          2HD1      LEU 107 -13.379  11.004 -15.680
  809   3HD1  LEU 107          3HD1      LEU 107 -12.560  12.289 -14.793
  810   1HD2  LEU 107          1HD2      LEU 107 -10.639   8.972 -14.910
  811   2HD2  LEU 107          2HD2      LEU 107 -10.215  10.679 -15.039
  812   3HD2  LEU 107          3HD2      LEU 107 -11.435   9.990 -16.110
  813    H    ALA 108           H        ALA 108 -10.703   9.042 -10.652
  814    HA   ALA 108           HA       ALA 108 -11.619   6.549 -11.501
  815   1HB   ALA 108          1HB       ALA 108 -10.599   5.660  -9.351
  816   2HB   ALA 108          2HB       ALA 108 -10.331   7.337  -8.876
  817   3HB   ALA 108          3HB       ALA 108  -9.535   6.689 -10.311
  818    H    GLU 109           H        GLU 109 -12.655   8.343  -8.591
  819    HA   GLU 109           HA       GLU 109 -14.614   6.303  -7.875
  820   1HB   GLU 109          2HB       GLU 109 -13.384   8.237  -6.445
  821   2HB   GLU 109          1HB       GLU 109 -14.893   9.068  -6.818
  822   1HG   GLU 109          2HG       GLU 109 -14.525   6.448  -5.360
  823   2HG   GLU 109          1HG       GLU 109 -15.306   7.917  -4.775
  824    H    LYS 110           H        LYS 110 -14.574   9.179  -9.850
  825    HA   LYS 110           HA       LYS 110 -17.377   9.736  -9.875
  826   1HB   LYS 110          2HB       LYS 110 -15.382  11.097 -10.869
  827   2HB   LYS 110          1HB       LYS 110 -15.637  10.103 -12.304
  828   1HG   LYS 110          2HG       LYS 110 -18.116  10.770 -12.118
  829   2HG   LYS 110          1HG       LYS 110 -17.571  12.016 -10.994
  830   1HD   LYS 110          2HD       LYS 110 -16.099  12.965 -12.689
  831   2HD   LYS 110          1HD       LYS 110 -16.506  11.665 -13.810
  832   1HE   LYS 110          2HE       LYS 110 -17.822  14.116 -13.592
  833   2HE   LYS 110          1HE       LYS 110 -18.416  12.689 -14.442
  834   1HZ   LYS 110          1HZ       LYS 110 -18.874  13.298 -11.571
  835   2HZ   LYS 110          2HZ       LYS 110 -19.464  11.942 -12.408
  836   3HZ   LYS 110          3HZ       LYS 110 -20.014  13.497 -12.812
  837    H    PHE 111           H        PHE 111 -15.419   7.371 -11.610
  838    HA   PHE 111           HA       PHE 111 -17.810   6.543 -13.173
  839   1HB   PHE 111          2HB       PHE 111 -14.872   6.228 -13.482
  840   2HB   PHE 111          1HB       PHE 111 -15.861   4.871 -14.023
  841    HD1  PHE 111           HD1      PHE 111 -18.018   5.560 -15.419
  842    HD2  PHE 111           HD2      PHE 111 -14.499   7.982 -14.975
  843    HE1  PHE 111           HE1      PHE 111 -18.620   6.811 -17.474
  844    HE2  PHE 111           HE2      PHE 111 -15.099   9.232 -17.032
  845    HZ   PHE 111           HZ       PHE 111 -17.160   8.646 -18.281
  846    H    ASP 112           H        ASP 112 -15.173   4.563 -11.815
  847    HA   ASP 112           HA       ASP 112 -16.472   3.335  -9.689
  848   1HB   ASP 112          2HB       ASP 112 -17.606   2.541 -12.280
  849   2HB   ASP 112          1HB       ASP 112 -17.091   1.172 -11.294
  850    H    ILE 113           H        ILE 113 -13.813   3.871 -10.724
  851    HA   ILE 113           HA       ILE 113 -12.726   1.082 -10.761
  852    HB   ILE 113           HB       ILE 113 -10.750   2.040 -11.940
  853   1HG1  ILE 113          2HG1      ILE 113 -12.465   4.544 -12.014
  854   2HG1  ILE 113          1HG1      ILE 113 -10.966   4.352 -11.104
  855   1HG2  ILE 113          1HG2      ILE 113 -13.089   2.919 -13.571
  856   2HG2  ILE 113          2HG2      ILE 113 -13.072   1.246 -13.017
  857   3HG2  ILE 113          3HG2      ILE 113 -11.748   1.859 -14.008
  858   1HD1  ILE 113          1HD1      ILE 113  -9.796   3.847 -13.274
  859   2HD1  ILE 113          2HD1      ILE 113 -10.438   5.487 -13.177
  860   3HD1  ILE 113          3HD1      ILE 113 -11.289   4.260 -14.116
  861    H    ILE 114           H        ILE 114 -11.213   0.583  -9.202
  862    HA   ILE 114           HA       ILE 114 -10.820   2.563  -7.058
  863    HB   ILE 114           HB       ILE 114 -11.261   0.426  -6.190
  864   1HG1  ILE 114          2HG1      ILE 114  -9.223  -0.261  -5.075
  865   2HG1  ILE 114          1HG1      ILE 114  -8.231   0.480  -6.331
  866   1HG2  ILE 114          1HG2      ILE 114  -9.755  -1.544  -7.082
  867   2HG2  ILE 114          2HG2      ILE 114  -9.560  -0.496  -8.486
  868   3HG2  ILE 114          3HG2      ILE 114 -11.169  -1.034  -8.005
  869   1HD1  ILE 114          1HD1      ILE 114 -10.201   2.246  -4.970
  870   2HD1  ILE 114          2HD1      ILE 114  -8.572   2.608  -5.538
  871   3HD1  ILE 114          3HD1      ILE 114  -8.805   1.738  -4.022
  872    H    TYR 115           H        TYR 115  -9.172   3.992  -7.283
  873    HA   TYR 115           HA       TYR 115  -6.743   3.157  -8.786
  874   1HB   TYR 115          2HB       TYR 115  -7.465   5.225  -9.626
  875   2HB   TYR 115          1HB       TYR 115  -7.946   5.812  -8.034
  876    HD1  TYR 115           HD1      TYR 115  -6.664   7.785  -7.779
  877    HD2  TYR 115           HD2      TYR 115  -4.755   4.136  -8.999
  878    HE1  TYR 115           HE1      TYR 115  -4.443   8.853  -7.498
  879    HE2  TYR 115           HE2      TYR 115  -2.534   5.204  -8.717
  880    HH   TYR 115           HH       TYR 115  -1.805   7.976  -8.796
  881    H    ASP 116           H        ASP 116  -5.423   2.077  -7.342
  882    HA   ASP 116           HA       ASP 116  -4.357   3.654  -5.090
  883   1HB   ASP 116          2HB       ASP 116  -6.392   2.242  -4.314
  884   2HB   ASP 116          1HB       ASP 116  -5.322   0.855  -4.524
  885    H    GLY 117           H        GLY 117  -2.407   3.568  -6.343
  886   1HA   GLY 117          2HA       GLY 117  -0.499   1.681  -5.694
  887   2HA   GLY 117          1HA       GLY 117  -1.261   1.008  -7.137
  888    H    TRP 118           H        TRP 118   0.265   4.005  -5.937
  889    HA   TRP 118           HA       TRP 118   1.043   4.604  -8.756
  890   1HB   TRP 118          2HB       TRP 118   0.944   6.861  -8.262
  891   2HB   TRP 118          1HB       TRP 118  -0.267   6.262  -7.131
  892    HD1  TRP 118           HD1      TRP 118   0.434   6.060  -4.558
  893    HE1  TRP 118           HE1      TRP 118   2.276   7.243  -3.196
  894    HE3  TRP 118           HE3      TRP 118   3.334   7.845  -8.363
  895    HZ2  TRP 118           HZ2      TRP 118   4.664   8.747  -3.661
  896    HZ3  TRP 118           HZ3      TRP 118   5.384   9.148  -7.876
  897    HH2  TRP 118           HH2      TRP 118   6.054   9.600  -5.532
  898    H    GLY 119           H        GLY 119   3.174   4.434  -9.284
  899   1HA   GLY 119          2HA       GLY 119   5.211   4.662  -7.135
  900   2HA   GLY 119          1HA       GLY 119   5.188   3.181  -8.095
  901    H    THR 120           H        THR 120   7.180   5.485  -7.899
  902    HA   THR 120           HA       THR 120   7.130   6.420 -10.725
  903    HB   THR 120           HB       THR 120   7.490   8.210  -9.161
  904    HG1  THR 120           HG1      THR 120   9.194   8.972 -10.153
  905   1HG2  THR 120          1HG2      THR 120   9.975   7.385  -7.948
  906   2HG2  THR 120          2HG2      THR 120   8.721   6.190  -7.621
  907   3HG2  THR 120          3HG2      THR 120   8.471   7.875  -7.168
  908    H    TYR 121           H        TYR 121   9.553   6.606 -11.591
  909    HA   TYR 121           HA       TYR 121  11.011   4.091 -10.925
  910   1HB   TYR 121          2HB       TYR 121  10.061   3.337 -12.889
  911   2HB   TYR 121          1HB       TYR 121   9.885   4.960 -13.552
  912    HD1  TYR 121           HD1      TYR 121  11.263   5.503 -15.341
  913    HD2  TYR 121           HD2      TYR 121  12.656   2.692 -12.409
  914    HE1  TYR 121           HE1      TYR 121  13.366   5.212 -16.620
  915    HE2  TYR 121           HE2      TYR 121  14.761   2.401 -13.688
  916    HH   TYR 121           HH       TYR 121  15.280   4.098 -16.780
  917    H    TYR 122           H        TYR 122  13.177   4.442 -10.679
  918    HA   TYR 122           HA       TYR 122  14.302   7.028 -10.622
  919   1HB   TYR 122          2HB       TYR 122  15.170   4.522  -9.929
  920   2HB   TYR 122          1HB       TYR 122  16.193   4.874 -11.322
  921    HD1  TYR 122           HD1      TYR 122  15.627   5.500  -7.831
  922    HD2  TYR 122           HD2      TYR 122  17.413   7.142 -11.376
  923    HE1  TYR 122           HE1      TYR 122  17.016   7.005  -6.434
  924    HE2  TYR 122           HE2      TYR 122  18.802   8.648  -9.978
  925    HH   TYR 122           HH       TYR 122  18.186   9.250  -6.758
  926    H    GLU 123           H        GLU 123  15.682   8.140 -12.102
  927    HA   GLU 123           HA       GLU 123  14.975   7.753 -14.901
  928   1HB   GLU 123          2HB       GLU 123  15.432   9.988 -13.721
  929   2HB   GLU 123          1HB       GLU 123  17.143   9.574 -13.837
  930   1HG   GLU 123          2HG       GLU 123  15.969   9.091 -16.393
  931   2HG   GLU 123          1HG       GLU 123  15.447  10.689 -15.860
  932    H    GLY 124           H        GLY 124  16.267   5.451 -13.914
  933   1HA   GLY 124          2HA       GLY 124  17.803   4.191 -15.468
  934   2HA   GLY 124          1HA       GLY 124  18.884   5.583 -15.363
  935    H    LEU 125           H        LEU 125  20.041   3.259 -14.700
  936    HA   LEU 125           HA       LEU 125  20.184   3.387 -11.716
  937   1HB   LEU 125          2HB       LEU 125  20.468   0.870 -13.382
  938   2HB   LEU 125          1HB       LEU 125  20.474   0.979 -11.621
  939    HG   LEU 125           HG       LEU 125  18.127   1.961 -13.248
  940   1HD1  LEU 125          1HD1      LEU 125  17.980  -0.698 -11.921
  941   2HD1  LEU 125          2HD1      LEU 125  18.896  -0.627 -13.427
  942   3HD1  LEU 125          3HD1      LEU 125  17.203  -0.134 -13.399
  943   1HD2  LEU 125          1HD2      LEU 125  16.969   1.452 -11.065
  944   2HD2  LEU 125          2HD2      LEU 125  18.193   2.715 -10.948
  945   3HD2  LEU 125          3HD2      LEU 125  18.550   1.086 -10.376
  946    H    GLU 126           H        GLU 126  22.290   3.213 -10.862
  947    HA   GLU 126           HA       GLU 126  24.501   2.995 -12.861
  948   1HB   GLU 126          2HB       GLU 126  24.420   4.938 -10.534
  949   2HB   GLU 126          1HB       GLU 126  25.687   4.807 -11.753
  950   1HG   GLU 126          2HG       GLU 126  23.342   5.101 -13.239
  951   2HG   GLU 126          1HG       GLU 126  23.141   6.217 -11.888
  952    H    HIS 127           H        HIS 127  24.486   0.728 -11.973
  953    HA   HIS 127           HA       HIS 127  26.452   0.499  -9.832
  954   1HB   HIS 127          2HB       HIS 127  23.758  -0.786  -9.334
  955   2HB   HIS 127          1HB       HIS 127  25.122  -0.668  -8.224
  956    HD2  HIS 127           HD2      HIS 127  25.094   1.619  -6.641
  957    HE1  HIS 127           HE1      HIS 127  22.092   3.723  -8.737
  958    HE2  HIS 127           HE2      HIS 127  23.589   3.748  -6.691
  959    H    HIS 128           H        HIS 128  24.819  -0.642 -12.540
  960    HA   HIS 128           HA       HIS 128  25.475  -3.475 -12.193
  961   1HB   HIS 128          2HB       HIS 128  23.985  -1.840 -14.096
  962   2HB   HIS 128          1HB       HIS 128  25.002  -3.032 -14.908
  963    HD2  HIS 128           HD2      HIS 128  23.669  -5.431 -15.126
  964    HE1  HIS 128           HE1      HIS 128  21.247  -5.111 -11.681
  965    HE2  HIS 128           HE2      HIS 128  21.823  -6.567 -13.676
  966    H    HIS 129           H        HIS 129  26.937  -4.591 -13.749
  967    HA   HIS 129           HA       HIS 129  29.117  -2.836 -14.780
  968   1HB   HIS 129          2HB       HIS 129  30.465  -5.082 -13.912
  969   2HB   HIS 129          1HB       HIS 129  30.393  -3.548 -13.042
  970    HD2  HIS 129           HD2      HIS 129  27.464  -6.237 -13.207
  971    HE1  HIS 129           HE1      HIS 129  28.551  -5.627  -9.172
  972    HE2  HIS 129           HE2      HIS 129  26.929  -6.814 -10.720
  973    H    HIS 130           H        HIS 130  30.041  -3.596 -16.701
  974    HA   HIS 130           HA       HIS 130  29.028  -6.221 -17.710
  975   1HB   HIS 130          2HB       HIS 130  27.907  -4.079 -18.680
  976   2HB   HIS 130          1HB       HIS 130  29.434  -3.858 -19.536
  977    HD2  HIS 130           HD2      HIS 130  27.699  -7.394 -19.041
  978    HE1  HIS 130           HE1      HIS 130  27.888  -6.533 -23.171
  979    HE2  HIS 130           HE2      HIS 130  27.273  -8.293 -21.452
  980    H    HIS 131           H        HIS 131  30.391  -6.861 -19.739
  981    HA   HIS 131           HA       HIS 131  33.086  -5.807 -19.921
  982   1HB   HIS 131          2HB       HIS 131  32.511  -8.098 -18.123
  983   2HB   HIS 131          1HB       HIS 131  33.890  -8.296 -19.204
  984    HD2  HIS 131           HD2      HIS 131  35.437  -5.547 -19.094
  985    HE1  HIS 131           HE1      HIS 131  34.902  -5.549 -14.904
  986    HE2  HIS 131           HE2      HIS 131  36.219  -4.536 -16.819
  987    H    HIS 132           HN       HIS 132  32.454  -9.248 -20.151
  988    HA   HIS 132           HA       HIS 132  33.371  -9.682 -22.705
  989   1HB   HIS 132          2HB       HIS 132  31.187 -11.343 -22.705
  990   2HB   HIS 132          1HB       HIS 132  32.713 -11.704 -21.896
  991    HD2  HIS 132           HD2      HIS 132  29.630  -9.459 -20.685
  992    HE1  HIS 132           HE1      HIS 132  30.771 -12.082 -17.577
  993    HE2  HIS 132           HE2      HIS 132  29.179 -10.219 -18.231
  Start of MODEL   14
    1   1H    MET   1          1H        MET   1 -15.750  23.182   2.451
    2   2H    MET   1          2H        MET   1 -15.506  21.843   1.435
    3   3H    MET   1          3H        MET   1 -15.158  23.411   0.878
    4    HA   MET   1           HA       MET   1 -13.254  21.846   1.693
    5   1HB   MET   1          2HB       MET   1 -13.441  24.746   2.563
    6   2HB   MET   1          1HB       MET   1 -11.963  23.836   2.255
    7   1HG   MET   1          2HG       MET   1 -13.726  23.637  -0.024
    8   2HG   MET   1          1HG       MET   1 -13.462  25.333   0.386
    9   1HE   MET   1          1HE       MET   1 -11.112  24.863  -2.538
   10   2HE   MET   1          2HE       MET   1 -12.790  25.057  -2.033
   11   3HE   MET   1          3HE       MET   1 -12.161  23.448  -2.375
   12    H    SER   2           H        SER   2 -15.472  23.356   3.960
   13    HA   SER   2           HA       SER   2 -14.533  21.560   6.076
   14   1HB   SER   2          2HB       SER   2 -14.349  23.716   7.609
   15   2HB   SER   2          1HB       SER   2 -12.962  23.158   6.677
   16    HG   SER   2           HG       SER   2 -13.339  24.718   5.184
   17    H    HIS   3           H        HIS   3 -17.021  22.270   4.544
   18    HA   HIS   3           HA       HIS   3 -18.757  22.743   6.927
   19   1HB   HIS   3          2HB       HIS   3 -20.318  23.866   5.121
   20   2HB   HIS   3          1HB       HIS   3 -19.018  24.801   5.863
   21    HD2  HIS   3           HD2      HIS   3 -18.508  22.235   2.870
   22    HE1  HIS   3           HE1      HIS   3 -17.326  26.084   1.596
   23    HE2  HIS   3           HE2      HIS   3 -17.444  23.635   0.944
   24    H    GLN   4           H        GLN   4 -18.002  20.221   5.763
   25    HA   GLN   4           HA       GLN   4 -20.684  19.171   5.211
   26   1HB   GLN   4          2HB       GLN   4 -19.293  19.961   3.004
   27   2HB   GLN   4          1HB       GLN   4 -18.731  18.296   3.164
   28   1HG   GLN   4          2HG       GLN   4 -21.571  19.280   2.846
   29   2HG   GLN   4          1HG       GLN   4 -20.684  18.163   1.811
   30   1HE2  GLN   4          1HE2      GLN   4 -20.260  15.961   2.685
   31   2HE2  GLN   4          2HE2      GLN   4 -21.234  15.340   3.929
   32    H    ASP   5           H        ASP   5 -20.790  16.926   5.649
   33    HA   ASP   5           HA       ASP   5 -18.305  15.428   6.114
   34   1HB   ASP   5          2HB       ASP   5 -18.542  16.610   8.241
   35   2HB   ASP   5          1HB       ASP   5 -20.216  16.069   8.380
   36    H    ASP   6           H        ASP   6 -18.697  13.393   5.408
   37    HA   ASP   6           HA       ASP   6 -21.216  12.037   6.038
   38   1HB   ASP   6          2HB       ASP   6 -21.925  13.238   4.047
   39   2HB   ASP   6          1HB       ASP   6 -20.479  12.722   3.176
   40    H    TYR   7           H        TYR   7 -19.657  10.622   7.089
   41    HA   TYR   7           HA       TYR   7 -18.001   8.929   7.146
   42   1HB   TYR   7          2HB       TYR   7 -20.263   8.060   5.945
   43   2HB   TYR   7          1HB       TYR   7 -19.115   7.799   4.631
   44    HD1  TYR   7           HD1      TYR   7 -16.753   6.787   5.500
   45    HD2  TYR   7           HD2      TYR   7 -20.559   6.293   7.431
   46    HE1  TYR   7           HE1      TYR   7 -15.911   4.752   6.638
   47    HE2  TYR   7           HE2      TYR   7 -19.715   4.256   8.569
   48    HH   TYR   7           HH       TYR   7 -17.624   3.244   9.210
   49    H    LEU   8           H        LEU   8 -16.275  10.470   6.513
   50    HA   LEU   8           HA       LEU   8 -15.511  10.912   3.798
   51   1HB   LEU   8          2HB       LEU   8 -14.160  11.140   6.457
   52   2HB   LEU   8          1HB       LEU   8 -13.153  11.172   5.009
   53    HG   LEU   8           HG       LEU   8 -14.521  13.004   4.090
   54   1HD1  LEU   8          1HD1      LEU   8 -16.153  14.105   5.705
   55   2HD1  LEU   8          2HD1      LEU   8 -16.024  12.652   6.694
   56   3HD1  LEU   8          3HD1      LEU   8 -16.670  12.549   5.056
   57   1HD2  LEU   8          1HD2      LEU   8 -13.397  13.369   6.878
   58   2HD2  LEU   8          2HD2      LEU   8 -13.949  14.726   5.895
   59   3HD2  LEU   8          3HD2      LEU   8 -12.610  13.723   5.339
   60    H    SER   9           H        SER   9 -13.488  10.017   2.791
   61    HA   SER   9           HA       SER   9 -12.371   7.518   3.667
   62   1HB   SER   9          2HB       SER   9 -14.152   7.196   1.259
   63   2HB   SER   9          1HB       SER   9 -13.439   5.948   2.275
   64    HG   SER   9           HG       SER   9 -14.941   6.296   3.779
   65    H    VAL  10           H        VAL  10 -13.297   9.208   0.645
   66    HA   VAL  10           HA       VAL  10 -10.991   8.505  -0.845
   67    HB   VAL  10           HB       VAL  10 -12.121  11.244  -1.199
   68   1HG1  VAL  10          1HG1      VAL  10 -10.564  10.361  -2.841
   69   2HG1  VAL  10          2HG1      VAL  10 -12.166  10.429  -3.573
   70   3HG1  VAL  10          3HG1      VAL  10 -11.519   8.888  -3.011
   71   1HG2  VAL  10          1HG2      VAL  10 -13.696   8.672  -1.504
   72   2HG2  VAL  10          2HG2      VAL  10 -14.140  10.173  -2.317
   73   3HG2  VAL  10          3HG2      VAL  10 -14.135  10.093  -0.555
   74    H    GLU  11           H        GLU  11 -11.454  10.861   1.693
   75    HA   GLU  11           HA       GLU  11  -9.050  12.385   1.155
   76   1HB   GLU  11          2HB       GLU  11 -11.228  12.648   2.864
   77   2HB   GLU  11          1HB       GLU  11  -9.887  12.308   3.959
   78   1HG   GLU  11          2HG       GLU  11  -8.576  14.121   2.937
   79   2HG   GLU  11          1HG       GLU  11  -9.898  14.456   1.817
   80    H    GLU  12           H        GLU  12  -9.718   9.347   2.676
   81    HA   GLU  12           HA       GLU  12  -7.305   9.249   4.294
   82   1HB   GLU  12          2HB       GLU  12  -9.103   7.022   3.285
   83   2HB   GLU  12          1HB       GLU  12  -7.847   6.839   4.510
   84   1HG   GLU  12          2HG       GLU  12  -9.575   9.062   5.180
   85   2HG   GLU  12          1HG       GLU  12 -10.531   7.601   4.929
   86    H    LEU  13           H        LEU  13  -8.269   7.820   1.166
   87    HA   LEU  13           HA       LEU  13  -5.778   6.546   0.621
   88   1HB   LEU  13          2HB       LEU  13  -7.569   7.740  -1.500
   89   2HB   LEU  13          1HB       LEU  13  -6.568   6.292  -1.605
   90    HG   LEU  13           HG       LEU  13  -9.126   6.676  -0.042
   91   1HD1  LEU  13          1HD1      LEU  13  -9.180   5.944  -2.455
   92   2HD1  LEU  13          2HD1      LEU  13  -9.876   4.773  -1.334
   93   3HD1  LEU  13          3HD1      LEU  13  -8.256   4.517  -1.984
   94   1HD2  LEU  13          1HD2      LEU  13  -7.041   4.485   0.201
   95   2HD2  LEU  13          2HD2      LEU  13  -8.676   4.368   0.850
   96   3HD2  LEU  13          3HD2      LEU  13  -7.566   5.588   1.472
   97    H    ILE  14           H        ILE  14  -6.980   9.786  -0.282
   98    HA   ILE  14           HA       ILE  14  -4.659  10.590  -1.734
   99    HB   ILE  14           HB       ILE  14  -6.736  12.172  -0.204
  100   1HG1  ILE  14          2HG1      ILE  14  -6.252  11.962  -3.185
  101   2HG1  ILE  14          1HG1      ILE  14  -7.319  10.856  -2.321
  102   1HG2  ILE  14          1HG2      ILE  14  -5.274  13.898  -0.297
  103   2HG2  ILE  14          2HG2      ILE  14  -5.551  13.883  -2.039
  104   3HG2  ILE  14          3HG2      ILE  14  -4.178  13.012  -1.357
  105   1HD1  ILE  14          1HD1      ILE  14  -8.873  12.457  -2.886
  106   2HD1  ILE  14          2HD1      ILE  14  -7.679  13.753  -2.923
  107   3HD1  ILE  14          3HD1      ILE  14  -8.298  13.169  -1.379
  108    H    GLU  15           H        GLU  15  -5.570  11.315   1.657
  109    HA   GLU  15           HA       GLU  15  -3.221  12.650   2.419
  110   1HB   GLU  15          2HB       GLU  15  -5.232  10.976   3.872
  111   2HB   GLU  15          1HB       GLU  15  -3.747  11.417   4.718
  112   1HG   GLU  15          2HG       GLU  15  -4.169  13.800   4.205
  113   2HG   GLU  15          1HG       GLU  15  -5.667  13.353   3.389
  114    H    ILE  16           H        ILE  16  -3.878   9.145   2.779
  115    HA   ILE  16           HA       ILE  16  -1.411   8.314   3.760
  116    HB   ILE  16           HB       ILE  16  -3.348   7.023   1.848
  117   1HG1  ILE  16          2HG1      ILE  16  -2.425   6.283   4.643
  118   2HG1  ILE  16          1HG1      ILE  16  -3.845   7.273   4.304
  119   1HG2  ILE  16          1HG2      ILE  16  -1.855   4.920   2.473
  120   2HG2  ILE  16          2HG2      ILE  16  -0.587   6.138   2.603
  121   3HG2  ILE  16          3HG2      ILE  16  -1.453   5.926   1.081
  122   1HD1  ILE  16          1HD1      ILE  16  -3.516   4.373   4.106
  123   2HD1  ILE  16          2HD1      ILE  16  -4.189   5.081   2.637
  124   3HD1  ILE  16          3HD1      ILE  16  -4.995   5.331   4.185
  125    H    GLN  17           H        GLN  17  -2.237   9.146   0.411
  126    HA   GLN  17           HA       GLN  17   0.333   8.324  -0.655
  127   1HB   GLN  17          2HB       GLN  17  -2.137   9.476  -1.667
  128   2HB   GLN  17          1HB       GLN  17  -0.729  10.271  -2.371
  129   1HG   GLN  17          2HG       GLN  17  -1.340   8.338  -3.739
  130   2HG   GLN  17          1HG       GLN  17   0.207   8.034  -2.947
  131   1HE2  GLN  17          1HE2      GLN  17  -3.307   7.565  -2.218
  132   2HE2  GLN  17          2HE2      GLN  17  -3.101   6.032  -1.521
  133    H    LYS  18           H        LYS  18  -1.014  11.358   0.572
  134    HA   LYS  18           HA       LYS  18   1.065  13.101  -0.279
  135   1HB   LYS  18          2HB       LYS  18  -0.912  13.127   1.979
  136   2HB   LYS  18          1HB       LYS  18   0.380  14.328   1.955
  137   1HG   LYS  18          2HG       LYS  18  -0.306  14.851  -0.436
  138   2HG   LYS  18          1HG       LYS  18  -1.732  13.852  -0.159
  139   1HD   LYS  18          2HD       LYS  18  -2.135  15.312   1.924
  140   2HD   LYS  18          1HD       LYS  18  -0.955  16.421   1.226
  141   1HE   LYS  18          2HE       LYS  18  -2.313  16.934  -0.599
  142   2HE   LYS  18          1HE       LYS  18  -3.225  15.429  -0.472
  143   1HZ   LYS  18          1HZ       LYS  18  -4.105  16.297   1.676
  144   2HZ   LYS  18          2HZ       LYS  18  -4.608  17.169   0.308
  145   3HZ   LYS  18          3HZ       LYS  18  -3.387  17.791   1.314
  146    H    GLU  19           H        GLU  19   0.756  11.152   2.694
  147    HA   GLU  19           HA       GLU  19   3.246  12.048   3.832
  148   1HB   GLU  19          2HB       GLU  19   1.169  10.675   4.837
  149   2HB   GLU  19          1HB       GLU  19   2.228   9.316   4.458
  150   1HG   GLU  19          2HG       GLU  19   3.990  10.191   5.829
  151   2HG   GLU  19          1HG       GLU  19   3.160  11.737   6.015
  152    H    GLU  20           H        GLU  20   2.395   8.962   2.219
  153    HA   GLU  20           HA       GLU  20   5.006   7.886   2.140
  154   1HB   GLU  20          2HB       GLU  20   2.677   6.883   1.419
  155   2HB   GLU  20          1HB       GLU  20   3.136   7.485  -0.174
  156   1HG   GLU  20          2HG       GLU  20   4.160   5.442  -0.325
  157   2HG   GLU  20          1HG       GLU  20   5.451   6.282   0.535
  158    H    THR  21           H        THR  21   3.528  10.373   0.160
  159    HA   THR  21           HA       THR  21   5.434  10.284  -1.995
  160    HB   THR  21           HB       THR  21   3.819  12.650  -0.997
  161    HG1  THR  21           HG1      THR  21   2.314  11.943  -2.514
  162   1HG2  THR  21          1HG2      THR  21   5.486  12.095  -3.416
  163   2HG2  THR  21          2HG2      THR  21   5.289  13.596  -2.510
  164   3HG2  THR  21          3HG2      THR  21   4.022  13.059  -3.614
  165    H    ARG  22           H        ARG  22   5.203  12.461   0.844
  166    HA   ARG  22           HA       ARG  22   7.634  13.845   0.372
  167   1HB   ARG  22          2HB       ARG  22   5.872  13.372   2.720
  168   2HB   ARG  22          1HB       ARG  22   7.523  13.883   3.072
  169   1HG   ARG  22          2HG       ARG  22   7.265  15.931   1.999
  170   2HG   ARG  22          1HG       ARG  22   5.979  15.334   0.950
  171   1HD   ARG  22          2HD       ARG  22   5.248  16.916   2.819
  172   2HD   ARG  22          1HD       ARG  22   4.378  15.385   2.720
  173    HE   ARG  22           HE       ARG  22   6.443  14.852   4.485
  174   1HH1  ARG  22          1HH2      ARG  22   3.967  17.231   4.179
  175   2HH1  ARG  22          2HH2      ARG  22   3.803  17.473   5.887
  176   1HH2  ARG  22          2HH1      ARG  22   6.243  15.153   6.717
  177   2HH2  ARG  22          1HH1      ARG  22   5.091  16.295   7.323
  178    H    ASP  23           H        ASP  23   7.026  10.662   1.691
  179    HA   ASP  23           HA       ASP  23   9.664  10.336   2.865
  180   1HB   ASP  23          2HB       ASP  23   7.230   8.852   2.762
  181   2HB   ASP  23          1HB       ASP  23   8.510   7.811   2.138
  182    H    ILE  24           H        ILE  24   8.138   9.070  -0.121
  183    HA   ILE  24           HA       ILE  24  10.504   7.845  -1.142
  184    HB   ILE  24           HB       ILE  24   8.062   8.958  -2.550
  185   1HG1  ILE  24          2HG1      ILE  24   8.882   6.084  -2.074
  186   2HG1  ILE  24          1HG1      ILE  24   7.886   6.982  -0.928
  187   1HG2  ILE  24          1HG2      ILE  24  10.322   7.243  -3.629
  188   2HG2  ILE  24          2HG2      ILE  24   9.957   8.901  -4.110
  189   3HG2  ILE  24          3HG2      ILE  24   8.824   7.603  -4.490
  190   1HD1  ILE  24          1HD1      ILE  24   6.268   5.955  -2.264
  191   2HD1  ILE  24          2HD1      ILE  24   7.232   6.122  -3.732
  192   3HD1  ILE  24          3HD1      ILE  24   6.429   7.532  -3.039
  193    H    ILE  25           H        ILE  25   9.045  11.010  -2.004
  194    HA   ILE  25           HA       ILE  25  11.123  11.900  -3.693
  195    HB   ILE  25           HB       ILE  25   9.067  13.266  -1.998
  196   1HG1  ILE  25          2HG1      ILE  25   8.294  14.059  -4.128
  197   2HG1  ILE  25          1HG1      ILE  25   9.809  13.616  -4.914
  198   1HG2  ILE  25          1HG2      ILE  25  11.573  14.512  -3.088
  199   2HG2  ILE  25          2HG2      ILE  25  10.736  14.838  -1.570
  200   3HG2  ILE  25          3HG2      ILE  25  10.074  15.441  -3.090
  201   1HD1  ILE  25          1HD1      ILE  25   7.742  12.030  -5.166
  202   2HD1  ILE  25          2HD1      ILE  25   8.162  11.512  -3.532
  203   3HD1  ILE  25          3HD1      ILE  25   9.326  11.325  -4.844
  204    H    GLN  26           H        GLN  26  10.921  11.848  -0.173
  205    HA   GLN  26           HA       GLN  26  13.221  13.520   0.301
  206   1HB   GLN  26          2HB       GLN  26  11.957  13.300   2.227
  207   2HB   GLN  26          1HB       GLN  26  11.581  11.606   1.912
  208   1HG   GLN  26          2HG       GLN  26  13.175  11.979   3.838
  209   2HG   GLN  26          1HG       GLN  26  13.795  10.915   2.574
  210   1HE2  GLN  26          1HE2      GLN  26  15.912  11.404   2.010
  211   2HE2  GLN  26          2HE2      GLN  26  16.605  12.952   2.057
  212    H    ALA  27           H        ALA  27  12.864   9.956   0.525
  213    HA   ALA  27           HA       ALA  27  15.580   9.338   0.888
  214   1HB   ALA  27          1HB       ALA  27  14.624   7.301   0.947
  215   2HB   ALA  27          2HB       ALA  27  14.537   7.335  -0.814
  216   3HB   ALA  27          3HB       ALA  27  13.178   7.916   0.148
  217    H    LEU  28           H        LEU  28  13.813   9.530  -2.224
  218    HA   LEU  28           HA       LEU  28  16.049   9.046  -3.900
  219   1HB   LEU  28          2HB       LEU  28  13.404  10.390  -4.238
  220   2HB   LEU  28          1HB       LEU  28  14.623  10.661  -5.482
  221    HG   LEU  28           HG       LEU  28  14.305   7.852  -4.591
  222   1HD1  LEU  28          1HD1      LEU  28  12.128   9.425  -5.956
  223   2HD1  LEU  28          2HD1      LEU  28  11.988   8.248  -4.650
  224   3HD1  LEU  28          3HD1      LEU  28  12.336   7.705  -6.291
  225   1HD2  LEU  28          1HD2      LEU  28  14.809   7.406  -6.870
  226   2HD2  LEU  28          2HD2      LEU  28  15.786   8.819  -6.470
  227   3HD2  LEU  28          3HD2      LEU  28  14.289   9.011  -7.382
  228    H    LEU  29           H        LEU  29  14.729  12.159  -2.740
  229    HA   LEU  29           HA       LEU  29  16.557  13.876  -4.016
  230   1HB   LEU  29          2HB       LEU  29  14.955  14.012  -1.497
  231   2HB   LEU  29          1HB       LEU  29  16.228  15.212  -1.724
  232    HG   LEU  29           HG       LEU  29  14.069  14.612  -3.765
  233   1HD1  LEU  29          1HD1      LEU  29  13.099  15.624  -1.749
  234   2HD1  LEU  29          2HD1      LEU  29  13.127  16.800  -3.062
  235   3HD1  LEU  29          3HD1      LEU  29  14.328  16.887  -1.774
  236   1HD2  LEU  29          1HD2      LEU  29  16.517  16.253  -3.705
  237   2HD2  LEU  29          2HD2      LEU  29  15.083  17.129  -4.239
  238   3HD2  LEU  29          3HD2      LEU  29  15.591  15.668  -5.087
  239    H    GLU  30           H        GLU  30  16.886  12.198  -0.883
  240    HA   GLU  30           HA       GLU  30  19.513  13.248  -0.326
  241   1HB   GLU  30          2HB       GLU  30  17.690  11.258   0.829
  242   2HB   GLU  30          1HB       GLU  30  19.390  10.818   0.990
  243   1HG   GLU  30          2HG       GLU  30  19.899  12.931   2.060
  244   2HG   GLU  30          1HG       GLU  30  18.266  13.526   1.757
  245    H    ASP  31           H        ASP  31  18.322  10.487  -2.151
  246    HA   ASP  31           HA       ASP  31  20.762   9.024  -2.339
  247   1HB   ASP  31          2HB       ASP  31  18.267   9.208  -3.991
  248   2HB   ASP  31          1HB       ASP  31  19.667   8.374  -4.666
  249    H    GLY  32           H        GLY  32  19.521  11.784  -4.183
  250   1HA   GLY  32          2HA       GLY  32  21.391  13.328  -4.949
  251   2HA   GLY  32          1HA       GLY  32  22.156  11.879  -5.600
  252    H    SER  33           H        SER  33  18.737  11.913  -5.866
  253    HA   SER  33           HA       SER  33  18.636  11.610  -8.638
  254   1HB   SER  33          2HB       SER  33  16.741  11.586  -6.769
  255   2HB   SER  33          1HB       SER  33  16.479  13.232  -7.339
  256    HG   SER  33           HG       SER  33  16.806  11.655  -9.450
  257    H    ASP  34           H        ASP  34  17.283  13.473  -9.982
  258    HA   ASP  34           HA       ASP  34  18.610  16.096  -9.533
  259   1HB   ASP  34          2HB       ASP  34  19.142  14.214 -11.739
  260   2HB   ASP  34          1HB       ASP  34  18.771  15.857 -12.266
  261    HA   PRO  35           HA       PRO  35  14.086  16.564 -10.322
  262   1HB   PRO  35          2HB       PRO  35  14.791  19.225  -9.193
  263   2HB   PRO  35          1HB       PRO  35  13.471  18.126  -8.753
  264   1HG   PRO  35          2HG       PRO  35  15.630  18.444  -7.208
  265   2HG   PRO  35          1HG       PRO  35  14.784  16.893  -7.344
  266   1HD   PRO  35          2HD       PRO  35  17.404  17.717  -8.511
  267   2HD   PRO  35          1HD       PRO  35  16.851  16.109  -7.994
  268    H    ASP  36           H        ASP  36  16.884  18.305 -11.398
  269    HA   ASP  36           HA       ASP  36  15.333  20.047 -13.209
  270   1HB   ASP  36          2HB       ASP  36  17.727  20.658 -13.985
  271   2HB   ASP  36          1HB       ASP  36  17.254  21.129 -12.352
  272    H    ALA  37           H        ALA  37  15.777  16.908 -13.328
  273    HA   ALA  37           HA       ALA  37  16.450  16.888 -16.245
  274   1HB   ALA  37          1HB       ALA  37  17.700  15.482 -14.161
  275   2HB   ALA  37          2HB       ALA  37  17.883  15.183 -15.889
  276   3HB   ALA  37          3HB       ALA  37  16.675  14.291 -14.964
  277    H    LEU  38           H        LEU  38  13.814  17.226 -14.831
  278    HA   LEU  38           HA       LEU  38  11.620  16.415 -15.041
  279   1HB   LEU  38          2HB       LEU  38  13.013  15.317 -17.477
  280   2HB   LEU  38          1HB       LEU  38  11.324  14.924 -17.158
  281    HG   LEU  38           HG       LEU  38  12.343  17.771 -17.162
  282   1HD1  LEU  38          1HD1      LEU  38  11.181  16.162 -19.455
  283   2HD1  LEU  38          2HD1      LEU  38  12.804  16.844 -19.371
  284   3HD1  LEU  38          3HD1      LEU  38  11.404  17.911 -19.471
  285   1HD2  LEU  38          1HD2      LEU  38  10.250  17.952 -16.258
  286   2HD2  LEU  38          2HD2      LEU  38   9.733  16.389 -16.887
  287   3HD2  LEU  38          3HD2      LEU  38   9.731  17.805 -17.937
  288    H    TYR  39           H        TYR  39  10.307  14.413 -14.821
  289    HA   TYR  39           HA       TYR  39  11.878  11.988 -14.120
  290   1HB   TYR  39          2HB       TYR  39  10.829  13.763 -12.188
  291   2HB   TYR  39          1HB       TYR  39   9.743  12.373 -12.204
  292    HD1  TYR  39           HD1      TYR  39  13.344  13.339 -11.977
  293    HD2  TYR  39           HD2      TYR  39  10.386  10.316 -11.228
  294    HE1  TYR  39           HE1      TYR  39  15.018  12.014 -10.713
  295    HE2  TYR  39           HE2      TYR  39  12.060   8.991  -9.965
  296    HH   TYR  39           HH       TYR  39  15.305   9.477 -10.146
  297    H    GLU  40           H        GLU  40  10.250  10.122 -13.649
  298    HA   GLU  40           HA       GLU  40   7.895  10.436 -15.469
  299   1HB   GLU  40          2HB       GLU  40  10.059   8.854 -15.985
  300   2HB   GLU  40          1HB       GLU  40   9.015   7.720 -15.127
  301   1HG   GLU  40          2HG       GLU  40   7.137   8.461 -16.675
  302   2HG   GLU  40          1HG       GLU  40   8.365   9.298 -17.625
  303    H    ILE  41           H        ILE  41   5.967   9.947 -14.535
  304    HA   ILE  41           HA       ILE  41   6.015   8.331 -12.017
  305    HB   ILE  41           HB       ILE  41   4.314  10.733 -12.738
  306   1HG1  ILE  41          2HG1      ILE  41   5.277  11.530 -10.527
  307   2HG1  ILE  41          1HG1      ILE  41   6.351  10.130 -10.576
  308   1HG2  ILE  41          1HG2      ILE  41   4.050   8.706 -10.505
  309   2HG2  ILE  41          2HG2      ILE  41   2.825   9.182 -11.682
  310   3HG2  ILE  41          3HG2      ILE  41   3.325  10.312 -10.424
  311   1HD1  ILE  41          1HD1      ILE  41   6.326  11.603 -13.101
  312   2HD1  ILE  41          2HD1      ILE  41   7.696  11.094 -12.114
  313   3HD1  ILE  41          3HD1      ILE  41   6.854  12.600 -11.746
  314    H    GLU  42           H        GLU  42   4.744   6.528 -12.090
  315    HA   GLU  42           HA       GLU  42   2.749   6.355 -14.314
  316   1HB   GLU  42          2HB       GLU  42   3.104   3.860 -14.115
  317   2HB   GLU  42          1HB       GLU  42   4.517   4.752 -14.683
  318   1HG   GLU  42          2HG       GLU  42   5.537   4.679 -12.504
  319   2HG   GLU  42          1HG       GLU  42   4.064   4.039 -11.775
  320    H    HIS  43           H        HIS  43   0.696   5.505 -13.807
  321    HA   HIS  43           HA       HIS  43   0.173   5.116 -10.887
  322   1HB   HIS  43          2HB       HIS  43  -1.924   6.123 -12.794
  323   2HB   HIS  43          1HB       HIS  43  -1.824   6.331 -11.045
  324    HD2  HIS  43           HD2      HIS  43   0.581   7.503 -14.023
  325    HE1  HIS  43           HE1      HIS  43   0.187  10.630 -11.211
  326    HE2  HIS  43           HE2      HIS  43   1.268   9.941 -13.401
  327    H    HIS  44           H        HIS  44  -1.500   3.560 -10.382
  328    HA   HIS  44           HA       HIS  44  -2.064   1.662 -12.627
  329   1HB   HIS  44          2HB       HIS  44  -0.585   1.155 -10.324
  330   2HB   HIS  44          1HB       HIS  44  -2.178   0.503  -9.943
  331    HD2  HIS  44           HD2      HIS  44   0.631  -0.034 -12.693
  332    HE1  HIS  44           HE1      HIS  44  -1.987  -3.349 -12.754
  333    HE2  HIS  44           HE2      HIS  44   0.163  -2.394 -13.703
  334    H    LEU  45           H        LEU  45  -4.203   1.095 -12.890
  335    HA   LEU  45           HA       LEU  45  -6.114   1.664 -10.692
  336   1HB   LEU  45          2HB       LEU  45  -6.633   2.653 -13.503
  337   2HB   LEU  45          1HB       LEU  45  -7.545   3.022 -12.040
  338    HG   LEU  45           HG       LEU  45  -5.309   4.014 -11.162
  339   1HD1  LEU  45          1HD1      LEU  45  -4.479   3.077 -13.697
  340   2HD1  LEU  45          2HD1      LEU  45  -3.549   4.061 -12.567
  341   3HD1  LEU  45          3HD1      LEU  45  -4.519   4.836 -13.819
  342   1HD2  LEU  45          1HD2      LEU  45  -7.297   5.356 -11.735
  343   2HD2  LEU  45          2HD2      LEU  45  -6.825   5.339 -13.433
  344   3HD2  LEU  45          3HD2      LEU  45  -5.824   6.179 -12.249
  345    H    PHE  46           H        PHE  46  -7.980   0.352 -10.793
  346    HA   PHE  46           HA       PHE  46  -8.019  -1.635 -13.025
  347   1HB   PHE  46          2HB       PHE  46  -9.185  -2.750 -10.657
  348   2HB   PHE  46          1HB       PHE  46  -7.764  -3.305 -11.541
  349    HD1  PHE  46           HD1      PHE  46  -8.844  -2.257  -8.415
  350    HD2  PHE  46           HD2      PHE  46  -5.642  -1.610 -11.204
  351    HE1  PHE  46           HE1      PHE  46  -7.388  -1.480  -6.564
  352    HE2  PHE  46           HE2      PHE  46  -4.186  -0.833  -9.353
  353    HZ   PHE  46           HZ       PHE  46  -5.059  -0.768  -7.032
  354    H    ALA  47           H        ALA  47 -10.182  -2.591 -13.398
  355    HA   ALA  47           HA       ALA  47 -12.435  -0.969 -12.337
  356   1HB   ALA  47          1HB       ALA  47 -11.500  -0.138 -14.637
  357   2HB   ALA  47          2HB       ALA  47 -13.242  -0.328 -14.440
  358   3HB   ALA  47          3HB       ALA  47 -12.310  -1.566 -15.282
  359    H    GLU  48           H        GLU  48 -14.568  -2.022 -13.439
  360    HA   GLU  48           HA       GLU  48 -14.261  -4.960 -12.990
  361   1HB   GLU  48          2HB       GLU  48 -16.179  -2.980 -12.078
  362   2HB   GLU  48          1HB       GLU  48 -16.991  -4.304 -12.916
  363   1HG   GLU  48          2HG       GLU  48 -14.888  -4.791 -10.800
  364   2HG   GLU  48          1HG       GLU  48 -16.600  -4.626 -10.404
  365    H    ASP  49           H        ASP  49 -15.991  -2.588 -15.036
  366    HA   ASP  49           HA       ASP  49 -16.586  -4.794 -16.947
  367   1HB   ASP  49          2HB       ASP  49 -18.349  -3.079 -16.114
  368   2HB   ASP  49          1HB       ASP  49 -17.554  -1.952 -17.213
  369    H    PHE  50           H        PHE  50 -15.815  -4.742 -19.074
  370    HA   PHE  50           HA       PHE  50 -13.327  -3.394 -19.540
  371   1HB   PHE  50          2HB       PHE  50 -14.437  -4.054 -22.051
  372   2HB   PHE  50          1HB       PHE  50 -13.284  -5.005 -21.118
  373    HD1  PHE  50           HD1      PHE  50 -16.613  -4.867 -22.427
  374    HD2  PHE  50           HD2      PHE  50 -14.241  -6.541 -19.261
  375    HE1  PHE  50           HE1      PHE  50 -18.347  -6.599 -22.042
  376    HE2  PHE  50           HE2      PHE  50 -15.974  -8.272 -18.877
  377    HZ   PHE  50           HZ       PHE  50 -18.028  -8.301 -20.267
  378    H    ASP  51           H        ASP  51 -16.672  -2.572 -20.230
  379    HA   ASP  51           HA       ASP  51 -16.090  -0.418 -22.070
  380   1HB   ASP  51          2HB       ASP  51 -18.525  -0.666 -20.288
  381   2HB   ASP  51          1HB       ASP  51 -18.405   0.172 -21.835
  382    H    LYS  52           H        LYS  52 -17.526  -0.091 -18.809
  383    HA   LYS  52           HA       LYS  52 -17.003   2.562 -18.317
  384   1HB   LYS  52          2HB       LYS  52 -18.080   1.042 -16.677
  385   2HB   LYS  52          1HB       LYS  52 -16.509   0.319 -16.332
  386   1HG   LYS  52          2HG       LYS  52 -16.497   1.892 -14.664
  387   2HG   LYS  52          1HG       LYS  52 -15.880   2.916 -15.960
  388   1HD   LYS  52          2HD       LYS  52 -17.693   4.104 -14.894
  389   2HD   LYS  52          1HD       LYS  52 -18.263   3.563 -16.474
  390   1HE   LYS  52          2HE       LYS  52 -18.777   1.457 -14.630
  391   2HE   LYS  52          1HE       LYS  52 -19.345   2.952 -13.888
  392   1HZ   LYS  52          1HZ       LYS  52 -20.102   3.089 -16.532
  393   2HZ   LYS  52          2HZ       LYS  52 -21.110   2.806 -15.193
  394   3HZ   LYS  52          3HZ       LYS  52 -20.451   1.499 -16.057
  395    H    LEU  53           H        LEU  53 -14.655  -0.077 -18.266
  396    HA   LEU  53           HA       LEU  53 -12.464   1.444 -17.196
  397   1HB   LEU  53          2HB       LEU  53 -12.717  -1.133 -17.539
  398   2HB   LEU  53          1HB       LEU  53 -12.103  -0.810 -19.160
  399    HG   LEU  53           HG       LEU  53 -10.701   0.172 -16.667
  400   1HD1  LEU  53          1HD1      LEU  53 -11.012  -2.498 -17.338
  401   2HD1  LEU  53          2HD1      LEU  53  -9.696  -1.836 -16.369
  402   3HD1  LEU  53          3HD1      LEU  53  -9.480  -2.076 -18.102
  403   1HD2  LEU  53          1HD2      LEU  53  -9.967   1.371 -18.580
  404   2HD2  LEU  53          2HD2      LEU  53 -10.021  -0.065 -19.602
  405   3HD2  LEU  53          3HD2      LEU  53  -8.763   0.098 -18.376
  406    H    GLU  54           H        GLU  54 -13.252   0.542 -20.577
  407    HA   GLU  54           HA       GLU  54 -11.195   2.030 -21.820
  408   1HB   GLU  54          2HB       GLU  54 -12.680   0.416 -23.003
  409   2HB   GLU  54          1HB       GLU  54 -14.005   1.574 -22.871
  410   1HG   GLU  54          2HG       GLU  54 -13.040   3.058 -24.381
  411   2HG   GLU  54          1HG       GLU  54 -11.407   2.470 -24.073
  412    H    LYS  55           H        LYS  55 -14.166   3.098 -20.338
  413    HA   LYS  55           HA       LYS  55 -14.176   5.716 -21.619
  414   1HB   LYS  55          2HB       LYS  55 -15.565   4.768 -19.093
  415   2HB   LYS  55          1HB       LYS  55 -15.918   6.260 -19.966
  416   1HG   LYS  55          2HG       LYS  55 -16.187   3.456 -21.090
  417   2HG   LYS  55          1HG       LYS  55 -17.522   4.490 -20.581
  418   1HD   LYS  55          2HD       LYS  55 -16.256   6.183 -22.270
  419   2HD   LYS  55          1HD       LYS  55 -15.834   4.643 -23.019
  420   1HE   LYS  55          2HE       LYS  55 -18.168   4.017 -23.191
  421   2HE   LYS  55          1HE       LYS  55 -18.660   5.436 -22.267
  422   1HZ   LYS  55          1HZ       LYS  55 -17.145   5.667 -24.797
  423   2HZ   LYS  55          2HZ       LYS  55 -18.048   6.860 -23.993
  424   3HZ   LYS  55          3HZ       LYS  55 -18.839   5.576 -24.775
  425    H    ALA  56           H        ALA  56 -13.724   4.837 -18.170
  426    HA   ALA  56           HA       ALA  56 -12.619   7.254 -17.308
  427   1HB   ALA  56          1HB       ALA  56 -11.225   4.927 -16.186
  428   2HB   ALA  56          2HB       ALA  56 -12.979   4.749 -16.187
  429   3HB   ALA  56          3HB       ALA  56 -12.233   6.128 -15.378
  430    H    ALA  57           H        ALA  57 -10.969   4.521 -18.876
  431    HA   ALA  57           HA       ALA  57  -8.325   5.625 -18.705
  432   1HB   ALA  57          1HB       ALA  57  -8.240   3.390 -19.295
  433   2HB   ALA  57          2HB       ALA  57  -8.103   4.113 -20.897
  434   3HB   ALA  57          3HB       ALA  57  -9.659   3.502 -20.336
  435    H    VAL  58           H        VAL  58 -10.756   5.697 -21.332
  436    HA   VAL  58           HA       VAL  58  -9.319   7.187 -23.220
  437    HB   VAL  58           HB       VAL  58 -12.253   7.145 -22.503
  438   1HG1  VAL  58          1HG1      VAL  58 -12.208   8.284 -24.974
  439   2HG1  VAL  58          2HG1      VAL  58 -10.778   9.026 -24.256
  440   3HG1  VAL  58          3HG1      VAL  58 -12.352   9.209 -23.479
  441   1HG2  VAL  58          1HG2      VAL  58 -10.787   5.304 -23.774
  442   2HG2  VAL  58          2HG2      VAL  58 -11.090   6.367 -25.146
  443   3HG2  VAL  58          3HG2      VAL  58 -12.443   5.657 -24.265
  444    H    GLU  59           H        GLU  59 -11.446   8.500 -20.647
  445    HA   GLU  59           HA       GLU  59 -10.965  11.232 -21.076
  446   1HB   GLU  59          2HB       GLU  59 -11.830   9.561 -18.815
  447   2HB   GLU  59          1HB       GLU  59 -11.035  11.056 -18.322
  448   1HG   GLU  59          2HG       GLU  59 -13.296  10.916 -20.337
  449   2HG   GLU  59          1HG       GLU  59 -13.511  11.307 -18.630
  450    H    ALA  60           H        ALA  60  -9.015   8.893 -19.232
  451    HA   ALA  60           HA       ALA  60  -7.096  10.667 -18.169
  452   1HB   ALA  60          1HB       ALA  60  -7.337   7.822 -18.586
  453   2HB   ALA  60          2HB       ALA  60  -6.363   8.683 -17.393
  454   3HB   ALA  60          3HB       ALA  60  -5.701   8.341 -18.992
  455    H    PHE  61           H        PHE  61  -6.816   8.805 -21.222
  456    HA   PHE  61           HA       PHE  61  -4.466   9.936 -22.205
  457   1HB   PHE  61          2HB       PHE  61  -5.664   8.140 -23.378
  458   2HB   PHE  61          1HB       PHE  61  -6.968   9.258 -23.782
  459    HD1  PHE  61           HD1      PHE  61  -3.767   7.962 -24.768
  460    HD2  PHE  61           HD2      PHE  61  -6.366  11.363 -25.142
  461    HE1  PHE  61           HE1      PHE  61  -2.518   8.696 -26.781
  462    HE2  PHE  61           HE2      PHE  61  -5.116  12.096 -27.154
  463    HZ   PHE  61           HZ       PHE  61  -3.192  10.762 -27.974
  464    H    LYS  62           H        LYS  62  -7.750  11.134 -23.006
  465    HA   LYS  62           HA       LYS  62  -7.030  13.483 -24.327
  466   1HB   LYS  62          2HB       LYS  62  -9.327  13.092 -22.382
  467   2HB   LYS  62          1HB       LYS  62  -9.198  14.417 -23.541
  468   1HG   LYS  62          2HG       LYS  62  -8.752  12.121 -25.072
  469   2HG   LYS  62          1HG       LYS  62 -10.062  11.670 -23.978
  470   1HD   LYS  62          2HD       LYS  62 -11.183  12.646 -25.812
  471   2HD   LYS  62          1HD       LYS  62 -11.111  13.950 -24.627
  472   1HE   LYS  62          2HE       LYS  62 -10.217  15.153 -26.339
  473   2HE   LYS  62          1HE       LYS  62  -8.733  14.293 -25.931
  474   1HZ   LYS  62          1HZ       LYS  62  -9.492  12.529 -27.511
  475   2HZ   LYS  62          2HZ       LYS  62  -9.083  14.012 -28.235
  476   3HZ   LYS  62          3HZ       LYS  62 -10.715  13.590 -28.019
  477    H    MET  63           H        MET  63  -7.295  12.973 -20.807
  478    HA   MET  63           HA       MET  63  -6.709  15.694 -20.092
  479   1HB   MET  63          2HB       MET  63  -6.701  13.058 -18.678
  480   2HB   MET  63          1HB       MET  63  -5.846  14.401 -17.918
  481   1HG   MET  63          2HG       MET  63  -8.015  15.758 -18.362
  482   2HG   MET  63          1HG       MET  63  -8.776  14.185 -18.600
  483   1HE   MET  63          1HE       MET  63  -8.558  12.306 -17.182
  484   2HE   MET  63          2HE       MET  63  -8.545  12.325 -15.421
  485   3HE   MET  63          3HE       MET  63  -7.021  12.344 -16.306
  486    H    GLY  64           H        GLY  64  -4.716  13.013 -21.084
  487   1HA   GLY  64          2HA       GLY  64  -2.481  13.625 -21.998
  488   2HA   GLY  64          1HA       GLY  64  -2.312  14.735 -20.638
  489    H    PHE  65           H        PHE  65  -3.289  11.301 -20.883
  490    HA   PHE  65           HA       PHE  65  -1.048  10.649 -19.020
  491   1HB   PHE  65          2HB       PHE  65  -3.973  10.016 -18.762
  492   2HB   PHE  65          1HB       PHE  65  -2.783   8.889 -18.112
  493    HD1  PHE  65           HD1      PHE  65  -0.901   9.931 -16.618
  494    HD2  PHE  65           HD2      PHE  65  -4.643  11.855 -17.480
  495    HE1  PHE  65           HE1      PHE  65  -0.614  11.381 -14.626
  496    HE2  PHE  65           HE2      PHE  65  -4.356  13.306 -15.488
  497    HZ   PHE  65           HZ       PHE  65  -2.341  13.069 -14.061
  498    H    GLU  66           H        GLU  66   0.238   9.191 -20.045
  499    HA   GLU  66           HA       GLU  66  -0.551   7.801 -22.425
  500   1HB   GLU  66          2HB       GLU  66   1.790   8.202 -22.056
  501   2HB   GLU  66          1HB       GLU  66   1.746   7.380 -20.496
  502   1HG   GLU  66          2HG       GLU  66   2.027   5.359 -21.458
  503   2HG   GLU  66          1HG       GLU  66   0.749   5.672 -22.635
  504    H    VAL  67           H        VAL  67  -2.516   6.706 -21.880
  505    HA   VAL  67           HA       VAL  67  -2.692   4.837 -19.687
  506    HB   VAL  67           HB       VAL  67  -4.688   5.863 -20.716
  507   1HG1  VAL  67          1HG1      VAL  67  -3.834   5.882 -23.046
  508   2HG1  VAL  67          2HG1      VAL  67  -5.425   5.127 -22.941
  509   3HG1  VAL  67          3HG1      VAL  67  -3.983   4.125 -23.102
  510   1HG2  VAL  67          1HG2      VAL  67  -5.176   3.053 -21.437
  511   2HG2  VAL  67          2HG2      VAL  67  -5.934   4.039 -20.187
  512   3HG2  VAL  67          3HG2      VAL  67  -4.389   3.251 -19.871
  513    H    LEU  68           H        LEU  68  -2.488   2.572 -19.726
  514    HA   LEU  68           HA       LEU  68  -1.295   1.431 -22.219
  515   1HB   LEU  68          2HB       LEU  68  -0.203   1.578 -19.527
  516   2HB   LEU  68          1HB       LEU  68  -0.347  -0.096 -20.062
  517    HG   LEU  68           HG       LEU  68   1.840   1.034 -20.669
  518   1HD1  LEU  68          1HD1      LEU  68  -0.034  -0.329 -22.536
  519   2HD1  LEU  68          2HD1      LEU  68   1.565  -0.824 -21.986
  520   3HD1  LEU  68          3HD1      LEU  68   1.408   0.393 -23.251
  521   1HD2  LEU  68          1HD2      LEU  68   0.240   3.129 -21.400
  522   2HD2  LEU  68          2HD2      LEU  68   0.536   2.372 -22.965
  523   3HD2  LEU  68          3HD2      LEU  68   1.892   2.906 -21.974
  524    H    GLU  69           H        GLU  69  -2.120  -0.558 -22.843
  525    HA   GLU  69           HA       GLU  69  -4.663  -1.393 -22.109
  526   1HB   GLU  69          2HB       GLU  69  -2.304  -2.999 -23.112
  527   2HB   GLU  69          1HB       GLU  69  -3.903  -3.714 -22.894
  528   1HG   GLU  69          2HG       GLU  69  -3.557  -1.175 -24.483
  529   2HG   GLU  69          1HG       GLU  69  -3.305  -2.752 -25.234
  530    H    ALA  70           H        ALA  70  -5.307  -3.395 -20.872
  531    HA   ALA  70           HA       ALA  70  -3.721  -3.548 -18.346
  532   1HB   ALA  70          1HB       ALA  70  -5.887  -4.437 -17.378
  533   2HB   ALA  70          2HB       ALA  70  -6.653  -4.057 -18.921
  534   3HB   ALA  70          3HB       ALA  70  -5.967  -2.766 -17.935
  535    H    GLU  71           H        GLU  71  -4.298  -5.838 -17.233
  536    HA   GLU  71           HA       GLU  71  -4.297  -8.015 -19.237
  537   1HB   GLU  71          2HB       GLU  71  -2.234  -9.011 -18.275
  538   2HB   GLU  71          1HB       GLU  71  -1.918  -7.444 -19.021
  539   1HG   GLU  71          2HG       GLU  71  -2.617  -6.811 -16.396
  540   2HG   GLU  71          1HG       GLU  71  -1.615  -8.255 -16.237
  541    H    GLU  72           H        GLU  72  -5.756  -9.452 -18.447
  542    HA   GLU  72           HA       GLU  72  -7.027  -9.452 -16.006
  543   1HB   GLU  72          2HB       GLU  72  -6.639 -12.194 -16.529
  544   2HB   GLU  72          1HB       GLU  72  -8.003 -11.199 -17.042
  545   1HG   GLU  72          2HG       GLU  72  -6.838 -10.595 -19.101
  546   2HG   GLU  72          1HG       GLU  72  -5.405 -11.482 -18.581
  547    H    THR  73           H        THR  73  -6.201  -9.453 -13.978
  548    HA   THR  73           HA       THR  73  -3.739 -11.077 -13.475
  549    HB   THR  73           HB       THR  73  -3.478  -8.589 -13.210
  550    HG1  THR  73           HG1      THR  73  -2.658 -10.493 -11.702
  551   1HG2  THR  73          1HG2      THR  73  -5.840  -8.259 -12.387
  552   2HG2  THR  73          2HG2      THR  73  -4.611  -7.455 -11.410
  553   3HG2  THR  73          3HG2      THR  73  -5.337  -8.962 -10.850
  554    H    GLU  74           H        GLU  74  -4.083 -10.634 -10.562
  555    HA   GLU  74           HA       GLU  74  -6.630 -12.011  -9.963
  556   1HB   GLU  74          2HB       GLU  74  -4.004 -13.332 -10.030
  557   2HB   GLU  74          1HB       GLU  74  -4.861 -13.543  -8.503
  558   1HG   GLU  74          2HG       GLU  74  -6.863 -14.308  -9.743
  559   2HG   GLU  74          1HG       GLU  74  -5.981 -14.131 -11.260
  560    H    ASP  75           H        ASP  75  -7.425 -11.016  -8.181
  561    HA   ASP  75           HA       ASP  75  -5.584  -9.485  -6.442
  562   1HB   ASP  75          2HB       ASP  75  -7.833  -8.599  -7.323
  563   2HB   ASP  75          1HB       ASP  75  -8.587  -9.689  -6.160
  564    H    GLU  76           H        GLU  76  -8.308 -11.751  -5.891
  565    HA   GLU  76           HA       GLU  76  -7.050 -12.519  -3.313
  566   1HB   GLU  76          2HB       GLU  76  -9.600 -11.958  -3.738
  567   2HB   GLU  76          1HB       GLU  76  -9.661 -13.636  -4.280
  568   1HG   GLU  76          2HG       GLU  76  -8.270 -13.970  -1.994
  569   2HG   GLU  76          1HG       GLU  76  -9.209 -12.543  -1.552
  570    H    ASP  77           H        ASP  77  -5.961 -13.362  -5.948
  571    HA   ASP  77           HA       ASP  77  -5.197 -15.321  -6.997
  572   1HB   ASP  77          2HB       ASP  77  -5.415 -16.001  -4.088
  573   2HB   ASP  77          1HB       ASP  77  -5.064 -17.298  -5.231
  574    H    GLY  78           H        GLY  78  -8.279 -14.849  -6.322
  575   1HA   GLY  78          2HA       GLY  78  -9.096 -17.422  -7.561
  576   2HA   GLY  78          1HA       GLY  78  -9.906 -16.924  -6.074
  577    H    ASN  79           H        ASN  79  -8.905 -14.356  -8.113
  578    HA   ASN  79           HA       ASN  79 -11.639 -14.169  -9.303
  579   1HB   ASN  79          2HB       ASN  79 -10.287 -12.317  -7.448
  580   2HB   ASN  79          1HB       ASN  79 -10.956 -11.542  -8.885
  581   1HD2  ASN  79          1HD2      ASN  79 -11.762 -12.691  -5.780
  582   2HD2  ASN  79          2HD2      ASN  79 -13.449 -12.715  -5.963
  583    H    LYS  80           H        LYS  80 -11.485 -12.096 -10.921
  584    HA   LYS  80           HA       LYS  80  -8.882 -11.940 -12.272
  585   1HB   LYS  80          2HB       LYS  80  -9.902 -12.689 -14.469
  586   2HB   LYS  80          1HB       LYS  80  -9.672 -13.977 -13.286
  587   1HG   LYS  80          2HG       LYS  80 -11.868 -14.445 -13.392
  588   2HG   LYS  80          1HG       LYS  80 -12.229 -12.828 -12.786
  589   1HD   LYS  80          2HD       LYS  80 -11.947 -12.003 -15.181
  590   2HD   LYS  80          1HD       LYS  80 -11.934 -13.698 -15.670
  591   1HE   LYS  80          2HE       LYS  80 -14.179 -13.777 -15.562
  592   2HE   LYS  80          1HE       LYS  80 -14.138 -13.261 -13.875
  593   1HZ   LYS  80          1HZ       LYS  80 -13.597 -11.147 -15.749
  594   2HZ   LYS  80          2HZ       LYS  80 -14.662 -11.181 -14.425
  595   3HZ   LYS  80          3HZ       LYS  80 -15.145 -11.817 -15.924
  596    H    LEU  81           H        LEU  81  -8.802  -9.744 -12.466
  597    HA   LEU  81           HA       LEU  81 -11.170  -8.397 -13.700
  598   1HB   LEU  81          2HB       LEU  81 -10.679  -6.415 -12.288
  599   2HB   LEU  81          1HB       LEU  81 -11.090  -7.825 -11.313
  600    HG   LEU  81           HG       LEU  81  -8.246  -7.778 -11.856
  601   1HD1  LEU  81          1HD1      LEU  81  -8.290  -5.413 -11.996
  602   2HD1  LEU  81          2HD1      LEU  81  -7.873  -5.742 -10.314
  603   3HD1  LEU  81          3HD1      LEU  81  -9.520  -5.278 -10.740
  604   1HD2  LEU  81          1HD2      LEU  81  -9.241  -9.046 -10.037
  605   2HD2  LEU  81          2HD2      LEU  81  -9.948  -7.584  -9.351
  606   3HD2  LEU  81          3HD2      LEU  81  -8.199  -7.806  -9.340
  607    H    LEU  82           H        LEU  82 -10.481  -6.216 -14.674
  608    HA   LEU  82           HA       LEU  82  -7.914  -6.645 -16.110
  609   1HB   LEU  82          2HB       LEU  82 -10.173  -4.697 -16.673
  610   2HB   LEU  82          1HB       LEU  82  -8.766  -4.970 -17.700
  611    HG   LEU  82           HG       LEU  82  -9.467  -7.427 -17.772
  612   1HD1  LEU  82          1HD1      LEU  82 -11.081  -7.929 -16.253
  613   2HD1  LEU  82          2HD1      LEU  82 -12.190  -7.258 -17.449
  614   3HD1  LEU  82          3HD1      LEU  82 -11.609  -6.252 -16.122
  615   1HD2  LEU  82          1HD2      LEU  82 -11.154  -7.003 -19.525
  616   2HD2  LEU  82          2HD2      LEU  82  -9.816  -5.862 -19.653
  617   3HD2  LEU  82          3HD2      LEU  82 -11.347  -5.350 -18.943
  618    H    CYS  83           H        CYS  83  -6.177  -5.344 -15.734
  619    HA   CYS  83           HA       CYS  83  -6.630  -2.864 -14.130
  620   1HB   CYS  83          2HB       CYS  83  -4.225  -3.369 -13.282
  621   2HB   CYS  83          1HB       CYS  83  -5.559  -4.301 -12.603
  622    HG   CYS  83           HG       CYS  83  -4.100  -5.547 -15.039
  623    H    PHE  84           H        PHE  84  -6.201  -1.154 -15.444
  624    HA   PHE  84           HA       PHE  84  -4.130  -1.487 -17.560
  625   1HB   PHE  84          2HB       PHE  84  -5.073   0.690 -18.423
  626   2HB   PHE  84          1HB       PHE  84  -6.227  -0.641 -18.410
  627    HD1  PHE  84           HD1      PHE  84  -7.684  -0.884 -16.240
  628    HD2  PHE  84           HD2      PHE  84  -5.634   2.711 -17.392
  629    HE1  PHE  84           HE1      PHE  84  -9.202   0.445 -14.798
  630    HE2  PHE  84           HE2      PHE  84  -7.152   4.039 -15.950
  631    HZ   PHE  84           HZ       PHE  84  -8.935   2.907 -14.653
  632    H    ASP  85           H        ASP  85  -2.612   0.375 -17.871
  633    HA   ASP  85           HA       ASP  85  -2.004   1.697 -15.254
  634   1HB   ASP  85          2HB       ASP  85   0.195   1.186 -17.200
  635   2HB   ASP  85          1HB       ASP  85   0.227   1.163 -15.436
  636    H    ALA  86           H        ALA  86  -0.680   3.728 -15.542
  637    HA   ALA  86           HA       ALA  86  -1.125   5.057 -18.164
  638   1HB   ALA  86          1HB       ALA  86  -1.888   7.114 -16.912
  639   2HB   ALA  86          2HB       ALA  86  -1.999   6.117 -15.462
  640   3HB   ALA  86          3HB       ALA  86  -3.028   5.769 -16.853
  641    H    THR  87           H        THR  87   0.251   7.035 -18.371
  642    HA   THR  87           HA       THR  87   2.494   7.115 -16.415
  643    HB   THR  87           HB       THR  87   3.547   7.499 -19.056
  644    HG1  THR  87           HG1      THR  87   3.098   5.020 -19.358
  645   1HG2  THR  87          1HG2      THR  87   4.961   6.826 -17.264
  646   2HG2  THR  87          2HG2      THR  87   4.863   5.426 -18.332
  647   3HG2  THR  87          3HG2      THR  87   3.912   5.472 -16.847
  648    H    MET  88           H        MET  88   3.568   9.140 -16.320
  649    HA   MET  88           HA       MET  88   2.743  11.321 -18.101
  650   1HB   MET  88          2HB       MET  88   0.944  11.097 -16.279
  651   2HB   MET  88          1HB       MET  88   2.186  11.622 -15.142
  652   1HG   MET  88          2HG       MET  88   2.541  13.668 -16.506
  653   2HG   MET  88          1HG       MET  88   1.246  13.152 -17.587
  654   1HE   MET  88          1HE       MET  88  -1.154  13.092 -17.122
  655   2HE   MET  88          2HE       MET  88  -0.616  14.737 -17.444
  656   3HE   MET  88          3HE       MET  88  -1.814  14.440 -16.186
  657    H    GLN  89           H        GLN  89   4.499  12.640 -18.335
  658    HA   GLN  89           HA       GLN  89   6.742  12.298 -16.419
  659   1HB   GLN  89          2HB       GLN  89   6.895  13.960 -18.919
  660   2HB   GLN  89          1HB       GLN  89   8.164  13.026 -18.124
  661   1HG   GLN  89          2HG       GLN  89   6.559  10.990 -18.700
  662   2HG   GLN  89          1HG       GLN  89   5.987  12.091 -19.954
  663   1HE2  GLN  89          1HE2      GLN  89   8.303   9.727 -19.353
  664   2HE2  GLN  89          2HE2      GLN  89   9.432  10.158 -20.544
  665    H    SER  90           H        SER  90   7.580  14.022 -15.234
  666    HA   SER  90           HA       SER  90   6.879  16.774 -15.671
  667   1HB   SER  90          2HB       SER  90   5.326  17.164 -13.886
  668   2HB   SER  90          1HB       SER  90   4.685  15.806 -14.807
  669    HG   SER  90           HG       SER  90   4.764  15.550 -12.455
  670    H    ALA  91           H        ALA  91   7.320  17.964 -13.344
  671    HA   ALA  91           HA       ALA  91  10.045  17.132 -12.662
  672   1HB   ALA  91          1HB       ALA  91   8.407  19.351 -11.409
  673   2HB   ALA  91          2HB       ALA  91   9.306  19.543 -12.915
  674   3HB   ALA  91          3HB       ALA  91  10.163  19.190 -11.415
  675    H    LEU  92           H        LEU  92  10.266  15.463 -11.241
  676    HA   LEU  92           HA       LEU  92   8.430  14.351  -9.508
  677   1HB   LEU  92          2HB       LEU  92  10.813  13.570  -9.903
  678   2HB   LEU  92          1HB       LEU  92  11.326  14.788  -8.736
  679    HG   LEU  92           HG       LEU  92   9.582  13.721  -7.148
  680   1HD1  LEU  92          1HD1      LEU  92   9.711  11.094  -7.914
  681   2HD1  LEU  92          2HD1      LEU  92   9.521  11.895  -9.472
  682   3HD1  LEU  92          3HD1      LEU  92   8.324  12.143  -8.202
  683   1HD2  LEU  92          1HD2      LEU  92  11.228  12.071  -6.386
  684   2HD2  LEU  92          2HD2      LEU  92  12.052  13.541  -6.905
  685   3HD2  LEU  92          3HD2      LEU  92  12.032  12.124  -7.954
  686    H    ASP  93           H        ASP  93   7.056  15.822  -8.458
  687    HA   ASP  93           HA       ASP  93   8.288  17.245  -6.162
  688   1HB   ASP  93          2HB       ASP  93   7.000  18.507  -8.499
  689   2HB   ASP  93          1HB       ASP  93   6.397  19.068  -6.939
  690    H    ALA  94           H        ALA  94   6.981  17.184  -4.350
  691    HA   ALA  94           HA       ALA  94   4.816  15.346  -4.231
  692   1HB   ALA  94          1HB       ALA  94   5.016  17.634  -2.296
  693   2HB   ALA  94          2HB       ALA  94   6.289  16.413  -2.332
  694   3HB   ALA  94          3HB       ALA  94   4.625  15.943  -1.984
  695    H    LYS  95           H        LYS  95   4.796  18.915  -4.427
  696    HA   LYS  95           HA       LYS  95   2.012  19.322  -4.260
  697   1HB   LYS  95          2HB       LYS  95   3.864  20.833  -6.124
  698   2HB   LYS  95          1HB       LYS  95   2.381  21.426  -5.378
  699   1HG   LYS  95          2HG       LYS  95   3.522  22.079  -3.554
  700   2HG   LYS  95          1HG       LYS  95   4.130  20.439  -3.320
  701   1HD   LYS  95          2HD       LYS  95   5.955  20.871  -4.910
  702   2HD   LYS  95          1HD       LYS  95   5.339  22.500  -5.188
  703   1HE   LYS  95          2HE       LYS  95   5.928  23.231  -3.038
  704   2HE   LYS  95          1HE       LYS  95   5.989  21.590  -2.395
  705   1HZ   LYS  95          1HZ       LYS  95   8.122  21.449  -2.919
  706   2HZ   LYS  95          2HZ       LYS  95   8.097  23.086  -3.372
  707   3HZ   LYS  95          3HZ       LYS  95   7.819  21.875  -4.532
  708    H    LEU  96           H        LEU  96   3.966  18.778  -7.214
  709    HA   LEU  96           HA       LEU  96   1.768  18.737  -9.025
  710   1HB   LEU  96          2HB       LEU  96   4.601  17.953  -9.067
  711   2HB   LEU  96          1HB       LEU  96   3.586  16.970 -10.123
  712    HG   LEU  96           HG       LEU  96   2.640  19.077 -11.092
  713   1HD1  LEU  96          1HD1      LEU  96   2.945  20.745  -9.482
  714   2HD1  LEU  96          2HD1      LEU  96   4.239  21.109 -10.623
  715   3HD1  LEU  96          3HD1      LEU  96   4.598  20.241  -9.130
  716   1HD2  LEU  96          1HD2      LEU  96   4.954  17.789 -11.726
  717   2HD2  LEU  96          2HD2      LEU  96   5.565  19.419 -11.445
  718   3HD2  LEU  96          3HD2      LEU  96   4.311  19.144 -12.653
  719    H    ILE  97           H        ILE  97   3.591  15.880  -7.861
  720    HA   ILE  97           HA       ILE  97   1.906  13.862  -8.701
  721    HB   ILE  97           HB       ILE  97   3.428  14.158  -6.108
  722   1HG1  ILE  97          2HG1      ILE  97   3.916  12.170  -8.313
  723   2HG1  ILE  97          1HG1      ILE  97   4.458  13.838  -8.502
  724   1HG2  ILE  97          1HG2      ILE  97   1.537  12.020  -6.993
  725   2HG2  ILE  97          2HG2      ILE  97   1.896  12.597  -5.366
  726   3HG2  ILE  97          3HG2      ILE  97   3.025  11.522  -6.190
  727   1HD1  ILE  97          1HD1      ILE  97   5.115  12.221  -6.035
  728   2HD1  ILE  97          2HD1      ILE  97   5.880  13.706  -6.602
  729   3HD1  ILE  97          3HD1      ILE  97   6.142  12.191  -7.468
  730    H    ASP  98           H        ASP  98   1.423  15.969  -5.886
  731    HA   ASP  98           HA       ASP  98  -0.866  14.630  -4.830
  732   1HB   ASP  98          2HB       ASP  98   0.440  17.247  -4.498
  733   2HB   ASP  98          1HB       ASP  98  -1.301  17.274  -4.212
  734    H    GLU  99           H        GLU  99  -0.707  17.508  -6.962
  735    HA   GLU  99           HA       GLU  99  -3.527  17.659  -7.397
  736   1HB   GLU  99          2HB       GLU  99  -1.336  18.532  -9.303
  737   2HB   GLU  99          1HB       GLU  99  -2.989  19.145  -9.237
  738   1HG   GLU  99          2HG       GLU  99  -2.625  20.301  -7.240
  739   2HG   GLU  99          1HG       GLU  99  -1.258  19.283  -6.785
  740    H    GLN 100           H        GLN 100  -0.944  16.117  -9.337
  741    HA   GLN 100           HA       GLN 100  -2.581  15.189 -11.451
  742   1HB   GLN 100          2HB       GLN 100  -0.172  13.804 -10.231
  743   2HB   GLN 100          1HB       GLN 100  -0.835  13.502 -11.838
  744   1HG   GLN 100          2HG       GLN 100   0.349  16.111 -10.845
  745   2HG   GLN 100          1HG       GLN 100   1.068  15.018 -12.028
  746   1HE2  GLN 100          1HE2      GLN 100   0.105  17.891 -12.353
  747   2HE2  GLN 100          2HE2      GLN 100  -0.994  17.831 -13.646
  748    H    VAL 101           H        VAL 101  -1.629  13.437  -8.472
  749    HA   VAL 101           HA       VAL 101  -3.264  11.153  -8.964
  750    HB   VAL 101           HB       VAL 101  -2.221  12.385  -6.401
  751   1HG1  VAL 101          1HG1      VAL 101  -4.102  11.190  -5.635
  752   2HG1  VAL 101          2HG1      VAL 101  -2.799  10.009  -5.511
  753   3HG1  VAL 101          3HG1      VAL 101  -3.923   9.941  -6.868
  754   1HG2  VAL 101          1HG2      VAL 101  -0.733  10.376  -6.495
  755   2HG2  VAL 101          2HG2      VAL 101  -0.522  11.442  -7.884
  756   3HG2  VAL 101          3HG2      VAL 101  -1.454   9.954  -8.049
  757    H    GLU 102           H        GLU 102  -3.905  13.981  -6.857
  758    HA   GLU 102           HA       GLU 102  -6.462  13.434  -5.986
  759   1HB   GLU 102          2HB       GLU 102  -5.126  15.969  -6.853
  760   2HB   GLU 102          1HB       GLU 102  -6.858  16.009  -6.515
  761   1HG   GLU 102          2HG       GLU 102  -6.411  14.972  -4.291
  762   2HG   GLU 102          1HG       GLU 102  -4.682  15.065  -4.627
  763    H    LYS 103           H        LYS 103  -5.521  14.428  -9.250
  764    HA   LYS 103           HA       LYS 103  -8.206  14.779 -10.237
  765   1HB   LYS 103          2HB       LYS 103  -5.487  14.688 -11.355
  766   2HB   LYS 103          1HB       LYS 103  -6.719  14.048 -12.443
  767   1HG   LYS 103          2HG       LYS 103  -8.069  16.128 -12.035
  768   2HG   LYS 103          1HG       LYS 103  -6.707  16.774 -11.120
  769   1HD   LYS 103          2HD       LYS 103  -5.261  16.486 -13.128
  770   2HD   LYS 103          1HD       LYS 103  -6.672  15.946 -14.037
  771   1HE   LYS 103          2HE       LYS 103  -6.626  18.219 -14.561
  772   2HE   LYS 103          1HE       LYS 103  -7.731  18.197 -13.186
  773   1HZ   LYS 103          1HZ       LYS 103  -5.037  18.369 -12.316
  774   2HZ   LYS 103          2HZ       LYS 103  -6.332  19.425 -12.012
  775   3HZ   LYS 103          3HZ       LYS 103  -5.382  19.622 -13.406
  776    H    LEU 104           H        LEU 104  -5.885  12.132 -10.930
  777    HA   LEU 104           HA       LEU 104  -7.728  10.358 -12.099
  778   1HB   LEU 104          2HB       LEU 104  -5.447   9.512 -10.294
  779   2HB   LEU 104          1HB       LEU 104  -6.144   8.604 -11.636
  780    HG   LEU 104           HG       LEU 104  -4.761  11.286 -11.928
  781   1HD1  LEU 104          1HD1      LEU 104  -2.943   9.914 -12.982
  782   2HD1  LEU 104          2HD1      LEU 104  -3.774   8.462 -12.424
  783   3HD1  LEU 104          3HD1      LEU 104  -3.131   9.614 -11.254
  784   1HD2  LEU 104          1HD2      LEU 104  -6.044  11.161 -13.834
  785   2HD2  LEU 104          2HD2      LEU 104  -6.189   9.406 -13.745
  786   3HD2  LEU 104          3HD2      LEU 104  -4.711  10.137 -14.368
  787    H    VAL 105           H        VAL 105  -7.409  11.315  -8.789
  788    HA   VAL 105           HA       VAL 105  -8.726   8.993  -7.642
  789    HB   VAL 105           HB       VAL 105  -8.113  11.774  -6.637
  790   1HG1  VAL 105          1HG1      VAL 105  -8.894  10.425  -4.406
  791   2HG1  VAL 105          2HG1      VAL 105 -10.027   9.770  -5.589
  792   3HG1  VAL 105          3HG1      VAL 105  -9.951  11.510  -5.307
  793   1HG2  VAL 105          1HG2      VAL 105  -6.698  10.470  -5.053
  794   2HG2  VAL 105          2HG2      VAL 105  -6.253  10.179  -6.734
  795   3HG2  VAL 105          3HG2      VAL 105  -7.208   8.984  -5.855
  796    H    ASN 106           H        ASN 106  -9.868  12.384  -7.845
  797    HA   ASN 106           HA       ASN 106 -12.578  11.879  -7.346
  798   1HB   ASN 106          2HB       ASN 106 -11.152  13.980  -8.958
  799   2HB   ASN 106          1HB       ASN 106 -12.915  13.935  -8.939
  800   1HD2  ASN 106          1HD2      ASN 106 -10.935  15.896  -7.650
  801   2HD2  ASN 106          2HD2      ASN 106 -11.398  15.943  -6.018
  802    H    LEU 107           H        LEU 107 -10.972  12.011 -10.544
  803    HA   LEU 107           HA       LEU 107 -13.214  11.364 -12.127
  804   1HB   LEU 107          2HB       LEU 107 -11.216  12.006 -13.253
  805   2HB   LEU 107          1HB       LEU 107 -10.274  10.744 -12.458
  806    HG   LEU 107           HG       LEU 107 -12.599   9.748 -13.974
  807   1HD1  LEU 107          1HD1      LEU 107 -11.774  11.677 -15.382
  808   2HD1  LEU 107          2HD1      LEU 107 -11.646  10.101 -16.165
  809   3HD1  LEU 107          3HD1      LEU 107 -10.212  10.861 -15.473
  810   1HD2  LEU 107          1HD2      LEU 107 -10.769   8.379 -12.900
  811   2HD2  LEU 107          2HD2      LEU 107  -9.650   9.046 -14.088
  812   3HD2  LEU 107          3HD2      LEU 107 -11.001   8.044 -14.616
  813    H    ALA 108           H        ALA 108 -10.885   9.162 -10.552
  814    HA   ALA 108           HA       ALA 108 -11.903   6.717 -11.494
  815   1HB   ALA 108          1HB       ALA 108 -10.035   6.316 -10.232
  816   2HB   ALA 108          2HB       ALA 108 -11.226   6.038  -8.961
  817   3HB   ALA 108          3HB       ALA 108 -10.413   7.598  -9.081
  818    H    GLU 109           H        GLU 109 -12.734   8.158  -8.315
  819    HA   GLU 109           HA       GLU 109 -14.911   6.455  -7.755
  820   1HB   GLU 109          2HB       GLU 109 -14.201   9.255  -6.920
  821   2HB   GLU 109          1HB       GLU 109 -15.750   8.564  -6.436
  822   1HG   GLU 109          2HG       GLU 109 -13.878   8.203  -4.772
  823   2HG   GLU 109          1HG       GLU 109 -14.666   6.723  -5.321
  824    H    LYS 110           H        LYS 110 -14.860   9.528  -9.554
  825    HA   LYS 110           HA       LYS 110 -17.639   9.863  -9.913
  826   1HB   LYS 110          2HB       LYS 110 -15.280  10.538 -11.677
  827   2HB   LYS 110          1HB       LYS 110 -16.933  10.953 -12.135
  828   1HG   LYS 110          2HG       LYS 110 -16.593  11.735  -9.419
  829   2HG   LYS 110          1HG       LYS 110 -15.193  12.329 -10.314
  830   1HD   LYS 110          2HD       LYS 110 -16.814  13.239 -12.040
  831   2HD   LYS 110          1HD       LYS 110 -18.115  12.846 -10.916
  832   1HE   LYS 110          2HE       LYS 110 -17.737  14.968 -10.160
  833   2HE   LYS 110          1HE       LYS 110 -16.442  14.187  -9.253
  834   1HZ   LYS 110          1HZ       LYS 110 -16.292  15.888 -11.615
  835   2HZ   LYS 110          2HZ       LYS 110 -15.194  14.593 -11.536
  836   3HZ   LYS 110          3HZ       LYS 110 -15.227  15.758 -10.301
  837    H    PHE 111           H        PHE 111 -15.416   7.629 -11.465
  838    HA   PHE 111           HA       PHE 111 -17.520   6.783 -13.378
  839   1HB   PHE 111          2HB       PHE 111 -14.582   6.182 -13.065
  840   2HB   PHE 111          1HB       PHE 111 -15.606   5.172 -14.086
  841    HD1  PHE 111           HD1      PHE 111 -15.498   5.718 -16.341
  842    HD2  PHE 111           HD2      PHE 111 -15.271   8.857 -13.418
  843    HE1  PHE 111           HE1      PHE 111 -15.350   7.399 -18.158
  844    HE2  PHE 111           HE2      PHE 111 -15.123  10.538 -15.234
  845    HZ   PHE 111           HZ       PHE 111 -15.162   9.809 -17.605
  846    H    ASP 112           H        ASP 112 -15.182   4.824 -11.551
  847    HA   ASP 112           HA       ASP 112 -16.741   3.578  -9.658
  848   1HB   ASP 112          2HB       ASP 112 -17.567   2.805 -12.390
  849   2HB   ASP 112          1HB       ASP 112 -17.280   1.450 -11.297
  850    H    ILE 113           H        ILE 113 -13.987   4.063 -10.472
  851    HA   ILE 113           HA       ILE 113 -12.944   1.260 -10.413
  852    HB   ILE 113           HB       ILE 113 -10.838   2.309 -11.387
  853   1HG1  ILE 113          2HG1      ILE 113 -12.702   4.584 -12.104
  854   2HG1  ILE 113          1HG1      ILE 113 -11.633   4.657 -10.703
  855   1HG2  ILE 113          1HG2      ILE 113 -12.875   1.156 -12.627
  856   2HG2  ILE 113          2HG2      ILE 113 -11.600   1.945 -13.554
  857   3HG2  ILE 113          3HG2      ILE 113 -13.127   2.777 -13.268
  858   1HD1  ILE 113          1HD1      ILE 113  -9.747   4.853 -11.981
  859   2HD1  ILE 113          2HD1      ILE 113 -10.887   5.485 -13.170
  860   3HD1  ILE 113          3HD1      ILE 113 -10.374   3.800 -13.249
  861    H    ILE 114           H        ILE 114 -10.790   1.113  -9.249
  862    HA   ILE 114           HA       ILE 114 -10.790   2.978  -6.910
  863    HB   ILE 114           HB       ILE 114 -11.229   0.930  -5.920
  864   1HG1  ILE 114          2HG1      ILE 114  -9.190   0.074  -4.927
  865   2HG1  ILE 114          1HG1      ILE 114  -8.219   0.719  -6.250
  866   1HG2  ILE 114          1HG2      ILE 114 -11.354  -0.477  -7.822
  867   2HG2  ILE 114          2HG2      ILE 114 -10.094  -1.202  -6.824
  868   3HG2  ILE 114          3HG2      ILE 114  -9.656  -0.223  -8.224
  869   1HD1  ILE 114          1HD1      ILE 114  -8.627   2.023  -3.888
  870   2HD1  ILE 114          2HD1      ILE 114  -9.923   2.704  -4.869
  871   3HD1  ILE 114          3HD1      ILE 114  -8.249   2.838  -5.405
  872    H    TYR 115           H        TYR 115  -9.132   4.392  -7.108
  873    HA   TYR 115           HA       TYR 115  -6.694   3.590  -8.586
  874   1HB   TYR 115          2HB       TYR 115  -7.244   5.733  -9.273
  875   2HB   TYR 115          1HB       TYR 115  -7.917   6.175  -7.706
  876    HD1  TYR 115           HD1      TYR 115  -4.846   5.868  -9.706
  877    HD2  TYR 115           HD2      TYR 115  -6.470   6.901  -5.866
  878    HE1  TYR 115           HE1      TYR 115  -2.696   6.937  -9.084
  879    HE2  TYR 115           HE2      TYR 115  -4.321   7.970  -5.244
  880    HH   TYR 115           HH       TYR 115  -1.567   7.425  -6.501
  881    H    ASP 116           H        ASP 116  -5.131   2.611  -7.398
  882    HA   ASP 116           HA       ASP 116  -4.141   3.858  -4.956
  883   1HB   ASP 116          2HB       ASP 116  -6.008   2.615  -3.992
  884   2HB   ASP 116          1HB       ASP 116  -5.490   1.144  -4.819
  885    H    GLY 117           H        GLY 117  -2.248   3.868  -6.361
  886   1HA   GLY 117          2HA       GLY 117  -0.306   1.967  -5.867
  887   2HA   GLY 117          1HA       GLY 117  -1.124   1.351  -7.304
  888    H    TRP 118           H        TRP 118   0.705   4.107  -6.032
  889    HA   TRP 118           HA       TRP 118   1.297   4.871  -8.864
  890   1HB   TRP 118          2HB       TRP 118   1.203   7.120  -8.316
  891   2HB   TRP 118          1HB       TRP 118   0.003   6.488  -7.189
  892    HD1  TRP 118           HD1      TRP 118   0.851   6.048  -4.637
  893    HE1  TRP 118           HE1      TRP 118   2.657   7.264  -3.257
  894    HE3  TRP 118           HE3      TRP 118   3.422   8.362  -8.395
  895    HZ2  TRP 118           HZ2      TRP 118   4.898   8.990  -3.691
  896    HZ3  TRP 118           HZ3      TRP 118   5.385   9.784  -7.885
  897    HH2  TRP 118           HH2      TRP 118   6.127  10.101  -5.539
  898    H    GLY 119           H        GLY 119   3.507   5.684  -9.222
  899   1HA   GLY 119          2HA       GLY 119   5.564   5.710  -7.286
  900   2HA   GLY 119          1HA       GLY 119   5.498   4.071  -7.933
  901    H    THR 120           H        THR 120   7.700   5.895  -8.289
  902    HA   THR 120           HA       THR 120   7.543   6.313 -11.248
  903    HB   THR 120           HB       THR 120   7.764   8.477 -10.251
  904    HG1  THR 120           HG1      THR 120  10.465   7.957 -10.643
  905   1HG2  THR 120          1HG2      THR 120   9.544   8.950  -8.570
  906   2HG2  THR 120          2HG2      THR 120   9.931   7.229  -8.538
  907   3HG2  THR 120          3HG2      THR 120   8.352   7.789  -7.988
  908    H    TYR 121           H        TYR 121   9.779   6.163 -12.285
  909    HA   TYR 121           HA       TYR 121  11.338   3.988 -10.944
  910   1HB   TYR 121          2HB       TYR 121  10.074   3.970 -13.443
  911   2HB   TYR 121          1HB       TYR 121  11.779   4.233 -13.816
  912    HD1  TYR 121           HD1      TYR 121   9.609   2.118 -11.597
  913    HD2  TYR 121           HD2      TYR 121  13.188   2.380 -13.959
  914    HE1  TYR 121           HE1      TYR 121  10.075  -0.278 -11.158
  915    HE2  TYR 121           HE2      TYR 121  13.654  -0.015 -13.519
  916    HH   TYR 121           HH       TYR 121  11.316  -2.080 -11.929
  917    H    TYR 122           H        TYR 122  13.622   4.157 -11.001
  918    HA   TYR 122           HA       TYR 122  14.706   6.805 -10.962
  919   1HB   TYR 122          2HB       TYR 122  15.616   4.615  -9.882
  920   2HB   TYR 122          1HB       TYR 122  16.388   4.351 -11.446
  921    HD1  TYR 122           HD1      TYR 122  18.531   5.205 -11.749
  922    HD2  TYR 122           HD2      TYR 122  15.890   7.120  -8.955
  923    HE1  TYR 122           HE1      TYR 122  20.337   6.787 -11.126
  924    HE2  TYR 122           HE2      TYR 122  17.696   8.702  -8.333
  925    HH   TYR 122           HH       TYR 122  20.976   8.346  -9.619
  926    H    GLU 123           H        GLU 123  15.782   7.978 -12.553
  927    HA   GLU 123           HA       GLU 123  15.583   6.873 -15.310
  928   1HB   GLU 123          2HB       GLU 123  15.338   9.537 -14.115
  929   2HB   GLU 123          1HB       GLU 123  16.388   9.519 -15.532
  930   1HG   GLU 123          2HG       GLU 123  13.622   8.284 -15.471
  931   2HG   GLU 123          1HG       GLU 123  13.961   9.907 -16.074
  932    H    GLY 124           H        GLY 124  17.448   5.753 -15.760
  933   1HA   GLY 124          2HA       GLY 124  19.728   5.983 -16.628
  934   2HA   GLY 124          1HA       GLY 124  20.007   7.251 -15.436
  935    H    LEU 125           H        LEU 125  19.257   3.760 -15.638
  936    HA   LEU 125           HA       LEU 125  20.327   3.335 -12.931
  937   1HB   LEU 125          2HB       LEU 125  19.491   1.279 -15.000
  938   2HB   LEU 125          1HB       LEU 125  19.724   1.005 -13.273
  939    HG   LEU 125           HG       LEU 125  17.859   3.197 -13.882
  940   1HD1  LEU 125          1HD1      LEU 125  17.004   0.357 -14.494
  941   2HD1  LEU 125          2HD1      LEU 125  17.429   1.526 -15.744
  942   3HD1  LEU 125          3HD1      LEU 125  16.052   1.829 -14.686
  943   1HD2  LEU 125          1HD2      LEU 125  16.517   1.898 -12.184
  944   2HD2  LEU 125          2HD2      LEU 125  18.125   2.356 -11.626
  945   3HD2  LEU 125          3HD2      LEU 125  17.813   0.703 -12.158
  946    H    GLU 126           H        GLU 126  22.478   4.308 -13.745
  947    HA   GLU 126           HA       GLU 126  24.249   2.054 -14.463
  948   1HB   GLU 126          2HB       GLU 126  25.321   3.240 -16.294
  949   2HB   GLU 126          1HB       GLU 126  23.591   3.146 -16.627
  950   1HG   GLU 126          2HG       GLU 126  23.286   5.428 -15.761
  951   2HG   GLU 126          1HG       GLU 126  25.009   5.528 -15.394
  952    H    HIS 127           H        HIS 127  23.604   4.321 -12.336
  953    HA   HIS 127           HA       HIS 127  26.436   5.225 -12.019
  954   1HB   HIS 127          2HB       HIS 127  24.152   6.750 -12.025
  955   2HB   HIS 127          1HB       HIS 127  24.387   6.463 -10.301
  956    HD2  HIS 127           HD2      HIS 127  27.814   6.503 -10.620
  957    HE1  HIS 127           HE1      HIS 127  27.082  10.530 -11.666
  958    HE2  HIS 127           HE2      HIS 127  28.853   8.878 -10.910
  959    H    HIS 128           H        HIS 128  26.080   2.655 -11.263
  960    HA   HIS 128           HA       HIS 128  25.645   2.741  -8.308
  961   1HB   HIS 128          2HB       HIS 128  25.655   0.408 -10.248
  962   2HB   HIS 128          1HB       HIS 128  25.479   0.250  -8.500
  963    HD2  HIS 128           HD2      HIS 128  22.995   1.312  -7.459
  964    HE1  HIS 128           HE1      HIS 128  21.154   1.676 -11.242
  965    HE2  HIS 128           HE2      HIS 128  20.761   1.736  -8.736
  966    H    HIS 129           H        HIS 129  27.411   2.511  -7.011
  967    HA   HIS 129           HA       HIS 129  30.058   2.360  -8.153
  968   1HB   HIS 129          2HB       HIS 129  29.859   3.552  -6.102
  969   2HB   HIS 129          1HB       HIS 129  29.001   2.221  -5.325
  970    HD2  HIS 129           HD2      HIS 129  31.398   2.557  -3.491
  971    HE1  HIS 129           HE1      HIS 129  33.782   0.158  -6.021
  972    HE2  HIS 129           HE2      HIS 129  33.608   1.188  -3.710
  973    H    HIS 130           H        HIS 130  29.490   0.285  -5.420
  974    HA   HIS 130           HA       HIS 130  30.433  -2.018  -7.049
  975   1HB   HIS 130          2HB       HIS 130  31.459  -1.224  -4.762
  976   2HB   HIS 130          1HB       HIS 130  30.091  -2.093  -4.064
  977    HD2  HIS 130           HD2      HIS 130  30.356  -4.483  -6.603
  978    HE1  HIS 130           HE1      HIS 130  33.903  -5.357  -4.483
  979    HE2  HIS 130           HE2      HIS 130  32.250  -6.231  -6.198
  980    H    HIS 131           H        HIS 131  27.598  -0.924  -6.953
  981    HA   HIS 131           HA       HIS 131  25.419  -1.791  -6.847
  982   1HB   HIS 131          2HB       HIS 131  27.016  -3.670  -8.073
  983   2HB   HIS 131          1HB       HIS 131  26.280  -4.604  -6.772
  984    HD2  HIS 131           HD2      HIS 131  25.393  -4.033 -10.276
  985    HE1  HIS 131           HE1      HIS 131  21.654  -3.779  -8.328
  986    HE2  HIS 131           HE2      HIS 131  22.802  -4.038 -10.574
  987    H    HIS 132           HN       HIS 132  27.515  -2.001  -4.375
  988    HA   HIS 132           HA       HIS 132  25.698  -3.630  -2.657
  989   1HB   HIS 132          2HB       HIS 132  28.571  -2.747  -2.274
  990   2HB   HIS 132          1HB       HIS 132  27.626  -3.568  -1.032
  991    HD2  HIS 132           HD2      HIS 132  29.517  -5.795  -1.436
  992    HE1  HIS 132           HE1      HIS 132  27.746  -6.968  -5.087
  993    HE2  HIS 132           HE2      HIS 132  29.353  -7.662  -3.251
  Start of MODEL   15
    1   1H    MET   1          1H        MET   1 -30.279  13.715   5.235
    2   2H    MET   1          2H        MET   1 -31.029  15.201   5.577
    3   3H    MET   1          3H        MET   1 -30.329  14.930   4.053
    4    HA   MET   1           HA       MET   1 -32.954  14.561   4.710
    5   1HB   MET   1          2HB       MET   1 -31.277  13.451   2.440
    6   2HB   MET   1          1HB       MET   1 -33.041  13.483   2.445
    7   1HG   MET   1          2HG       MET   1 -31.232  15.907   2.674
    8   2HG   MET   1          1HG       MET   1 -32.139  15.433   1.238
    9   1HE   MET   1          1HE       MET   1 -34.487  17.191   0.922
   10   2HE   MET   1          2HE       MET   1 -32.776  17.576   1.093
   11   3HE   MET   1          3HE       MET   1 -33.971  18.468   2.031
   12    H    SER   2           H        SER   2 -30.589  11.949   4.046
   13    HA   SER   2           HA       SER   2 -32.508  10.050   5.317
   14   1HB   SER   2          2HB       SER   2 -31.744   8.426   3.891
   15   2HB   SER   2          1HB       SER   2 -31.288   9.817   2.911
   16    HG   SER   2           HG       SER   2 -29.651   8.486   4.817
   17    H    HIS   3           H        HIS   3 -29.077  11.010   5.291
   18    HA   HIS   3           HA       HIS   3 -28.862  10.496   8.143
   19   1HB   HIS   3          2HB       HIS   3 -28.673   8.191   6.981
   20   2HB   HIS   3          1HB       HIS   3 -27.108   8.763   6.400
   21    HD2  HIS   3           HD2      HIS   3 -28.290   6.812   9.336
   22    HE1  HIS   3           HE1      HIS   3 -25.073   9.082  10.866
   23    HE2  HIS   3           HE2      HIS   3 -26.618   7.121  11.315
   24    H    GLN   4           H        GLN   4 -26.310  10.095   5.706
   25    HA   GLN   4           HA       GLN   4 -25.372  12.861   6.205
   26   1HB   GLN   4          2HB       GLN   4 -23.858  10.352   6.943
   27   2HB   GLN   4          1HB       GLN   4 -23.026  11.874   6.618
   28   1HG   GLN   4          2HG       GLN   4 -25.285  11.637   8.619
   29   2HG   GLN   4          1HG       GLN   4 -23.589  11.445   9.062
   30   1HE2  GLN   4          1HE2      GLN   4 -24.374  13.502  10.405
   31   2HE2  GLN   4          2HE2      GLN   4 -24.107  14.999   9.650
   32    H    ASP   5           H        ASP   5 -23.629  13.463   4.668
   33    HA   ASP   5           HA       ASP   5 -23.744  11.784   2.192
   34   1HB   ASP   5          2HB       ASP   5 -24.831  13.877   1.749
   35   2HB   ASP   5          1HB       ASP   5 -23.547  14.785   2.550
   36    H    ASP   6           H        ASP   6 -21.740  11.924   0.840
   37    HA   ASP   6           HA       ASP   6 -19.418  11.609   0.667
   38   1HB   ASP   6          2HB       ASP   6 -19.221  13.790   2.756
   39   2HB   ASP   6          1HB       ASP   6 -18.063  13.402   1.483
   40    H    TYR   7           H        TYR   7 -17.552  10.734   1.858
   41    HA   TYR   7           HA       TYR   7 -18.263   9.811   4.611
   42   1HB   TYR   7          2HB       TYR   7 -17.141   8.222   2.298
   43   2HB   TYR   7          1HB       TYR   7 -16.988   7.678   3.968
   44    HD1  TYR   7           HD1      TYR   7 -19.050   7.278   5.344
   45    HD2  TYR   7           HD2      TYR   7 -19.224   8.080   1.128
   46    HE1  TYR   7           HE1      TYR   7 -21.369   6.402   5.273
   47    HE2  TYR   7           HE2      TYR   7 -21.544   7.204   1.058
   48    HH   TYR   7           HH       TYR   7 -23.397   6.795   2.503
   49    H    LEU   8           H        LEU   8 -16.359   9.291   5.944
   50    HA   LEU   8           HA       LEU   8 -14.190  11.201   5.462
   51   1HB   LEU   8          2HB       LEU   8 -13.336  10.214   7.671
   52   2HB   LEU   8          1HB       LEU   8 -14.897  11.035   7.733
   53    HG   LEU   8           HG       LEU   8 -15.321   8.283   7.014
   54   1HD1  LEU   8          1HD1      LEU   8 -13.786   8.700   9.596
   55   2HD1  LEU   8          2HD1      LEU   8 -13.132   7.927   8.153
   56   3HD1  LEU   8          3HD1      LEU   8 -14.472   7.181   9.022
   57   1HD2  LEU   8          1HD2      LEU   8 -17.052   9.579   8.036
   58   2HD2  LEU   8          2HD2      LEU   8 -16.008  10.041   9.381
   59   3HD2  LEU   8          3HD2      LEU   8 -16.582   8.378   9.240
   60    H    SER   9           H        SER   9 -13.950   9.564   3.385
   61    HA   SER   9           HA       SER   9 -11.641   7.812   4.116
   62   1HB   SER   9          2HB       SER   9 -12.776   6.724   1.791
   63   2HB   SER   9          1HB       SER   9 -12.830   6.033   3.411
   64    HG   SER   9           HG       SER   9 -14.896   6.543   2.215
   65    H    VAL  10           H        VAL  10 -13.299   9.275   1.292
   66    HA   VAL  10           HA       VAL  10 -11.282   9.323  -0.572
   67    HB   VAL  10           HB       VAL  10 -12.241  11.329  -1.483
   68   1HG1  VAL  10          1HG1      VAL  10 -14.651  10.841  -1.350
   69   2HG1  VAL  10          2HG1      VAL  10 -14.378   9.850   0.083
   70   3HG1  VAL  10          3HG1      VAL  10 -13.723   9.347  -1.475
   71   1HG2  VAL  10          1HG2      VAL  10 -13.104  11.805   1.373
   72   2HG2  VAL  10          2HG2      VAL  10 -13.887  12.634   0.027
   73   3HG2  VAL  10          3HG2      VAL  10 -12.164  12.865   0.322
   74    H    GLU  11           H        GLU  11 -11.425  11.191   2.402
   75    HA   GLU  11           HA       GLU  11  -9.081  12.808   1.705
   76   1HB   GLU  11          2HB       GLU  11 -11.101  13.320   3.366
   77   2HB   GLU  11          1HB       GLU  11 -10.035  12.527   4.527
   78   1HG   GLU  11          2HG       GLU  11  -9.450  14.825   4.645
   79   2HG   GLU  11          1HG       GLU  11  -8.193  14.093   3.646
   80    H    GLU  12           H        GLU  12  -9.707  10.452   4.345
   81    HA   GLU  12           HA       GLU  12  -7.151  10.070   5.285
   82   1HB   GLU  12          2HB       GLU  12  -7.895   8.086   6.190
   83   2HB   GLU  12          1HB       GLU  12  -9.452   8.748   5.698
   84   1HG   GLU  12          2HG       GLU  12  -9.483   6.562   4.819
   85   2HG   GLU  12          1HG       GLU  12  -9.010   7.551   3.438
   86    H    LEU  13           H        LEU  13  -8.426   9.010   2.184
   87    HA   LEU  13           HA       LEU  13  -6.198   7.315   1.479
   88   1HB   LEU  13          2HB       LEU  13  -8.423   8.663  -0.024
   89   2HB   LEU  13          1HB       LEU  13  -7.077   7.964  -0.925
   90    HG   LEU  13           HG       LEU  13  -8.127   6.211   1.192
   91   1HD1  LEU  13          1HD1      LEU  13 -10.220   7.327   0.413
   92   2HD1  LEU  13          2HD1      LEU  13 -10.173   5.612   0.002
   93   3HD1  LEU  13          3HD1      LEU  13  -9.840   6.825  -1.234
   94   1HD2  LEU  13          1HD2      LEU  13  -6.485   5.482  -0.481
   95   2HD2  LEU  13          2HD2      LEU  13  -7.601   5.899  -1.782
   96   3HD2  LEU  13          3HD2      LEU  13  -7.986   4.576  -0.680
   97    H    ILE  14           H        ILE  14  -7.064  10.599   0.334
   98    HA   ILE  14           HA       ILE  14  -4.640  11.176  -0.980
   99    HB   ILE  14           HB       ILE  14  -6.676  12.901   0.423
  100   1HG1  ILE  14          2HG1      ILE  14  -5.838  13.036  -2.462
  101   2HG1  ILE  14          1HG1      ILE  14  -6.890  11.726  -1.923
  102   1HG2  ILE  14          1HG2      ILE  14  -5.418  14.842  -0.679
  103   2HG2  ILE  14          2HG2      ILE  14  -4.053  13.736  -0.830
  104   3HG2  ILE  14          3HG2      ILE  14  -4.677  14.154   0.766
  105   1HD1  ILE  14          1HD1      ILE  14  -7.748  14.313  -0.877
  106   2HD1  ILE  14          2HD1      ILE  14  -8.673  13.102  -1.763
  107   3HD1  ILE  14          3HD1      ILE  14  -7.711  14.291  -2.640
  108    H    GLU  15           H        GLU  15  -5.475  11.379   2.445
  109    HA   GLU  15           HA       GLU  15  -3.173  12.799   3.342
  110   1HB   GLU  15          2HB       GLU  15  -5.172  10.962   4.588
  111   2HB   GLU  15          1HB       GLU  15  -3.673  11.251   5.472
  112   1HG   GLU  15          2HG       GLU  15  -4.917  13.678   4.341
  113   2HG   GLU  15          1HG       GLU  15  -5.862  12.884   5.601
  114    H    ILE  16           H        ILE  16  -3.732   9.264   3.582
  115    HA   ILE  16           HA       ILE  16  -1.089   8.564   4.251
  116    HB   ILE  16           HB       ILE  16  -3.135   7.022   2.632
  117   1HG1  ILE  16          2HG1      ILE  16  -2.343   6.570   5.505
  118   2HG1  ILE  16          1HG1      ILE  16  -3.548   7.790   5.092
  119   1HG2  ILE  16          1HG2      ILE  16  -0.354   6.454   3.251
  120   2HG2  ILE  16          2HG2      ILE  16  -1.479   5.541   2.245
  121   3HG2  ILE  16          3HG2      ILE  16  -1.422   5.257   3.985
  122   1HD1  ILE  16          1HD1      ILE  16  -4.895   6.092   3.933
  123   2HD1  ILE  16          2HD1      ILE  16  -4.609   5.612   5.606
  124   3HD1  ILE  16          3HD1      ILE  16  -3.683   4.865   4.304
  125    H    GLN  17           H        GLN  17  -2.520   8.321   0.967
  126    HA   GLN  17           HA       GLN  17  -0.213   7.748  -0.469
  127   1HB   GLN  17          2HB       GLN  17  -2.628   9.417  -1.144
  128   2HB   GLN  17          1HB       GLN  17  -1.309   9.248  -2.305
  129   1HG   GLN  17          2HG       GLN  17  -2.362   6.768  -1.007
  130   2HG   GLN  17          1HG       GLN  17  -3.336   7.520  -2.271
  131   1HE2  GLN  17          1HE2      GLN  17  -0.864   5.286  -1.794
  132   2HE2  GLN  17          2HE2      GLN  17  -0.180   5.319  -3.348
  133    H    LYS  18           H        LYS  18  -1.364  11.018   0.428
  134    HA   LYS  18           HA       LYS  18   0.797  12.456  -0.735
  135   1HB   LYS  18          2HB       LYS  18  -1.361  13.408   0.233
  136   2HB   LYS  18          1HB       LYS  18  -0.621  13.230   1.824
  137   1HG   LYS  18          2HG       LYS  18   0.911  14.909   1.455
  138   2HG   LYS  18          1HG       LYS  18   0.986  14.603  -0.281
  139   1HD   LYS  18          2HD       LYS  18  -0.147  16.765   0.298
  140   2HD   LYS  18          1HD       LYS  18  -1.174  15.660  -0.615
  141   1HE   LYS  18          2HE       LYS  18  -2.177  16.817   1.490
  142   2HE   LYS  18          1HE       LYS  18  -2.451  15.088   1.276
  143   1HZ   LYS  18          1HZ       LYS  18  -0.448  16.401   3.021
  144   2HZ   LYS  18          2HZ       LYS  18  -0.417  14.740   2.663
  145   3HZ   LYS  18          3HZ       LYS  18  -1.741  15.409   3.491
  146    H    GLU  19           H        GLU  19   0.382  11.520   2.703
  147    HA   GLU  19           HA       GLU  19   2.900  12.306   3.640
  148   1HB   GLU  19          2HB       GLU  19   1.114  11.438   5.108
  149   2HB   GLU  19          1HB       GLU  19   1.347   9.824   4.436
  150   1HG   GLU  19          2HG       GLU  19   2.869   9.497   6.071
  151   2HG   GLU  19          1HG       GLU  19   3.913  10.608   5.185
  152    H    GLU  20           H        GLU  20   2.107   8.939   2.694
  153    HA   GLU  20           HA       GLU  20   4.626   7.826   2.689
  154   1HB   GLU  20          2HB       GLU  20   2.512   6.656   2.009
  155   2HB   GLU  20          1HB       GLU  20   2.635   7.441   0.435
  156   1HG   GLU  20          2HG       GLU  20   4.969   6.436   0.254
  157   2HG   GLU  20          1HG       GLU  20   4.563   5.463   1.667
  158    H    THR  21           H        THR  21   3.263   9.165  -0.344
  159    HA   THR  21           HA       THR  21   5.539   9.247  -1.891
  160    HB   THR  21           HB       THR  21   3.527  11.506  -1.667
  161    HG1  THR  21           HG1      THR  21   3.332   9.697  -3.707
  162   1HG2  THR  21          1HG2      THR  21   4.213  11.498  -4.239
  163   2HG2  THR  21          2HG2      THR  21   5.705  10.816  -3.592
  164   3HG2  THR  21          3HG2      THR  21   5.149  12.399  -3.047
  165    H    ARG  22           H        ARG  22   4.538  12.104   0.036
  166    HA   ARG  22           HA       ARG  22   6.717  13.718  -0.152
  167   1HB   ARG  22          2HB       ARG  22   4.738  13.240   1.887
  168   2HB   ARG  22          1HB       ARG  22   6.294  13.558   2.652
  169   1HG   ARG  22          2HG       ARG  22   6.544  15.629   1.405
  170   2HG   ARG  22          1HG       ARG  22   5.079  15.293   0.484
  171   1HD   ARG  22          2HD       ARG  22   5.253  15.798   3.468
  172   2HD   ARG  22          1HD       ARG  22   4.547  16.872   2.261
  173    HE   ARG  22           HE       ARG  22   3.129  14.511   1.955
  174   1HH1  ARG  22          1HH2      ARG  22   3.932  16.634   4.550
  175   2HH1  ARG  22          2HH2      ARG  22   2.484  16.306   5.442
  176   1HH2  ARG  22          2HH1      ARG  22   1.234  14.071   3.104
  177   2HH2  ARG  22          1HH1      ARG  22   0.956  14.854   4.624
  178    H    ASP  23           H        ASP  23   6.637  10.656   1.618
  179    HA   ASP  23           HA       ASP  23   9.303  10.974   2.730
  180   1HB   ASP  23          2HB       ASP  23   7.219   9.297   3.271
  181   2HB   ASP  23          1HB       ASP  23   8.267   8.231   2.336
  182    H    ILE  24           H        ILE  24   7.942   9.204  -0.051
  183    HA   ILE  24           HA       ILE  24  10.377   8.014  -0.926
  184    HB   ILE  24           HB       ILE  24   8.068   8.969  -2.645
  185   1HG1  ILE  24          2HG1      ILE  24   8.510   6.294  -1.278
  186   2HG1  ILE  24          1HG1      ILE  24   7.353   7.516  -0.751
  187   1HG2  ILE  24          1HG2      ILE  24   9.394   6.505  -3.420
  188   2HG2  ILE  24          2HG2      ILE  24  10.547   7.835  -3.332
  189   3HG2  ILE  24          3HG2      ILE  24   9.125   7.968  -4.366
  190   1HD1  ILE  24          1HD1      ILE  24   6.761   5.494  -2.498
  191   2HD1  ILE  24          2HD1      ILE  24   7.159   6.806  -3.607
  192   3HD1  ILE  24          3HD1      ILE  24   5.881   7.019  -2.410
  193    H    ILE  25           H        ILE  25   8.809  11.030  -2.064
  194    HA   ILE  25           HA       ILE  25  10.817  11.880  -3.832
  195    HB   ILE  25           HB       ILE  25   9.355  13.779  -1.992
  196   1HG1  ILE  25          2HG1      ILE  25   7.713  12.149  -2.772
  197   2HG1  ILE  25          1HG1      ILE  25   7.486  13.661  -3.650
  198   1HG2  ILE  25          1HG2      ILE  25   9.338  14.581  -4.706
  199   2HG2  ILE  25          2HG2      ILE  25  10.970  14.001  -4.377
  200   3HG2  ILE  25          3HG2      ILE  25  10.275  15.286  -3.390
  201   1HD1  ILE  25          1HD1      ILE  25   8.462  11.031  -4.629
  202   2HD1  ILE  25          2HD1      ILE  25   9.263  12.456  -5.290
  203   3HD1  ILE  25          3HD1      ILE  25   7.519  12.264  -5.466
  204    H    GLN  26           H        GLN  26  10.505  12.837  -0.389
  205    HA   GLN  26           HA       GLN  26  12.918  14.250  -0.160
  206   1HB   GLN  26          2HB       GLN  26  11.625  12.438   1.904
  207   2HB   GLN  26          1HB       GLN  26  12.845  13.664   2.249
  208   1HG   GLN  26          2HG       GLN  26  10.514  14.616   0.694
  209   2HG   GLN  26          1HG       GLN  26  10.164  14.136   2.355
  210   1HE2  GLN  26          1HE2      GLN  26  12.651  16.052   0.562
  211   2HE2  GLN  26          2HE2      GLN  26  12.791  17.252   1.755
  212    H    ALA  27           H        ALA  27  12.379  10.788  -0.324
  213    HA   ALA  27           HA       ALA  27  15.015  10.025   0.595
  214   1HB   ALA  27          1HB       ALA  27  14.235   7.908   0.354
  215   2HB   ALA  27          2HB       ALA  27  13.714   8.198  -1.305
  216   3HB   ALA  27          3HB       ALA  27  12.676   8.670   0.040
  217    H    LEU  28           H        LEU  28  13.625   9.765  -2.699
  218    HA   LEU  28           HA       LEU  28  16.052   9.388  -4.064
  219   1HB   LEU  28          2HB       LEU  28  13.621  10.920  -5.038
  220   2HB   LEU  28          1HB       LEU  28  14.882  10.231  -6.061
  221    HG   LEU  28           HG       LEU  28  13.124   8.635  -4.174
  222   1HD1  LEU  28          1HD1      LEU  28  11.742   8.123  -5.953
  223   2HD1  LEU  28          2HD1      LEU  28  13.014   8.370  -7.149
  224   3HD1  LEU  28          3HD1      LEU  28  12.209   9.759  -6.418
  225   1HD2  LEU  28          1HD2      LEU  28  15.453   8.020  -5.940
  226   2HD2  LEU  28          2HD2      LEU  28  14.145   6.838  -5.889
  227   3HD2  LEU  28          3HD2      LEU  28  14.984   7.288  -4.405
  228    H    LEU  29           H        LEU  29  14.483  12.423  -3.091
  229    HA   LEU  29           HA       LEU  29  16.322  14.174  -4.415
  230   1HB   LEU  29          2HB       LEU  29  14.012  14.533  -3.003
  231   2HB   LEU  29          1HB       LEU  29  15.205  15.090  -1.830
  232    HG   LEU  29           HG       LEU  29  14.446  16.952  -3.251
  233   1HD1  LEU  29          1HD1      LEU  29  16.706  17.639  -4.120
  234   2HD1  LEU  29          2HD1      LEU  29  17.288  16.019  -3.742
  235   3HD1  LEU  29          3HD1      LEU  29  16.726  17.077  -2.449
  236   1HD2  LEU  29          1HD2      LEU  29  14.344  15.061  -5.249
  237   2HD2  LEU  29          2HD2      LEU  29  15.800  15.961  -5.673
  238   3HD2  LEU  29          3HD2      LEU  29  14.259  16.803  -5.512
  239    H    GLU  30           H        GLU  30  16.173  13.219  -0.960
  240    HA   GLU  30           HA       GLU  30  18.578  14.410  -0.129
  241   1HB   GLU  30          2HB       GLU  30  17.084  11.957   0.765
  242   2HB   GLU  30          1HB       GLU  30  18.644  12.349   1.488
  243   1HG   GLU  30          2HG       GLU  30  17.862  14.324   2.441
  244   2HG   GLU  30          1HG       GLU  30  16.560  14.497   1.263
  245    H    ASP  31           H        ASP  31  18.072  11.556  -2.078
  246    HA   ASP  31           HA       ASP  31  20.713  10.435  -1.733
  247   1HB   ASP  31          2HB       ASP  31  18.338   9.887  -3.329
  248   2HB   ASP  31          1HB       ASP  31  19.815   9.668  -4.268
  249    H    GLY  32           H        GLY  32  19.291  12.745  -4.019
  250   1HA   GLY  32          2HA       GLY  32  20.959  14.526  -4.742
  251   2HA   GLY  32          1HA       GLY  32  22.038  13.184  -5.123
  252    H    SER  33           H        SER  33  18.701  12.640  -5.745
  253    HA   SER  33           HA       SER  33  18.956  11.956  -8.427
  254   1HB   SER  33          2HB       SER  33  16.522  12.506  -8.638
  255   2HB   SER  33          1HB       SER  33  16.892  11.550  -7.205
  256    HG   SER  33           HG       SER  33  15.518  13.413  -6.842
  257    H    ASP  34           H        ASP  34  18.030  13.220 -10.350
  258    HA   ASP  34           HA       ASP  34  18.927  16.073 -10.186
  259   1HB   ASP  34          2HB       ASP  34  19.286  13.989 -12.334
  260   2HB   ASP  34          1HB       ASP  34  19.332  15.708 -12.730
  261    HA   PRO  35           HA       PRO  35  14.391  16.220 -10.975
  262   1HB   PRO  35          2HB       PRO  35  15.017  19.086 -10.467
  263   2HB   PRO  35          1HB       PRO  35  13.741  18.069  -9.774
  264   1HG   PRO  35          2HG       PRO  35  15.905  18.771  -8.374
  265   2HG   PRO  35          1HG       PRO  35  15.119  17.197  -8.168
  266   1HD   PRO  35          2HD       PRO  35  17.687  17.852  -9.539
  267   2HD   PRO  35          1HD       PRO  35  17.208  16.369  -8.684
  268    H    ASP  36           H        ASP  36  17.020  18.100 -12.377
  269    HA   ASP  36           HA       ASP  36  15.362  19.222 -14.506
  270   1HB   ASP  36          2HB       ASP  36  17.856  19.555 -15.451
  271   2HB   ASP  36          1HB       ASP  36  17.176  20.603 -14.205
  272    H    ALA  37           H        ALA  37  16.025  16.140 -13.973
  273    HA   ALA  37           HA       ALA  37  16.796  15.509 -16.785
  274   1HB   ALA  37          1HB       ALA  37  17.950  13.768 -15.937
  275   2HB   ALA  37          2HB       ALA  37  16.540  13.203 -15.040
  276   3HB   ALA  37          3HB       ALA  37  17.611  14.411 -14.330
  277    H    LEU  38           H        LEU  38  14.057  16.216 -15.355
  278    HA   LEU  38           HA       LEU  38  11.815  15.629 -15.722
  279   1HB   LEU  38          2HB       LEU  38  12.705  15.613 -18.112
  280   2HB   LEU  38          1HB       LEU  38  12.877  13.866 -17.942
  281    HG   LEU  38           HG       LEU  38  10.380  13.988 -17.124
  282   1HD1  LEU  38          1HD1      LEU  38  10.253  16.284 -19.042
  283   2HD1  LEU  38          2HD1      LEU  38  10.668  16.621 -17.362
  284   3HD1  LEU  38          3HD1      LEU  38   9.136  15.841 -17.751
  285   1HD2  LEU  38          1HD2      LEU  38  11.513  14.060 -19.897
  286   2HD2  LEU  38          2HD2      LEU  38   9.760  14.087 -19.708
  287   3HD2  LEU  38          3HD2      LEU  38  10.696  12.742 -19.057
  288    H    TYR  39           H        TYR  39  10.369  13.990 -15.080
  289    HA   TYR  39           HA       TYR  39  11.601  11.351 -14.406
  290   1HB   TYR  39          2HB       TYR  39  10.346  13.334 -12.626
  291   2HB   TYR  39          1HB       TYR  39   9.701  11.703 -12.448
  292    HD1  TYR  39           HD1      TYR  39  11.089   9.870 -11.661
  293    HD2  TYR  39           HD2      TYR  39  12.724  13.804 -12.202
  294    HE1  TYR  39           HE1      TYR  39  13.111   9.203 -10.390
  295    HE2  TYR  39           HE2      TYR  39  14.747  13.138 -10.929
  296    HH   TYR  39           HH       TYR  39  15.200   9.798  -9.821
  297    H    GLU  40           H        GLU  40  10.068   9.581 -14.386
  298    HA   GLU  40           HA       GLU  40   7.556  10.208 -15.887
  299   1HB   GLU  40          2HB       GLU  40   7.873   7.610 -16.431
  300   2HB   GLU  40          1HB       GLU  40   8.674   8.856 -17.389
  301   1HG   GLU  40          2HG       GLU  40  10.716   8.616 -16.101
  302   2HG   GLU  40          1HG       GLU  40   9.927   7.501 -14.985
  303    H    ILE  41           H        ILE  41   5.768   9.927 -14.653
  304    HA   ILE  41           HA       ILE  41   5.942   8.171 -12.263
  305    HB   ILE  41           HB       ILE  41   3.547   9.847 -12.975
  306   1HG1  ILE  41          2HG1      ILE  41   5.323  11.428 -13.270
  307   2HG1  ILE  41          1HG1      ILE  41   4.699  11.696 -11.642
  308   1HG2  ILE  41          1HG2      ILE  41   2.942   9.348 -10.863
  309   2HG2  ILE  41          2HG2      ILE  41   4.502   9.877 -10.232
  310   3HG2  ILE  41          3HG2      ILE  41   4.300   8.224 -10.811
  311   1HD1  ILE  41          1HD1      ILE  41   7.296  10.494 -12.504
  312   2HD1  ILE  41          2HD1      ILE  41   6.555   9.884 -11.025
  313   3HD1  ILE  41          3HD1      ILE  41   6.958  11.595 -11.168
  314    H    GLU  42           H        GLU  42   4.208   6.605 -11.871
  315    HA   GLU  42           HA       GLU  42   2.651   5.837 -14.290
  316   1HB   GLU  42          2HB       GLU  42   4.612   4.411 -14.363
  317   2HB   GLU  42          1HB       GLU  42   4.424   3.997 -12.658
  318   1HG   GLU  42          2HG       GLU  42   2.731   2.518 -13.066
  319   2HG   GLU  42          1HG       GLU  42   2.053   3.498 -14.367
  320    H    HIS  43           H        HIS  43   0.555   5.530 -13.724
  321    HA   HIS  43           HA       HIS  43  -0.039   4.967 -10.848
  322   1HB   HIS  43          2HB       HIS  43  -1.817   6.236 -12.954
  323   2HB   HIS  43          1HB       HIS  43  -2.220   6.019 -11.251
  324    HD2  HIS  43           HD2      HIS  43  -0.514   8.624 -13.476
  325    HE1  HIS  43           HE1      HIS  43   0.613   9.556  -9.514
  326    HE2  HIS  43           HE2      HIS  43   0.600  10.387 -11.911
  327    H    HIS  44           H        HIS  44  -1.174   3.119 -10.366
  328    HA   HIS  44           HA       HIS  44  -1.897   1.356 -12.652
  329   1HB   HIS  44          2HB       HIS  44  -1.170   0.924  -9.785
  330   2HB   HIS  44          1HB       HIS  44  -2.261  -0.241 -10.535
  331    HD2  HIS  44           HD2      HIS  44  -1.051  -1.069 -13.256
  332    HE1  HIS  44           HE1      HIS  44   2.818  -0.936 -11.570
  333    HE2  HIS  44           HE2      HIS  44   1.445  -1.775 -13.530
  334    H    LEU  45           H        LEU  45  -4.024   1.207 -13.214
  335    HA   LEU  45           HA       LEU  45  -6.062   1.708 -11.085
  336   1HB   LEU  45          2HB       LEU  45  -6.309   2.680 -13.943
  337   2HB   LEU  45          1HB       LEU  45  -7.379   3.050 -12.591
  338    HG   LEU  45           HG       LEU  45  -5.044   3.901 -11.543
  339   1HD1  LEU  45          1HD1      LEU  45  -3.671   4.957 -13.223
  340   2HD1  LEU  45          2HD1      LEU  45  -4.814   4.534 -14.498
  341   3HD1  LEU  45          3HD1      LEU  45  -3.876   3.271 -13.698
  342   1HD2  LEU  45          1HD2      LEU  45  -7.112   5.221 -11.734
  343   2HD2  LEU  45          2HD2      LEU  45  -6.817   5.454 -13.457
  344   3HD2  LEU  45          3HD2      LEU  45  -5.730   6.175 -12.270
  345    H    PHE  46           H        PHE  46  -7.732   0.241 -11.094
  346    HA   PHE  46           HA       PHE  46  -7.881  -1.616 -13.434
  347   1HB   PHE  46          2HB       PHE  46  -8.893  -2.988 -11.205
  348   2HB   PHE  46          1HB       PHE  46  -7.348  -3.276 -12.004
  349    HD1  PHE  46           HD1      PHE  46  -8.819  -2.578  -8.921
  350    HD2  PHE  46           HD2      PHE  46  -5.482  -1.411 -11.361
  351    HE1  PHE  46           HE1      PHE  46  -7.625  -1.769  -6.903
  352    HE2  PHE  46           HE2      PHE  46  -4.288  -0.603  -9.343
  353    HZ   PHE  46           HZ       PHE  46  -5.360  -0.781  -7.114
  354    H    ALA  47           H        ALA  47 -10.021  -2.446 -13.893
  355    HA   ALA  47           HA       ALA  47 -12.230  -0.911 -12.590
  356   1HB   ALA  47          1HB       ALA  47 -11.802   0.168 -14.724
  357   2HB   ALA  47          2HB       ALA  47 -13.302  -0.751 -14.855
  358   3HB   ALA  47          3HB       ALA  47 -11.814  -1.388 -15.556
  359    H    GLU  48           H        GLU  48 -14.422  -1.985 -13.514
  360    HA   GLU  48           HA       GLU  48 -14.082  -4.917 -13.067
  361   1HB   GLU  48          2HB       GLU  48 -15.508  -3.533 -11.466
  362   2HB   GLU  48          1HB       GLU  48 -16.640  -3.323 -12.801
  363   1HG   GLU  48          2HG       GLU  48 -16.383  -5.970 -12.963
  364   2HG   GLU  48          1HG       GLU  48 -15.967  -5.791 -11.258
  365    H    ASP  49           H        ASP  49 -15.535  -2.498 -15.190
  366    HA   ASP  49           HA       ASP  49 -16.324  -4.720 -17.033
  367   1HB   ASP  49          2HB       ASP  49 -17.795  -2.468 -16.083
  368   2HB   ASP  49          1HB       ASP  49 -17.495  -2.216 -17.804
  369    H    PHE  50           H        PHE  50 -15.500  -4.685 -19.111
  370    HA   PHE  50           HA       PHE  50 -13.122  -3.195 -19.642
  371   1HB   PHE  50          2HB       PHE  50 -13.540  -5.289 -20.798
  372   2HB   PHE  50          1HB       PHE  50 -15.015  -4.642 -21.517
  373    HD1  PHE  50           HD1      PHE  50 -14.942  -3.104 -23.385
  374    HD2  PHE  50           HD2      PHE  50 -11.322  -4.470 -21.518
  375    HE1  PHE  50           HE1      PHE  50 -13.623  -2.197 -25.279
  376    HE2  PHE  50           HE2      PHE  50 -10.003  -3.563 -23.413
  377    HZ   PHE  50           HZ       PHE  50 -11.154  -2.426 -25.294
  378    H    ASP  51           H        ASP  51 -16.516  -2.588 -20.384
  379    HA   ASP  51           HA       ASP  51 -16.150  -0.479 -22.267
  380   1HB   ASP  51          2HB       ASP  51 -18.363  -0.896 -20.233
  381   2HB   ASP  51          1HB       ASP  51 -18.440   0.225 -21.593
  382    H    LYS  52           H        LYS  52 -17.144  -0.031 -18.852
  383    HA   LYS  52           HA       LYS  52 -16.598   2.684 -18.624
  384   1HB   LYS  52          2HB       LYS  52 -17.506   1.046 -16.840
  385   2HB   LYS  52          1HB       LYS  52 -15.814   0.766 -16.429
  386   1HG   LYS  52          2HG       LYS  52 -15.955   2.596 -15.113
  387   2HG   LYS  52          1HG       LYS  52 -16.011   3.542 -16.600
  388   1HD   LYS  52          2HD       LYS  52 -18.484   2.330 -15.349
  389   2HD   LYS  52          1HD       LYS  52 -17.920   3.956 -14.961
  390   1HE   LYS  52          2HE       LYS  52 -17.992   4.509 -17.401
  391   2HE   LYS  52          1HE       LYS  52 -18.699   2.921 -17.702
  392   1HZ   LYS  52          1HZ       LYS  52 -20.533   3.496 -16.244
  393   2HZ   LYS  52          2HZ       LYS  52 -20.399   4.626 -17.507
  394   3HZ   LYS  52          3HZ       LYS  52 -19.854   5.022 -15.947
  395    H    LEU  53           H        LEU  53 -14.281   0.006 -18.174
  396    HA   LEU  53           HA       LEU  53 -11.992   1.375 -17.431
  397   1HB   LEU  53          2HB       LEU  53 -12.309  -1.134 -18.034
  398   2HB   LEU  53          1HB       LEU  53 -11.878  -0.641 -19.671
  399    HG   LEU  53           HG       LEU  53 -10.157   0.175 -17.340
  400   1HD1  LEU  53          1HD1      LEU  53  -8.768  -1.898 -18.042
  401   2HD1  LEU  53          2HD1      LEU  53 -10.274  -2.494 -18.740
  402   3HD1  LEU  53          3HD1      LEU  53 -10.173  -2.163 -17.011
  403   1HD2  LEU  53          1HD2      LEU  53  -9.593   1.268 -19.381
  404   2HD2  LEU  53          2HD2      LEU  53  -9.814  -0.207 -20.321
  405   3HD2  LEU  53          3HD2      LEU  53  -8.431  -0.051 -19.235
  406    H    GLU  54           H        GLU  54 -13.239   1.032 -20.763
  407    HA   GLU  54           HA       GLU  54 -11.182   2.662 -21.949
  408   1HB   GLU  54          2HB       GLU  54 -12.563   1.098 -23.271
  409   2HB   GLU  54          1HB       GLU  54 -13.992   2.074 -22.931
  410   1HG   GLU  54          2HG       GLU  54 -13.362   3.749 -24.370
  411   2HG   GLU  54          1HG       GLU  54 -11.640   3.497 -24.076
  412    H    LYS  55           H        LYS  55 -14.189   3.370 -20.316
  413    HA   LYS  55           HA       LYS  55 -14.461   6.077 -21.310
  414   1HB   LYS  55          2HB       LYS  55 -15.562   4.722 -18.830
  415   2HB   LYS  55          1HB       LYS  55 -16.019   6.341 -19.360
  416   1HG   LYS  55          2HG       LYS  55 -16.201   4.087 -21.326
  417   2HG   LYS  55          1HG       LYS  55 -17.451   4.233 -20.090
  418   1HD   LYS  55          2HD       LYS  55 -16.657   6.688 -21.611
  419   2HD   LYS  55          1HD       LYS  55 -17.693   5.501 -22.407
  420   1HE   LYS  55          2HE       LYS  55 -19.239   5.601 -20.444
  421   2HE   LYS  55          1HE       LYS  55 -18.240   6.888 -19.767
  422   1HZ   LYS  55          1HZ       LYS  55 -20.310   7.397 -21.286
  423   2HZ   LYS  55          2HZ       LYS  55 -19.165   7.190 -22.523
  424   3HZ   LYS  55          3HZ       LYS  55 -18.922   8.370 -21.324
  425    H    ALA  56           H        ALA  56 -13.293   4.761 -18.185
  426    HA   ALA  56           HA       ALA  56 -12.385   7.325 -17.229
  427   1HB   ALA  56          1HB       ALA  56 -12.884   5.292 -15.800
  428   2HB   ALA  56          2HB       ALA  56 -11.357   6.094 -15.432
  429   3HB   ALA  56          3HB       ALA  56 -11.365   4.603 -16.374
  430    H    ALA  57           H        ALA  57 -10.805   4.668 -18.974
  431    HA   ALA  57           HA       ALA  57  -8.143   5.748 -18.790
  432   1HB   ALA  57          1HB       ALA  57  -9.507   3.711 -20.518
  433   2HB   ALA  57          2HB       ALA  57  -8.131   3.512 -19.432
  434   3HB   ALA  57          3HB       ALA  57  -7.915   4.302 -20.995
  435    H    VAL  58           H        VAL  58 -10.729   6.072 -21.214
  436    HA   VAL  58           HA       VAL  58  -9.268   7.546 -23.147
  437    HB   VAL  58           HB       VAL  58 -12.170   7.378 -22.392
  438   1HG1  VAL  58          1HG1      VAL  58 -10.872   9.405 -24.213
  439   2HG1  VAL  58          2HG1      VAL  58 -12.093   9.669 -22.970
  440   3HG1  VAL  58          3HG1      VAL  58 -12.529   8.867 -24.478
  441   1HG2  VAL  58          1HG2      VAL  58 -12.367   6.278 -24.476
  442   2HG2  VAL  58          2HG2      VAL  58 -10.816   5.713 -23.854
  443   3HG2  VAL  58          3HG2      VAL  58 -10.865   6.976 -25.085
  444    H    GLU  59           H        GLU  59 -11.478   8.883 -20.658
  445    HA   GLU  59           HA       GLU  59 -10.846  11.591 -20.998
  446   1HB   GLU  59          2HB       GLU  59 -12.557  10.453 -19.400
  447   2HB   GLU  59          1HB       GLU  59 -11.222  10.424 -18.247
  448   1HG   GLU  59          2HG       GLU  59 -11.739  12.551 -17.718
  449   2HG   GLU  59          1HG       GLU  59 -11.186  13.015 -19.328
  450    H    ALA  60           H        ALA  60  -9.071   9.108 -19.201
  451    HA   ALA  60           HA       ALA  60  -7.202  10.868 -17.934
  452   1HB   ALA  60          1HB       ALA  60  -6.724   8.016 -18.848
  453   2HB   ALA  60          2HB       ALA  60  -7.534   8.453 -17.344
  454   3HB   ALA  60          3HB       ALA  60  -5.841   8.881 -17.590
  455    H    PHE  61           H        PHE  61  -6.831   8.897 -20.906
  456    HA   PHE  61           HA       PHE  61  -4.311   9.832 -21.700
  457   1HB   PHE  61          2HB       PHE  61  -5.268   8.071 -22.977
  458   2HB   PHE  61          1HB       PHE  61  -6.730   9.000 -23.308
  459    HD1  PHE  61           HD1      PHE  61  -3.055   8.894 -23.952
  460    HD2  PHE  61           HD2      PHE  61  -6.872  10.419 -25.197
  461    HE1  PHE  61           HE1      PHE  61  -2.024   9.783 -26.025
  462    HE2  PHE  61           HE2      PHE  61  -5.842  11.308 -27.271
  463    HZ   PHE  61           HZ       PHE  61  -3.416  10.989 -27.685
  464    H    LYS  62           H        LYS  62  -7.498  11.244 -22.511
  465    HA   LYS  62           HA       LYS  62  -6.615  13.405 -24.069
  466   1HB   LYS  62          2HB       LYS  62  -9.015  12.779 -23.593
  467   2HB   LYS  62          1HB       LYS  62  -8.840  13.553 -22.017
  468   1HG   LYS  62          2HG       LYS  62  -7.942  15.578 -23.462
  469   2HG   LYS  62          1HG       LYS  62  -8.867  14.796 -24.745
  470   1HD   LYS  62          2HD       LYS  62 -10.397  16.305 -23.732
  471   2HD   LYS  62          1HD       LYS  62 -10.816  14.726 -23.066
  472   1HE   LYS  62          2HE       LYS  62  -8.769  15.842 -21.419
  473   2HE   LYS  62          1HE       LYS  62 -10.004  17.080 -21.656
  474   1HZ   LYS  62          1HZ       LYS  62 -10.369  15.494 -19.756
  475   2HZ   LYS  62          2HZ       LYS  62 -10.665  14.290 -20.918
  476   3HZ   LYS  62          3HZ       LYS  62 -11.666  15.661 -20.835
  477    H    MET  63           H        MET  63  -7.183  13.445 -20.528
  478    HA   MET  63           HA       MET  63  -6.337  15.995 -19.896
  479   1HB   MET  63          2HB       MET  63  -5.588  13.446 -18.428
  480   2HB   MET  63          1HB       MET  63  -5.495  15.071 -17.748
  481   1HG   MET  63          2HG       MET  63  -8.068  14.990 -18.744
  482   2HG   MET  63          1HG       MET  63  -7.837  13.346 -18.151
  483   1HE   MET  63          1HE       MET  63  -8.356  12.658 -16.104
  484   2HE   MET  63          2HE       MET  63  -9.760  13.711 -16.255
  485   3HE   MET  63          3HE       MET  63  -8.875  13.648 -14.733
  486    H    GLY  64           H        GLY  64  -4.243  13.213 -20.636
  487   1HA   GLY  64          2HA       GLY  64  -2.212  14.146 -22.020
  488   2HA   GLY  64          1HA       GLY  64  -1.881  15.022 -20.524
  489    H    PHE  65           H        PHE  65  -3.296  11.890 -20.207
  490    HA   PHE  65           HA       PHE  65  -0.724  10.896 -19.093
  491   1HB   PHE  65          2HB       PHE  65  -3.584   9.932 -18.815
  492   2HB   PHE  65          1HB       PHE  65  -2.198   9.068 -18.148
  493    HD1  PHE  65           HD1      PHE  65  -3.559  12.570 -18.257
  494    HD2  PHE  65           HD2      PHE  65  -1.631   9.511 -15.938
  495    HE1  PHE  65           HE1      PHE  65  -3.589  14.056 -16.272
  496    HE2  PHE  65           HE2      PHE  65  -1.661  10.998 -13.953
  497    HZ   PHE  65           HZ       PHE  65  -2.640  13.271 -14.120
  498    H    GLU  66           H        GLU  66  -0.141   8.605 -19.579
  499    HA   GLU  66           HA       GLU  66  -0.930   7.887 -22.375
  500   1HB   GLU  66          2HB       GLU  66   1.616   7.129 -20.908
  501   2HB   GLU  66          1HB       GLU  66   1.256   6.851 -22.612
  502   1HG   GLU  66          2HG       GLU  66   1.017   9.355 -22.876
  503   2HG   GLU  66          1HG       GLU  66   1.642   9.520 -21.236
  504    H    VAL  67           H        VAL  67  -2.715   6.588 -21.736
  505    HA   VAL  67           HA       VAL  67  -2.633   4.610 -19.681
  506    HB   VAL  67           HB       VAL  67  -4.707   5.499 -20.811
  507   1HG1  VAL  67          1HG1      VAL  67  -3.835   5.290 -23.134
  508   2HG1  VAL  67          2HG1      VAL  67  -5.382   4.468 -22.927
  509   3HG1  VAL  67          3HG1      VAL  67  -3.887   3.534 -22.973
  510   1HG2  VAL  67          1HG2      VAL  67  -5.911   3.540 -20.370
  511   2HG2  VAL  67          2HG2      VAL  67  -4.417   3.250 -19.478
  512   3HG2  VAL  67          3HG2      VAL  67  -4.661   2.501 -21.055
  513    H    LEU  68           H        LEU  68  -2.344   2.332 -19.831
  514    HA   LEU  68           HA       LEU  68  -0.950   1.392 -22.304
  515   1HB   LEU  68          2HB       LEU  68   0.472   1.825 -20.125
  516   2HB   LEU  68          1HB       LEU  68  -0.236   0.297 -19.600
  517    HG   LEU  68           HG       LEU  68   0.533  -0.688 -21.814
  518   1HD1  LEU  68          1HD1      LEU  68   1.154   0.891 -23.325
  519   2HD1  LEU  68          2HD1      LEU  68   2.688   0.897 -22.455
  520   3HD1  LEU  68          3HD1      LEU  68   1.453   2.098 -22.075
  521   1HD2  LEU  68          1HD2      LEU  68   1.734  -1.036 -19.660
  522   2HD2  LEU  68          2HD2      LEU  68   2.688   0.414 -19.980
  523   3HD2  LEU  68          3HD2      LEU  68   2.840  -0.993 -21.035
  524    H    GLU  69           H        GLU  69  -1.602  -0.641 -23.015
  525    HA   GLU  69           HA       GLU  69  -4.095  -1.673 -22.473
  526   1HB   GLU  69          2HB       GLU  69  -1.570  -3.193 -23.177
  527   2HB   GLU  69          1HB       GLU  69  -3.180  -3.914 -23.206
  528   1HG   GLU  69          2HG       GLU  69  -3.584  -1.606 -24.636
  529   2HG   GLU  69          1HG       GLU  69  -1.934  -2.028 -25.098
  530    H    ALA  70           H        ALA  70  -4.885  -3.432 -21.145
  531    HA   ALA  70           HA       ALA  70  -3.405  -3.635 -18.562
  532   1HB   ALA  70          1HB       ALA  70  -5.564  -4.213 -17.570
  533   2HB   ALA  70          2HB       ALA  70  -6.316  -4.246 -19.165
  534   3HB   ALA  70          3HB       ALA  70  -5.728  -2.723 -18.498
  535    H    GLU  71           H        GLU  71  -3.720  -5.816 -17.433
  536    HA   GLU  71           HA       GLU  71  -3.830  -8.053 -19.407
  537   1HB   GLU  71          2HB       GLU  71  -1.526  -7.977 -19.135
  538   2HB   GLU  71          1HB       GLU  71  -1.636  -7.331 -17.498
  539   1HG   GLU  71          2HG       GLU  71  -2.058  -9.426 -16.555
  540   2HG   GLU  71          1HG       GLU  71  -2.655 -10.098 -18.072
  541    H    GLU  72           H        GLU  72  -5.635  -9.142 -18.743
  542    HA   GLU  72           HA       GLU  72  -6.992  -9.133 -16.371
  543   1HB   GLU  72          2HB       GLU  72  -7.637 -10.520 -18.328
  544   2HB   GLU  72          1HB       GLU  72  -6.351 -11.659 -17.927
  545   1HG   GLU  72          2HG       GLU  72  -7.496 -11.717 -15.570
  546   2HG   GLU  72          1HG       GLU  72  -8.897 -11.084 -16.434
  547    H    THR  73           H        THR  73  -6.208  -9.237 -14.328
  548    HA   THR  73           HA       THR  73  -4.069 -11.252 -13.756
  549    HB   THR  73           HB       THR  73  -3.187  -9.022 -13.432
  550    HG1  THR  73           HG1      THR  73  -3.078  -9.086 -11.016
  551   1HG2  THR  73          1HG2      THR  73  -5.545  -8.026 -13.210
  552   2HG2  THR  73          2HG2      THR  73  -4.286  -7.319 -12.199
  553   3HG2  THR  73          3HG2      THR  73  -5.439  -8.458 -11.503
  554    H    GLU  74           H        GLU  74  -4.919  -9.979 -10.887
  555    HA   GLU  74           HA       GLU  74  -7.476 -11.110 -10.306
  556   1HB   GLU  74          2HB       GLU  74  -6.670 -13.116  -9.007
  557   2HB   GLU  74          1HB       GLU  74  -6.477 -13.269 -10.754
  558   1HG   GLU  74          2HG       GLU  74  -4.110 -12.092 -10.084
  559   2HG   GLU  74          1HG       GLU  74  -4.417 -13.059  -8.641
  560    H    ASP  75           H        ASP  75  -8.016 -10.806  -8.077
  561    HA   ASP  75           HA       ASP  75  -6.302  -8.866  -6.710
  562   1HB   ASP  75          2HB       ASP  75  -8.843  -8.780  -6.758
  563   2HB   ASP  75          1HB       ASP  75  -8.830 -10.158  -5.656
  564    H    GLU  76           H        GLU  76  -4.789 -11.093  -6.859
  565    HA   GLU  76           HA       GLU  76  -3.625 -12.684  -5.583
  566   1HB   GLU  76          2HB       GLU  76  -3.696 -10.417  -4.144
  567   2HB   GLU  76          1HB       GLU  76  -4.609 -11.458  -3.051
  568   1HG   GLU  76          2HG       GLU  76  -2.759 -13.139  -3.186
  569   2HG   GLU  76          1HG       GLU  76  -1.833 -11.986  -4.146
  570    H    ASP  77           H        ASP  77  -6.880 -12.593  -5.713
  571    HA   ASP  77           HA       ASP  77  -7.200 -14.874  -3.804
  572   1HB   ASP  77          2HB       ASP  77  -8.913 -12.585  -4.520
  573   2HB   ASP  77          1HB       ASP  77  -9.755 -14.136  -4.501
  574    H    GLY  78           H        GLY  78  -7.909 -13.721  -7.086
  575   1HA   GLY  78          2HA       GLY  78  -7.483 -15.653  -8.762
  576   2HA   GLY  78          1HA       GLY  78  -8.702 -16.507  -7.816
  577    H    ASN  79           H        ASN  79  -9.590 -13.332  -7.735
  578    HA   ASN  79           HA       ASN  79 -11.850 -13.729  -9.464
  579   1HB   ASN  79          2HB       ASN  79 -11.330 -11.982  -7.480
  580   2HB   ASN  79          1HB       ASN  79 -10.963 -10.951  -8.864
  581   1HD2  ASN  79          1HD2      ASN  79 -13.139 -10.082  -7.529
  582   2HD2  ASN  79          2HD2      ASN  79 -14.585 -10.522  -8.301
  583    H    LYS  80           H        LYS  80 -12.284 -12.067 -11.311
  584    HA   LYS  80           HA       LYS  80  -9.804 -11.877 -12.974
  585   1HB   LYS  80          2HB       LYS  80 -12.651 -12.154 -13.976
  586   2HB   LYS  80          1HB       LYS  80 -11.172 -12.249 -14.933
  587   1HG   LYS  80          2HG       LYS  80 -11.011 -14.450 -14.504
  588   2HG   LYS  80          1HG       LYS  80 -10.976 -14.123 -12.771
  589   1HD   LYS  80          2HD       LYS  80 -12.872 -15.523 -13.094
  590   2HD   LYS  80          1HD       LYS  80 -13.531 -13.895 -12.927
  591   1HE   LYS  80          2HE       LYS  80 -13.691 -13.675 -15.357
  592   2HE   LYS  80          1HE       LYS  80 -12.945 -15.258 -15.572
  593   1HZ   LYS  80          1HZ       LYS  80 -15.655 -14.582 -14.854
  594   2HZ   LYS  80          2HZ       LYS  80 -14.971 -15.803 -13.890
  595   3HZ   LYS  80          3HZ       LYS  80 -15.043 -15.989 -15.577
  596    H    LEU  81           H        LEU  81  -9.210  -9.821 -13.433
  597    HA   LEU  81           HA       LEU  81 -11.259  -7.771 -13.952
  598   1HB   LEU  81          2HB       LEU  81 -10.436  -6.213 -12.275
  599   2HB   LEU  81          1HB       LEU  81 -10.894  -7.714 -11.470
  600    HG   LEU  81           HG       LEU  81  -8.303  -8.264 -12.045
  601   1HD1  LEU  81          1HD1      LEU  81  -6.937  -6.415 -12.105
  602   2HD1  LEU  81          2HD1      LEU  81  -8.037  -5.440 -11.131
  603   3HD1  LEU  81          3HD1      LEU  81  -8.367  -5.696 -12.845
  604   1HD2  LEU  81          1HD2      LEU  81  -7.838  -7.674  -9.693
  605   2HD2  LEU  81          2HD2      LEU  81  -9.418  -8.444  -9.841
  606   3HD2  LEU  81          3HD2      LEU  81  -9.304  -6.695  -9.646
  607    H    LEU  82           H        LEU  82 -10.250  -5.786 -14.858
  608    HA   LEU  82           HA       LEU  82  -7.691  -6.469 -16.226
  609   1HB   LEU  82          2HB       LEU  82  -9.851  -4.453 -16.908
  610   2HB   LEU  82          1HB       LEU  82  -8.352  -4.650 -17.818
  611    HG   LEU  82           HG       LEU  82  -9.308  -7.245 -17.610
  612   1HD1  LEU  82          1HD1      LEU  82 -11.599  -5.306 -18.028
  613   2HD1  LEU  82          2HD1      LEU  82 -11.464  -6.537 -16.772
  614   3HD1  LEU  82          3HD1      LEU  82 -11.671  -7.015 -18.458
  615   1HD2  LEU  82          1HD2      LEU  82  -8.384  -6.568 -19.653
  616   2HD2  LEU  82          2HD2      LEU  82  -9.383  -5.116 -19.735
  617   3HD2  LEU  82          3HD2      LEU  82 -10.096  -6.698 -20.053
  618    H    CYS  83           H        CYS  83  -5.908  -5.141 -16.018
  619    HA   CYS  83           HA       CYS  83  -6.221  -2.727 -14.284
  620   1HB   CYS  83          2HB       CYS  83  -5.125  -4.281 -12.877
  621   2HB   CYS  83          1HB       CYS  83  -4.145  -4.914 -14.199
  622    HG   CYS  83           HG       CYS  83  -2.583  -2.935 -14.031
  623    H    PHE  84           H        PHE  84  -6.023  -1.112 -15.818
  624    HA   PHE  84           HA       PHE  84  -3.943  -1.380 -17.906
  625   1HB   PHE  84          2HB       PHE  84  -4.906   0.832 -18.700
  626   2HB   PHE  84          1HB       PHE  84  -6.029  -0.525 -18.728
  627    HD1  PHE  84           HD1      PHE  84  -5.501   2.805 -17.594
  628    HD2  PHE  84           HD2      PHE  84  -7.494  -0.863 -16.579
  629    HE1  PHE  84           HE1      PHE  84  -7.049   4.056 -16.116
  630    HE2  PHE  84           HE2      PHE  84  -9.040   0.389 -15.098
  631    HZ   PHE  84           HZ       PHE  84  -8.819   2.848 -14.868
  632    H    ASP  85           H        ASP  85  -2.315   0.308 -18.182
  633    HA   ASP  85           HA       ASP  85  -1.655   1.625 -15.575
  634   1HB   ASP  85          2HB       ASP  85   0.424   1.132 -17.673
  635   2HB   ASP  85          1HB       ASP  85   0.590   1.163 -15.917
  636    H    ALA  86           H        ALA  86  -0.921   3.775 -15.618
  637    HA   ALA  86           HA       ALA  86  -1.071   5.177 -18.250
  638   1HB   ALA  86          1HB       ALA  86  -1.934   6.938 -16.161
  639   2HB   ALA  86          2HB       ALA  86  -2.884   5.456 -16.059
  640   3HB   ALA  86          3HB       ALA  86  -2.848   6.378 -17.562
  641    H    THR  87           H        THR  87   0.614   6.604 -18.561
  642    HA   THR  87           HA       THR  87   2.422   7.048 -16.218
  643    HB   THR  87           HB       THR  87   3.887   7.633 -18.510
  644    HG1  THR  87           HG1      THR  87   1.886   6.384 -19.393
  645   1HG2  THR  87          1HG2      THR  87   3.661   5.172 -16.775
  646   2HG2  THR  87          2HG2      THR  87   4.860   6.463 -16.684
  647   3HG2  THR  87          3HG2      THR  87   4.892   5.323 -18.029
  648    H    MET  88           H        MET  88   3.641   9.154 -16.323
  649    HA   MET  88           HA       MET  88   2.517  11.295 -17.963
  650   1HB   MET  88          2HB       MET  88   0.824  11.029 -16.128
  651   2HB   MET  88          1HB       MET  88   2.095  11.402 -14.963
  652   1HG   MET  88          2HG       MET  88   2.438  13.592 -15.959
  653   2HG   MET  88          1HG       MET  88   1.295  13.223 -17.251
  654   1HE   MET  88          1HE       MET  88   0.476  15.637 -16.465
  655   2HE   MET  88          2HE       MET  88  -1.135  15.561 -15.756
  656   3HE   MET  88          3HE       MET  88  -0.756  14.582 -17.172
  657    H    GLN  89           H        GLN  89   4.417  12.258 -18.511
  658    HA   GLN  89           HA       GLN  89   6.764  12.184 -16.827
  659   1HB   GLN  89          2HB       GLN  89   6.059  13.748 -19.321
  660   2HB   GLN  89          1HB       GLN  89   7.625  13.890 -18.520
  661   1HG   GLN  89          2HG       GLN  89   7.617  12.211 -20.384
  662   2HG   GLN  89          1HG       GLN  89   8.056  11.519 -18.823
  663   1HE2  GLN  89          1HE2      GLN  89   5.578  11.568 -21.327
  664   2HE2  GLN  89          2HE2      GLN  89   4.626  10.326 -20.668
  665    H    SER  90           H        SER  90   7.527  13.732 -15.402
  666    HA   SER  90           HA       SER  90   6.257  16.391 -15.299
  667   1HB   SER  90          2HB       SER  90   6.057  15.842 -12.670
  668   2HB   SER  90          1HB       SER  90   4.726  15.580 -13.794
  669    HG   SER  90           HG       SER  90   5.323  13.755 -12.409
  670    H    ALA  91           H        ALA  91   7.254  17.116 -12.758
  671    HA   ALA  91           HA       ALA  91  10.197  16.805 -13.205
  672   1HB   ALA  91          1HB       ALA  91  10.311  19.072 -12.006
  673   2HB   ALA  91          2HB       ALA  91   8.568  19.170 -12.258
  674   3HB   ALA  91          3HB       ALA  91   9.656  19.083 -13.644
  675    H    LEU  92           H        LEU  92   8.953  14.894 -11.661
  676    HA   LEU  92           HA       LEU  92   8.665  14.106  -9.423
  677   1HB   LEU  92          2HB       LEU  92  11.140  13.914 -10.205
  678   2HB   LEU  92          1HB       LEU  92  11.435  15.247  -9.087
  679    HG   LEU  92           HG       LEU  92   9.976  13.660  -7.474
  680   1HD1  LEU  92          1HD1      LEU  92  10.829  11.304  -7.866
  681   2HD1  LEU  92          2HD1      LEU  92  11.350  11.835  -9.464
  682   3HD1  LEU  92          3HD1      LEU  92   9.638  11.864  -9.039
  683   1HD2  LEU  92          1HD2      LEU  92  12.206  14.546  -6.966
  684   2HD2  LEU  92          2HD2      LEU  92  12.941  13.376  -8.062
  685   3HD2  LEU  92          3HD2      LEU  92  12.148  12.824  -6.587
  686    H    ASP  93           H        ASP  93   7.152  15.433  -8.362
  687    HA   ASP  93           HA       ASP  93   8.302  17.314  -6.415
  688   1HB   ASP  93          2HB       ASP  93   6.868  18.187  -8.832
  689   2HB   ASP  93          1HB       ASP  93   6.208  18.848  -7.335
  690    H    ALA  94           H        ALA  94   7.271  16.893  -4.530
  691    HA   ALA  94           HA       ALA  94   5.089  15.122  -4.261
  692   1HB   ALA  94          1HB       ALA  94   6.766  16.284  -2.498
  693   2HB   ALA  94          2HB       ALA  94   5.243  15.541  -2.008
  694   3HB   ALA  94          3HB       ALA  94   5.340  17.287  -2.234
  695    H    LYS  95           H        LYS  95   5.129  18.654  -4.596
  696    HA   LYS  95           HA       LYS  95   2.346  19.081  -4.086
  697   1HB   LYS  95          2HB       LYS  95   4.452  20.602  -5.614
  698   2HB   LYS  95          1HB       LYS  95   2.772  21.139  -5.630
  699   1HG   LYS  95          2HG       LYS  95   2.807  21.100  -3.115
  700   2HG   LYS  95          1HG       LYS  95   4.537  20.764  -3.196
  701   1HD   LYS  95          2HD       LYS  95   5.038  22.867  -4.096
  702   2HD   LYS  95          1HD       LYS  95   3.393  23.116  -4.682
  703   1HE   LYS  95          2HE       LYS  95   3.558  24.524  -2.782
  704   2HE   LYS  95          1HE       LYS  95   2.697  23.099  -2.200
  705   1HZ   LYS  95          1HZ       LYS  95   5.160  24.138  -1.327
  706   2HZ   LYS  95          2HZ       LYS  95   5.419  22.582  -1.959
  707   3HZ   LYS  95          3HZ       LYS  95   4.291  22.818  -0.712
  708    H    LEU  96           H        LEU  96   4.127  18.492  -7.124
  709    HA   LEU  96           HA       LEU  96   1.793  18.603  -8.805
  710   1HB   LEU  96          2HB       LEU  96   4.372  18.637  -9.394
  711   2HB   LEU  96          1HB       LEU  96   4.155  16.891  -9.503
  712    HG   LEU  96           HG       LEU  96   2.061  17.523 -10.960
  713   1HD1  LEU  96          1HD1      LEU  96   2.356  19.981 -10.430
  714   2HD1  LEU  96          2HD1      LEU  96   2.261  19.610 -12.151
  715   3HD1  LEU  96          3HD1      LEU  96   3.824  19.947 -11.407
  716   1HD2  LEU  96          1HD2      LEU  96   4.907  17.847 -11.968
  717   2HD2  LEU  96          2HD2      LEU  96   3.502  17.496 -12.975
  718   3HD2  LEU  96          3HD2      LEU  96   4.050  16.317 -11.783
  719    H    ILE  97           H        ILE  97   3.732  15.726  -7.892
  720    HA   ILE  97           HA       ILE  97   2.041  13.715  -8.728
  721    HB   ILE  97           HB       ILE  97   3.658  13.912  -6.178
  722   1HG1  ILE  97          2HG1      ILE  97   4.184  12.083  -8.501
  723   2HG1  ILE  97          1HG1      ILE  97   4.596  13.793  -8.649
  724   1HG2  ILE  97          1HG2      ILE  97   2.299  12.205  -5.480
  725   2HG2  ILE  97          2HG2      ILE  97   3.341  11.250  -6.535
  726   3HG2  ILE  97          3HG2      ILE  97   1.775  11.813  -7.118
  727   1HD1  ILE  97          1HD1      ILE  97   5.503  12.035  -6.353
  728   2HD1  ILE  97          2HD1      ILE  97   6.026  13.682  -6.700
  729   3HD1  ILE  97          3HD1      ILE  97   6.481  12.367  -7.782
  730    H    ASP  98           H        ASP  98   1.612  15.794  -5.903
  731    HA   ASP  98           HA       ASP  98  -0.591  14.340  -4.764
  732   1HB   ASP  98          2HB       ASP  98   0.537  17.096  -4.476
  733   2HB   ASP  98          1HB       ASP  98  -1.087  16.794  -3.857
  734    H    GLU  99           H        GLU  99  -0.478  17.201  -6.908
  735    HA   GLU  99           HA       GLU  99  -3.305  17.483  -7.181
  736   1HB   GLU  99          2HB       GLU  99  -0.954  18.299  -8.882
  737   2HB   GLU  99          1HB       GLU  99  -2.604  18.573  -9.439
  738   1HG   GLU  99          2HG       GLU  99  -2.966  20.241  -7.939
  739   2HG   GLU  99          1HG       GLU  99  -2.115  19.391  -6.648
  740    H    GLN 100           H        GLN 100  -0.947  15.506  -8.939
  741    HA   GLN 100           HA       GLN 100  -2.788  14.634 -10.985
  742   1HB   GLN 100          2HB       GLN 100  -0.376  13.109  -9.975
  743   2HB   GLN 100          1HB       GLN 100  -1.102  13.039 -11.581
  744   1HG   GLN 100          2HG       GLN 100   0.184  15.509 -10.380
  745   2HG   GLN 100          1HG       GLN 100   0.967  14.431 -11.534
  746   1HE2  GLN 100          1HE2      GLN 100   0.015  17.352 -11.786
  747   2HE2  GLN 100          2HE2      GLN 100  -0.940  17.351 -13.189
  748    H    VAL 101           H        VAL 101  -1.610  13.061  -7.992
  749    HA   VAL 101           HA       VAL 101  -3.245  10.736  -8.220
  750    HB   VAL 101           HB       VAL 101  -1.970  12.142  -5.872
  751   1HG1  VAL 101          1HG1      VAL 101  -3.781  11.144  -4.776
  752   2HG1  VAL 101          2HG1      VAL 101  -2.570   9.863  -4.720
  753   3HG1  VAL 101          3HG1      VAL 101  -3.861   9.804  -5.920
  754   1HG2  VAL 101          1HG2      VAL 101  -0.513  10.174  -5.904
  755   2HG2  VAL 101          2HG2      VAL 101  -0.546  10.907  -7.507
  756   3HG2  VAL 101          3HG2      VAL 101  -1.483   9.449  -7.184
  757    H    GLU 102           H        GLU 102  -3.835  13.864  -6.615
  758    HA   GLU 102           HA       GLU 102  -6.348  13.187  -5.457
  759   1HB   GLU 102          2HB       GLU 102  -5.307  15.205  -4.731
  760   2HB   GLU 102          1HB       GLU 102  -5.170  15.814  -6.381
  761   1HG   GLU 102          2HG       GLU 102  -7.409  16.392  -6.503
  762   2HG   GLU 102          1HG       GLU 102  -7.897  15.161  -5.338
  763    H    LYS 103           H        LYS 103  -5.520  14.445  -8.681
  764    HA   LYS 103           HA       LYS 103  -8.280  14.754  -9.504
  765   1HB   LYS 103          2HB       LYS 103  -5.638  14.679 -10.955
  766   2HB   LYS 103          1HB       LYS 103  -7.159  14.710 -11.850
  767   1HG   LYS 103          2HG       LYS 103  -7.801  16.734 -10.436
  768   2HG   LYS 103          1HG       LYS 103  -6.122  16.771  -9.892
  769   1HD   LYS 103          2HD       LYS 103  -6.868  16.751 -12.823
  770   2HD   LYS 103          1HD       LYS 103  -6.685  18.248 -11.907
  771   1HE   LYS 103          2HE       LYS 103  -4.580  16.125 -12.388
  772   2HE   LYS 103          1HE       LYS 103  -4.564  17.794 -12.956
  773   1HZ   LYS 103          1HZ       LYS 103  -4.713  18.367 -10.476
  774   2HZ   LYS 103          2HZ       LYS 103  -3.217  17.847 -11.094
  775   3HZ   LYS 103          3HZ       LYS 103  -4.196  16.772 -10.214
  776    H    LEU 104           H        LEU 104  -5.887  12.153  -9.762
  777    HA   LEU 104           HA       LEU 104  -7.500  10.491 -11.492
  778   1HB   LEU 104          2HB       LEU 104  -5.225   9.819  -9.603
  779   2HB   LEU 104          1HB       LEU 104  -5.944   8.669 -10.731
  780    HG   LEU 104           HG       LEU 104  -4.718  11.319 -11.546
  781   1HD1  LEU 104          1HD1      LEU 104  -2.951   9.884 -10.735
  782   2HD1  LEU 104          2HD1      LEU 104  -2.911   9.833 -12.497
  783   3HD1  LEU 104          3HD1      LEU 104  -3.619   8.495 -11.594
  784   1HD2  LEU 104          1HD2      LEU 104  -6.030   9.029 -12.982
  785   2HD2  LEU 104          2HD2      LEU 104  -4.750   9.932 -13.793
  786   3HD2  LEU 104          3HD2      LEU 104  -6.209  10.763 -13.252
  787    H    VAL 105           H        VAL 105  -7.209  10.869  -7.994
  788    HA   VAL 105           HA       VAL 105  -8.741   8.539  -7.287
  789    HB   VAL 105           HB       VAL 105  -7.933  11.072  -5.893
  790   1HG1  VAL 105          1HG1      VAL 105  -9.151   9.910  -3.859
  791   2HG1  VAL 105          2HG1      VAL 105 -10.165   9.217  -5.125
  792   3HG1  VAL 105          3HG1      VAL 105 -10.056  10.967  -4.941
  793   1HG2  VAL 105          1HG2      VAL 105  -6.476   9.005  -6.086
  794   2HG2  VAL 105          2HG2      VAL 105  -7.671   8.156  -5.106
  795   3HG2  VAL 105          3HG2      VAL 105  -6.792   9.529  -4.432
  796    H    ASN 106           H        ASN 106  -9.766  11.969  -7.037
  797    HA   ASN 106           HA       ASN 106 -12.494  11.556  -6.699
  798   1HB   ASN 106          2HB       ASN 106 -10.938  13.719  -8.092
  799   2HB   ASN 106          1HB       ASN 106 -12.701  13.751  -8.121
  800   1HD2  ASN 106          1HD2      ASN 106  -9.933  13.580  -5.831
  801   2HD2  ASN 106          2HD2      ASN 106 -10.756  14.320  -4.545
  802    H    LEU 107           H        LEU 107 -10.708  11.620  -9.781
  803    HA   LEU 107           HA       LEU 107 -13.001  11.318 -11.469
  804   1HB   LEU 107          2HB       LEU 107 -10.902  12.016 -12.435
  805   2HB   LEU 107          1HB       LEU 107 -10.097  10.553 -11.866
  806    HG   LEU 107           HG       LEU 107 -12.490  10.041 -13.504
  807   1HD1  LEU 107          1HD1      LEU 107 -11.643  12.037 -14.667
  808   2HD1  LEU 107          2HD1      LEU 107 -11.346  10.591 -15.633
  809   3HD1  LEU 107          3HD1      LEU 107 -10.029  11.329 -14.723
  810   1HD2  LEU 107          1HD2      LEU 107  -9.675   9.101 -14.014
  811   2HD2  LEU 107          2HD2      LEU 107 -11.193   8.239 -14.267
  812   3HD2  LEU 107          3HD2      LEU 107 -10.576   8.476 -12.631
  813    H    ALA 108           H        ALA 108 -10.663   8.859 -10.305
  814    HA   ALA 108           HA       ALA 108 -11.750   6.566 -11.407
  815   1HB   ALA 108          1HB       ALA 108 -11.174   5.532  -9.035
  816   2HB   ALA 108          2HB       ALA 108 -10.460   7.121  -8.760
  817   3HB   ALA 108          3HB       ALA 108  -9.890   6.117 -10.094
  818    H    GLU 109           H        GLU 109 -12.765   7.897  -8.233
  819    HA   GLU 109           HA       GLU 109 -14.967   6.134  -7.885
  820   1HB   GLU 109          2HB       GLU 109 -14.681   8.984  -6.884
  821   2HB   GLU 109          1HB       GLU 109 -15.778   7.764  -6.237
  822   1HG   GLU 109          2HG       GLU 109 -12.819   7.227  -6.401
  823   2HG   GLU 109          1HG       GLU 109 -13.494   8.124  -5.041
  824    H    LYS 110           H        LYS 110 -14.800   9.351  -9.416
  825    HA   LYS 110           HA       LYS 110 -17.523   9.799  -9.880
  826   1HB   LYS 110          2HB       LYS 110 -15.213  11.031 -10.676
  827   2HB   LYS 110          1HB       LYS 110 -15.789  10.371 -12.205
  828   1HG   LYS 110          2HG       LYS 110 -18.114  11.369 -11.270
  829   2HG   LYS 110          1HG       LYS 110 -16.991  12.476 -10.478
  830   1HD   LYS 110          2HD       LYS 110 -16.881  11.847 -13.437
  831   2HD   LYS 110          1HD       LYS 110 -17.777  13.215 -12.774
  832   1HE   LYS 110          2HE       LYS 110 -15.415  13.606 -11.536
  833   2HE   LYS 110          1HE       LYS 110 -14.840  12.805 -12.999
  834   1HZ   LYS 110          1HZ       LYS 110 -15.776  15.449 -12.680
  835   2HZ   LYS 110          2HZ       LYS 110 -16.765  14.631 -13.794
  836   3HZ   LYS 110          3HZ       LYS 110 -15.088  14.722 -14.049
  837    H    PHE 111           H        PHE 111 -15.338   7.579 -11.537
  838    HA   PHE 111           HA       PHE 111 -17.448   6.872 -13.490
  839   1HB   PHE 111          2HB       PHE 111 -14.529   6.288 -13.185
  840   2HB   PHE 111          1HB       PHE 111 -15.516   5.137 -14.087
  841    HD1  PHE 111           HD1      PHE 111 -17.286   6.357 -15.740
  842    HD2  PHE 111           HD2      PHE 111 -13.541   7.995 -14.418
  843    HE1  PHE 111           HE1      PHE 111 -17.249   7.864 -17.710
  844    HE2  PHE 111           HE2      PHE 111 -13.505   9.502 -16.388
  845    HZ   PHE 111           HZ       PHE 111 -15.359   9.436 -18.034
  846    H    ASP 112           H        ASP 112 -15.243   4.751 -11.650
  847    HA   ASP 112           HA       ASP 112 -16.929   3.520  -9.862
  848   1HB   ASP 112          2HB       ASP 112 -17.680   2.864 -12.646
  849   2HB   ASP 112          1HB       ASP 112 -17.514   1.471 -11.576
  850    H    ILE 113           H        ILE 113 -14.122   3.878 -10.511
  851    HA   ILE 113           HA       ILE 113 -13.244   1.016 -10.506
  852    HB   ILE 113           HB       ILE 113 -11.110   1.796 -11.468
  853   1HG1  ILE 113          2HG1      ILE 113 -12.492   4.480 -11.278
  854   2HG1  ILE 113          1HG1      ILE 113 -10.923   4.018 -10.619
  855   1HG2  ILE 113          1HG2      ILE 113 -13.467   2.857 -13.051
  856   2HG2  ILE 113          2HG2      ILE 113 -13.041   1.150 -12.942
  857   3HG2  ILE 113          3HG2      ILE 113 -11.928   2.289 -13.697
  858   1HD1  ILE 113          1HD1      ILE 113 -10.230   3.572 -13.063
  859   2HD1  ILE 113          2HD1      ILE 113 -10.393   5.256 -12.568
  860   3HD1  ILE 113          3HD1      ILE 113 -11.673   4.486 -13.505
  861    H    ILE 114           H        ILE 114 -10.911   0.947  -9.430
  862    HA   ILE 114           HA       ILE 114 -10.985   2.650  -6.970
  863    HB   ILE 114           HB       ILE 114 -11.627   0.538  -6.154
  864   1HG1  ILE 114          2HG1      ILE 114  -9.722  -0.273  -4.896
  865   2HG1  ILE 114          1HG1      ILE 114  -8.597   0.406  -6.072
  866   1HG2  ILE 114          1HG2      ILE 114 -11.386  -0.747  -8.190
  867   2HG2  ILE 114          2HG2      ILE 114 -10.474  -1.567  -6.922
  868   3HG2  ILE 114          3HG2      ILE 114  -9.629  -0.599  -8.131
  869   1HD1  ILE 114          1HD1      ILE 114  -8.901   2.569  -5.325
  870   2HD1  ILE 114          2HD1      ILE 114  -9.210   1.705  -3.818
  871   3HD1  ILE 114          3HD1      ILE 114 -10.558   2.266  -4.805
  872    H    TYR 115           H        TYR 115  -9.292   4.041  -7.366
  873    HA   TYR 115           HA       TYR 115  -6.813   2.962  -8.577
  874   1HB   TYR 115          2HB       TYR 115  -7.382   5.024  -9.561
  875   2HB   TYR 115          1HB       TYR 115  -7.856   5.733  -8.019
  876    HD1  TYR 115           HD1      TYR 115  -6.422   7.680  -8.188
  877    HD2  TYR 115           HD2      TYR 115  -4.781   3.716  -8.443
  878    HE1  TYR 115           HE1      TYR 115  -4.139   8.604  -7.907
  879    HE2  TYR 115           HE2      TYR 115  -2.501   4.642  -8.161
  880    HH   TYR 115           HH       TYR 115  -1.440   7.106  -8.695
  881    H    ASP 116           H        ASP 116  -5.239   2.228  -7.236
  882    HA   ASP 116           HA       ASP 116  -4.456   3.740  -4.871
  883   1HB   ASP 116          2HB       ASP 116  -6.523   2.146  -4.324
  884   2HB   ASP 116          1HB       ASP 116  -5.248   0.932  -4.224
  885    H    GLY 117           H        GLY 117  -2.579   3.565  -6.446
  886   1HA   GLY 117          2HA       GLY 117  -0.554   1.888  -5.514
  887   2HA   GLY 117          1HA       GLY 117  -1.301   0.999  -6.841
  888    H    TRP 118           H        TRP 118   0.709   3.709  -6.003
  889    HA   TRP 118           HA       TRP 118   1.118   4.221  -8.923
  890   1HB   TRP 118          2HB       TRP 118   1.315   6.523  -8.545
  891   2HB   TRP 118          1HB       TRP 118   0.026   6.076  -7.426
  892    HD1  TRP 118           HD1      TRP 118   0.999   5.368  -4.860
  893    HE1  TRP 118           HE1      TRP 118   2.769   6.627  -3.473
  894    HE3  TRP 118           HE3      TRP 118   3.298   8.027  -8.566
  895    HZ2  TRP 118           HZ2      TRP 118   4.881   8.513  -3.880
  896    HZ3  TRP 118           HZ3      TRP 118   5.185   9.545  -8.038
  897    HH2  TRP 118           HH2      TRP 118   5.978   9.791  -5.703
  898    H    GLY 119           H        GLY 119   3.234   4.210  -9.621
  899   1HA   GLY 119          2HA       GLY 119   5.373   4.031  -7.546
  900   2HA   GLY 119          1HA       GLY 119   5.311   2.850  -8.858
  901    H    THR 120           H        THR 120   7.526   4.620  -8.430
  902    HA   THR 120           HA       THR 120   7.319   6.263 -10.921
  903    HB   THR 120           HB       THR 120   7.345   7.739  -8.946
  904    HG1  THR 120           HG1      THR 120   9.782   8.405  -9.554
  905   1HG2  THR 120          1HG2      THR 120   9.265   7.734  -7.427
  906   2HG2  THR 120          2HG2      THR 120   9.990   6.398  -8.320
  907   3HG2  THR 120          3HG2      THR 120   8.492   6.149  -7.423
  908    H    TYR 121           H        TYR 121   9.253   6.352 -12.186
  909    HA   TYR 121           HA       TYR 121  11.029   4.026 -11.753
  910   1HB   TYR 121          2HB       TYR 121   9.925   5.178 -14.026
  911   2HB   TYR 121          1HB       TYR 121  11.602   5.721 -14.071
  912    HD1  TYR 121           HD1      TYR 121   9.838   3.473 -15.663
  913    HD2  TYR 121           HD2      TYR 121  12.972   3.453 -12.724
  914    HE1  TYR 121           HE1      TYR 121  10.548   1.226 -16.436
  915    HE2  TYR 121           HE2      TYR 121  13.682   1.206 -13.498
  916    HH   TYR 121           HH       TYR 121  13.483  -0.132 -15.691
  917    H    TYR 122           H        TYR 122  13.070   4.255 -10.948
  918    HA   TYR 122           HA       TYR 122  14.088   7.034 -10.577
  919   1HB   TYR 122          2HB       TYR 122  13.931   5.797  -8.504
  920   2HB   TYR 122          1HB       TYR 122  14.790   4.425  -9.204
  921    HD1  TYR 122           HD1      TYR 122  15.166   8.061  -8.421
  922    HD2  TYR 122           HD2      TYR 122  17.141   4.307  -9.102
  923    HE1  TYR 122           HE1      TYR 122  17.330   9.080  -7.764
  924    HE2  TYR 122           HE2      TYR 122  19.305   5.326  -8.445
  925    HH   TYR 122           HH       TYR 122  19.746   8.673  -8.162
  926    H    GLU 123           H        GLU 123  15.902   7.681 -11.660
  927    HA   GLU 123           HA       GLU 123  17.123   5.792 -13.561
  928   1HB   GLU 123          2HB       GLU 123  16.560   8.192 -14.143
  929   2HB   GLU 123          1HB       GLU 123  17.862   8.687 -13.061
  930   1HG   GLU 123          2HG       GLU 123  19.516   7.589 -14.388
  931   2HG   GLU 123          1HG       GLU 123  18.292   6.727 -15.322
  932    H    GLY 124           H        GLY 124  18.420   4.378 -12.368
  933   1HA   GLY 124          2HA       GLY 124  21.024   4.716 -11.839
  934   2HA   GLY 124          1HA       GLY 124  20.338   5.509 -10.420
  935    H    LEU 125           H        LEU 125  19.609   2.499 -12.227
  936    HA   LEU 125           HA       LEU 125  20.101   0.949  -9.755
  937   1HB   LEU 125          2HB       LEU 125  17.462   1.668 -10.677
  938   2HB   LEU 125          1HB       LEU 125  17.675  -0.078 -10.797
  939    HG   LEU 125           HG       LEU 125  18.281   1.568  -8.324
  940   1HD1  LEU 125          1HD1      LEU 125  16.264   0.373  -7.409
  941   2HD1  LEU 125          2HD1      LEU 125  15.930  -0.205  -9.042
  942   3HD1  LEU 125          3HD1      LEU 125  15.886   1.522  -8.693
  943   1HD2  LEU 125          1HD2      LEU 125  19.171  -0.979  -9.124
  944   2HD2  LEU 125          2HD2      LEU 125  17.871  -1.285  -7.971
  945   3HD2  LEU 125          3HD2      LEU 125  19.254  -0.295  -7.501
  946    H    GLU 126           H        GLU 126  21.853   0.093 -11.054
  947    HA   GLU 126           HA       GLU 126  21.154  -1.354 -13.525
  948   1HB   GLU 126          2HB       GLU 126  23.834  -1.636 -12.237
  949   2HB   GLU 126          1HB       GLU 126  23.421  -1.447 -13.942
  950   1HG   GLU 126          2HG       GLU 126  22.832   0.921 -13.532
  951   2HG   GLU 126          1HG       GLU 126  23.277   0.730 -11.834
  952    H    HIS 127           H        HIS 127  23.217  -3.442 -12.930
  953    HA   HIS 127           HA       HIS 127  22.012  -4.980 -10.720
  954   1HB   HIS 127          2HB       HIS 127  21.778  -6.958 -12.423
  955   2HB   HIS 127          1HB       HIS 127  20.498  -5.748 -12.335
  956    HD2  HIS 127           HD2      HIS 127  23.093  -7.078 -14.889
  957    HE1  HIS 127           HE1      HIS 127  21.257  -3.701 -16.640
  958    HE2  HIS 127           HE2      HIS 127  22.794  -5.673 -17.066
  959    H    HIS 128           H        HIS 128  23.727  -5.853  -9.677
  960    HA   HIS 128           HA       HIS 128  25.709  -7.468 -10.948
  961   1HB   HIS 128          2HB       HIS 128  26.209  -4.796 -11.398
  962   2HB   HIS 128          1HB       HIS 128  27.163  -5.112  -9.948
  963    HD2  HIS 128           HD2      HIS 128  27.161  -6.057 -13.740
  964    HE1  HIS 128           HE1      HIS 128  30.466  -7.978 -11.947
  965    HE2  HIS 128           HE2      HIS 128  29.335  -7.435 -14.152
  966    H    HIS 129           H        HIS 129  25.307  -5.151  -8.250
  967    HA   HIS 129           HA       HIS 129  26.185  -7.350  -6.419
  968   1HB   HIS 129          2HB       HIS 129  26.895  -4.427  -6.459
  969   2HB   HIS 129          1HB       HIS 129  26.884  -5.305  -4.929
  970    HD2  HIS 129           HD2      HIS 129  28.710  -5.681  -8.454
  971    HE1  HIS 129           HE1      HIS 129  31.047  -7.542  -5.469
  972    HE2  HIS 129           HE2      HIS 129  30.948  -6.913  -7.924
  973    H    HIS 130           H        HIS 130  25.429  -6.641  -4.042
  974    HA   HIS 130           HA       HIS 130  22.533  -5.967  -4.308
  975   1HB   HIS 130          2HB       HIS 130  24.074  -7.850  -2.620
  976   2HB   HIS 130          1HB       HIS 130  22.774  -6.990  -1.795
  977    HD2  HIS 130           HD2      HIS 130  21.369  -9.582  -1.865
  978    HE1  HIS 130           HE1      HIS 130  20.447  -9.256  -5.973
  979    HE2  HIS 130           HE2      HIS 130  19.939 -10.520  -3.834
  980    H    HIS 131           H        HIS 131  21.988  -5.321  -1.664
  981    HA   HIS 131           HA       HIS 131  23.534  -2.782  -1.360
  982   1HB   HIS 131          2HB       HIS 131  20.896  -3.257  -0.014
  983   2HB   HIS 131          1HB       HIS 131  21.595  -1.746  -0.595
  984    HD2  HIS 131           HD2      HIS 131  19.881  -0.995  -2.642
  985    HE1  HIS 131           HE1      HIS 131  19.638  -4.731  -4.598
  986    HE2  HIS 131           HE2      HIS 131  18.949  -2.292  -4.705
  987    H    HIS 132           HN       HIS 132  25.042  -4.547  -0.266
  988    HA   HIS 132           HA       HIS 132  24.436  -5.724   2.215
  989   1HB   HIS 132          2HB       HIS 132  27.012  -4.549   1.150
  990   2HB   HIS 132          1HB       HIS 132  26.926  -5.386   2.700
  991    HD2  HIS 132           HD2      HIS 132  24.822  -6.800  -0.294
  992    HE1  HIS 132           HE1      HIS 132  28.041  -9.444   0.395
  993    HE2  HIS 132           HE2      HIS 132  25.887  -9.103  -0.898
  Start of MODEL   16
    1   1H    MET   1          1H        MET   1 -22.432  23.339  15.242
    2   2H    MET   1          2H        MET   1 -22.865  24.528  16.376
    3   3H    MET   1          3H        MET   1 -21.982  23.163  16.867
    4    HA   MET   1           HA       MET   1 -21.081  25.572  15.480
    5   1HB   MET   1          2HB       MET   1 -20.375  23.900  17.804
    6   2HB   MET   1          1HB       MET   1 -18.989  24.468  16.872
    7   1HG   MET   1          2HG       MET   1 -19.500  26.724  17.241
    8   2HG   MET   1          1HG       MET   1 -21.190  26.382  17.606
    9   1HE   MET   1          1HE       MET   1 -21.531  25.675  21.101
   10   2HE   MET   1          2HE       MET   1 -22.149  25.623  19.452
   11   3HE   MET   1          3HE       MET   1 -21.723  27.170  20.177
   12    H    SER   2           H        SER   2 -20.890  22.088  15.235
   13    HA   SER   2           HA       SER   2 -18.797  22.403  13.122
   14   1HB   SER   2          2HB       SER   2 -19.239  20.390  15.236
   15   2HB   SER   2          1HB       SER   2 -18.870  19.716  13.651
   16    HG   SER   2           HG       SER   2 -16.938  20.652  13.687
   17    H    HIS   3           H        HIS   3 -20.291  22.827  11.421
   18    HA   HIS   3           HA       HIS   3 -22.687  21.451  10.885
   19   1HB   HIS   3          2HB       HIS   3 -21.947  21.924   8.388
   20   2HB   HIS   3          1HB       HIS   3 -22.355  23.260   9.464
   21    HD2  HIS   3           HD2      HIS   3 -19.334  22.006   7.429
   22    HE1  HIS   3           HE1      HIS   3 -17.875  25.002  10.024
   23    HE2  HIS   3           HE2      HIS   3 -17.315  23.546   8.024
   24    H    GLN   4           H        GLN   4 -19.369  20.420  10.439
   25    HA   GLN   4           HA       GLN   4 -18.553  18.250  10.007
   26   1HB   GLN   4          2HB       GLN   4 -20.971  17.739  11.114
   27   2HB   GLN   4          1HB       GLN   4 -21.247  17.109   9.488
   28   1HG   GLN   4          2HG       GLN   4 -19.184  15.742   9.686
   29   2HG   GLN   4          1HG       GLN   4 -18.964  16.337  11.332
   30   1HE2  GLN   4          1HE2      GLN   4 -22.139  16.282  11.403
   31   2HE2  GLN   4          2HE2      GLN   4 -22.460  14.662  11.797
   32    H    ASP   5           H        ASP   5 -18.225  16.895   8.098
   33    HA   ASP   5           HA       ASP   5 -18.952  18.322   5.622
   34   1HB   ASP   5          2HB       ASP   5 -17.204  15.883   6.077
   35   2HB   ASP   5          1HB       ASP   5 -17.378  16.744   4.546
   36    H    ASP   6           H        ASP   6 -18.589  15.393   4.434
   37    HA   ASP   6           HA       ASP   6 -20.978  13.977   5.148
   38   1HB   ASP   6          2HB       ASP   6 -22.215  15.781   4.163
   39   2HB   ASP   6          1HB       ASP   6 -21.141  15.836   2.764
   40    H    TYR   7           H        TYR   7 -20.262  11.960   4.705
   41    HA   TYR   7           HA       TYR   7 -19.060  10.228   3.650
   42   1HB   TYR   7          2HB       TYR   7 -21.117  11.145   2.038
   43   2HB   TYR   7          1HB       TYR   7 -19.731  11.150   0.948
   44    HD1  TYR   7           HD1      TYR   7 -22.377   9.206   1.753
   45    HD2  TYR   7           HD2      TYR   7 -18.089   8.947   1.698
   46    HE1  TYR   7           HE1      TYR   7 -22.529   6.740   1.548
   47    HE2  TYR   7           HE2      TYR   7 -18.242   6.479   1.494
   48    HH   TYR   7           HH       TYR   7 -19.903   4.689   2.055
   49    H    LEU   8           H        LEU   8 -16.871  10.667   3.944
   50    HA   LEU   8           HA       LEU   8 -15.566  12.300   1.802
   51   1HB   LEU   8          2HB       LEU   8 -13.675  12.168   3.754
   52   2HB   LEU   8          1HB       LEU   8 -14.851  13.476   3.626
   53    HG   LEU   8           HG       LEU   8 -15.556  10.966   5.125
   54   1HD1  LEU   8          1HD1      LEU   8 -13.600  11.482   6.302
   55   2HD1  LEU   8          2HD1      LEU   8 -14.810  12.423   7.176
   56   3HD1  LEU   8          3HD1      LEU   8 -13.760  13.213   6.000
   57   1HD2  LEU   8          1HD2      LEU   8 -17.371  12.177   5.734
   58   2HD2  LEU   8          2HD2      LEU   8 -16.898  13.313   4.471
   59   3HD2  LEU   8          3HD2      LEU   8 -16.387  13.585   6.137
   60    H    SER   9           H        SER   9 -13.912  10.222   4.108
   61    HA   SER   9           HA       SER   9 -12.606   8.301   3.773
   62   1HB   SER   9          2HB       SER   9 -13.992   7.545   1.267
   63   2HB   SER   9          1HB       SER   9 -13.677   6.587   2.711
   64    HG   SER   9           HG       SER   9 -15.481   8.738   2.817
   65    H    VAL  10           H        VAL  10 -13.452   9.578   0.528
   66    HA   VAL  10           HA       VAL  10 -11.099   8.929  -0.816
   67    HB   VAL  10           HB       VAL  10 -11.592  10.730  -2.342
   68   1HG1  VAL  10          1HG1      VAL  10 -14.149   9.714  -1.061
   69   2HG1  VAL  10          2HG1      VAL  10 -13.222   8.884  -2.311
   70   3HG1  VAL  10          3HG1      VAL  10 -14.026  10.411  -2.676
   71   1HG2  VAL  10          1HG2      VAL  10 -11.757  12.542  -0.686
   72   2HG2  VAL  10          2HG2      VAL  10 -13.271  11.869  -0.082
   73   3HG2  VAL  10          3HG2      VAL  10 -13.190  12.528  -1.716
   74    H    GLU  11           H        GLU  11 -11.580  11.363   1.645
   75    HA   GLU  11           HA       GLU  11  -9.080  12.762   1.098
   76   1HB   GLU  11          2HB       GLU  11 -11.124  12.830   3.306
   77   2HB   GLU  11          1HB       GLU  11  -9.571  13.643   3.511
   78   1HG   GLU  11          2HG       GLU  11 -10.719  14.219   0.902
   79   2HG   GLU  11          1HG       GLU  11 -11.827  14.669   2.200
   80    H    GLU  12           H        GLU  12 -10.136  10.131   3.196
   81    HA   GLU  12           HA       GLU  12  -7.836  10.013   4.881
   82   1HB   GLU  12          2HB       GLU  12  -9.423   7.615   3.933
   83   2HB   GLU  12          1HB       GLU  12  -8.564   7.809   5.462
   84   1HG   GLU  12          2HG       GLU  12 -10.840   9.630   4.666
   85   2HG   GLU  12          1HG       GLU  12 -11.112   8.119   5.536
   86    H    LEU  13           H        LEU  13  -8.573   8.155   1.904
   87    HA   LEU  13           HA       LEU  13  -6.122   6.790   1.682
   88   1HB   LEU  13          2HB       LEU  13  -7.638   7.967  -0.663
   89   2HB   LEU  13          1HB       LEU  13  -6.620   6.526  -0.658
   90    HG   LEU  13           HG       LEU  13  -9.015   6.701   1.158
   91   1HD1  LEU  13          1HD1      LEU  13  -9.008   6.593  -1.763
   92   2HD1  LEU  13          2HD1      LEU  13 -10.362   6.811  -0.655
   93   3HD1  LEU  13          3HD1      LEU  13  -9.796   5.187  -1.047
   94   1HD2  LEU  13          1HD2      LEU  13  -8.904   4.259   0.965
   95   2HD2  LEU  13          2HD2      LEU  13  -7.326   4.889   1.438
   96   3HD2  LEU  13          3HD2      LEU  13  -7.614   4.393  -0.230
   97    H    ILE  14           H        ILE  14  -6.987   9.981   0.314
   98    HA   ILE  14           HA       ILE  14  -4.436  10.557  -0.803
   99    HB   ILE  14           HB       ILE  14  -6.484  12.475   0.352
  100   1HG1  ILE  14          2HG1      ILE  14  -6.065  11.680  -2.538
  101   2HG1  ILE  14          1HG1      ILE  14  -7.206  10.839  -1.489
  102   1HG2  ILE  14          1HG2      ILE  14  -4.174  12.884  -1.572
  103   2HG2  ILE  14          2HG2      ILE  14  -4.321  13.563   0.048
  104   3HG2  ILE  14          3HG2      ILE  14  -5.414  14.090  -1.231
  105   1HD1  ILE  14          1HD1      ILE  14  -8.059  13.280  -0.964
  106   2HD1  ILE  14          2HD1      ILE  14  -8.585  12.459  -2.435
  107   3HD1  ILE  14          3HD1      ILE  14  -7.294  13.659  -2.507
  108    H    GLU  15           H        GLU  15  -5.642  10.810   2.491
  109    HA   GLU  15           HA       GLU  15  -3.592  12.498   3.544
  110   1HB   GLU  15          2HB       GLU  15  -5.818  11.138   4.561
  111   2HB   GLU  15          1HB       GLU  15  -4.444  10.438   5.416
  112   1HG   GLU  15          2HG       GLU  15  -4.984  13.410   5.151
  113   2HG   GLU  15          1HG       GLU  15  -5.353  12.443   6.580
  114    H    ILE  16           H        ILE  16  -3.844   8.951   4.008
  115    HA   ILE  16           HA       ILE  16  -1.217   8.540   4.905
  116    HB   ILE  16           HB       ILE  16  -2.744   6.636   3.107
  117   1HG1  ILE  16          2HG1      ILE  16  -2.900   6.809   6.126
  118   2HG1  ILE  16          1HG1      ILE  16  -4.063   7.617   5.074
  119   1HG2  ILE  16          1HG2      ILE  16  -0.227   6.484   4.392
  120   2HG2  ILE  16          2HG2      ILE  16  -1.112   5.170   3.616
  121   3HG2  ILE  16          3HG2      ILE  16  -1.322   5.478   5.340
  122   1HD1  ILE  16          1HD1      ILE  16  -3.578   4.801   4.369
  123   2HD1  ILE  16          2HD1      ILE  16  -5.102   5.675   4.534
  124   3HD1  ILE  16          3HD1      ILE  16  -4.298   5.025   5.963
  125    H    GLN  17           H        GLN  17  -2.423   8.651   1.556
  126    HA   GLN  17           HA       GLN  17   0.010   7.930   0.268
  127   1HB   GLN  17          2HB       GLN  17  -2.226   8.136  -0.854
  128   2HB   GLN  17          1HB       GLN  17  -2.068   9.889  -0.750
  129   1HG   GLN  17          2HG       GLN  17  -1.216   9.479  -2.882
  130   2HG   GLN  17          1HG       GLN  17   0.255   9.461  -1.910
  131   1HE2  GLN  17          1HE2      GLN  17  -1.803   7.533  -3.949
  132   2HE2  GLN  17          2HE2      GLN  17  -0.942   6.079  -3.792
  133    H    LYS  18           H        LYS  18  -1.304  11.243   0.708
  134    HA   LYS  18           HA       LYS  18   0.812  12.759  -0.168
  135   1HB   LYS  18          2HB       LYS  18  -1.384  13.186   1.570
  136   2HB   LYS  18          1HB       LYS  18   0.037  13.805   2.412
  137   1HG   LYS  18          2HG       LYS  18   0.608  14.915   0.114
  138   2HG   LYS  18          1HG       LYS  18  -1.099  14.651  -0.244
  139   1HD   LYS  18          2HD       LYS  18  -0.157  16.025   2.282
  140   2HD   LYS  18          1HD       LYS  18  -0.525  16.907   0.799
  141   1HE   LYS  18          2HE       LYS  18  -2.808  15.904   0.809
  142   2HE   LYS  18          1HE       LYS  18  -2.431  15.127   2.347
  143   1HZ   LYS  18          1HZ       LYS  18  -3.063  16.987   3.338
  144   2HZ   LYS  18          2HZ       LYS  18  -3.252  17.789   1.852
  145   3HZ   LYS  18          3HZ       LYS  18  -1.743  17.787   2.634
  146    H    GLU  19           H        GLU  19   0.586  11.352   3.115
  147    HA   GLU  19           HA       GLU  19   3.176  12.218   3.959
  148   1HB   GLU  19          2HB       GLU  19   1.578   9.795   4.846
  149   2HB   GLU  19          1HB       GLU  19   2.952  10.487   5.711
  150   1HG   GLU  19          2HG       GLU  19   0.763  12.366   4.993
  151   2HG   GLU  19          1HG       GLU  19   0.399  11.180   6.247
  152    H    GLU  20           H        GLU  20   2.104   9.061   2.644
  153    HA   GLU  20           HA       GLU  20   4.560   7.723   2.646
  154   1HB   GLU  20          2HB       GLU  20   2.300   6.836   1.854
  155   2HB   GLU  20          1HB       GLU  20   2.637   7.622   0.311
  156   1HG   GLU  20          2HG       GLU  20   4.754   6.339   0.138
  157   2HG   GLU  20          1HG       GLU  20   4.365   5.521   1.651
  158    H    THR  21           H        THR  21   3.283   9.522  -0.187
  159    HA   THR  21           HA       THR  21   5.526   9.518  -1.797
  160    HB   THR  21           HB       THR  21   3.882  12.012  -1.282
  161    HG1  THR  21           HG1      THR  21   2.540  11.116  -2.931
  162   1HG2  THR  21          1HG2      THR  21   5.932  11.250  -3.188
  163   2HG2  THR  21          2HG2      THR  21   5.175  12.822  -2.937
  164   3HG2  THR  21          3HG2      THR  21   4.422  11.642  -4.010
  165    H    ARG  22           H        ARG  22   4.895  11.955   0.758
  166    HA   ARG  22           HA       ARG  22   7.213  13.455   0.617
  167   1HB   ARG  22          2HB       ARG  22   5.401  13.779   2.305
  168   2HB   ARG  22          1HB       ARG  22   6.024  12.390   3.197
  169   1HG   ARG  22          2HG       ARG  22   7.982  13.495   3.822
  170   2HG   ARG  22          1HG       ARG  22   7.891  14.629   2.474
  171   1HD   ARG  22          2HD       ARG  22   7.275  15.936   4.340
  172   2HD   ARG  22          1HD       ARG  22   5.730  15.496   3.616
  173    HE   ARG  22           HE       ARG  22   6.200  13.481   5.463
  174   1HH1  ARG  22          1HH2      ARG  22   6.112  16.928   5.473
  175   2HH1  ARG  22          2HH2      ARG  22   5.572  17.043   7.114
  176   1HH2  ARG  22          2HH1      ARG  22   5.492  13.611   7.607
  177   2HH2  ARG  22          1HH1      ARG  22   5.220  15.165   8.322
  178    H    ASP  23           H        ASP  23   6.869  10.282   2.210
  179    HA   ASP  23           HA       ASP  23   9.574  10.104   3.119
  180   1HB   ASP  23          2HB       ASP  23   7.833   7.773   2.279
  181   2HB   ASP  23          1HB       ASP  23   9.130   7.771   3.476
  182    H    ILE  24           H        ILE  24   8.020   9.161   0.067
  183    HA   ILE  24           HA       ILE  24  10.373   7.894  -1.035
  184    HB   ILE  24           HB       ILE  24   7.875   9.043  -2.305
  185   1HG1  ILE  24          2HG1      ILE  24   8.738   6.161  -2.264
  186   2HG1  ILE  24          1HG1      ILE  24   7.976   6.865  -0.837
  187   1HG2  ILE  24          1HG2      ILE  24  10.414   8.154  -3.507
  188   2HG2  ILE  24          2HG2      ILE  24   9.109   9.108  -4.213
  189   3HG2  ILE  24          3HG2      ILE  24   8.990   7.349  -4.164
  190   1HD1  ILE  24          1HD1      ILE  24   6.481   5.738  -2.686
  191   2HD1  ILE  24          2HD1      ILE  24   6.713   7.268  -3.531
  192   3HD1  ILE  24          3HD1      ILE  24   5.955   7.246  -1.939
  193    H    ILE  25           H        ILE  25   8.825  10.985  -1.998
  194    HA   ILE  25           HA       ILE  25  10.794  12.057  -3.589
  195    HB   ILE  25           HB       ILE  25   9.513  13.698  -1.393
  196   1HG1  ILE  25          2HG1      ILE  25   7.740  12.346  -2.337
  197   2HG1  ILE  25          1HG1      ILE  25   7.610  13.963  -3.030
  198   1HG2  ILE  25          1HG2      ILE  25   9.405  15.056  -3.805
  199   2HG2  ILE  25          2HG2      ILE  25  10.956  14.220  -3.890
  200   3HG2  ILE  25          3HG2      ILE  25  10.611  15.307  -2.544
  201   1HD1  ILE  25          1HD1      ILE  25   8.986  13.126  -4.987
  202   2HD1  ILE  25          2HD1      ILE  25   7.382  12.407  -4.848
  203   3HD1  ILE  25          3HD1      ILE  25   8.802  11.501  -4.326
  204    H    GLN  26           H        GLN  26  10.790  12.064  -0.027
  205    HA   GLN  26           HA       GLN  26  13.181  13.514   0.383
  206   1HB   GLN  26          2HB       GLN  26  11.883  11.273   1.942
  207   2HB   GLN  26          1HB       GLN  26  13.354  12.070   2.500
  208   1HG   GLN  26          2HG       GLN  26  11.128  13.851   1.659
  209   2HG   GLN  26          1HG       GLN  26  10.887  12.946   3.154
  210   1HE2  GLN  26          1HE2      GLN  26  14.058  14.068   1.958
  211   2HE2  GLN  26          2HE2      GLN  26  14.337  15.154   3.233
  212    H    ALA  27           H        ALA  27  12.836   9.944   0.318
  213    HA   ALA  27           HA       ALA  27  15.518   9.229   0.393
  214   1HB   ALA  27          1HB       ALA  27  13.569   7.933  -1.523
  215   2HB   ALA  27          2HB       ALA  27  13.479   7.693   0.222
  216   3HB   ALA  27          3HB       ALA  27  14.913   7.176  -0.666
  217    H    LEU  28           H        LEU  28  13.748   9.514  -2.719
  218    HA   LEU  28           HA       LEU  28  15.892   9.470  -4.457
  219   1HB   LEU  28          2HB       LEU  28  13.606  11.450  -4.680
  220   2HB   LEU  28          1HB       LEU  28  14.580  10.811  -6.004
  221    HG   LEU  28           HG       LEU  28  13.071   8.939  -4.194
  222   1HD1  LEU  28          1HD1      LEU  28  11.098   9.122  -5.480
  223   2HD1  LEU  28          2HD1      LEU  28  11.910  10.031  -6.756
  224   3HD1  LEU  28          3HD1      LEU  28  11.576  10.796  -5.203
  225   1HD2  LEU  28          1HD2      LEU  28  13.592   8.682  -7.152
  226   2HD2  LEU  28          2HD2      LEU  28  13.342   7.407  -5.960
  227   3HD2  LEU  28          3HD2      LEU  28  14.860   8.303  -5.987
  228    H    LEU  29           H        LEU  29  14.548  12.584  -3.285
  229    HA   LEU  29           HA       LEU  29  16.450  14.358  -4.085
  230   1HB   LEU  29          2HB       LEU  29  14.788  14.132  -1.669
  231   2HB   LEU  29          1HB       LEU  29  16.236  15.112  -1.440
  232    HG   LEU  29           HG       LEU  29  14.134  16.328  -2.287
  233   1HD1  LEU  29          1HD1      LEU  29  15.450  17.819  -3.638
  234   2HD1  LEU  29          2HD1      LEU  29  16.584  16.536  -4.056
  235   3HD1  LEU  29          3HD1      LEU  29  16.528  17.160  -2.409
  236   1HD2  LEU  29          1HD2      LEU  29  14.862  15.558  -5.043
  237   2HD2  LEU  29          2HD2      LEU  29  13.270  15.832  -4.336
  238   3HD2  LEU  29          3HD2      LEU  29  14.080  14.281  -4.112
  239    H    GLU  30           H        GLU  30  16.829  12.351  -1.143
  240    HA   GLU  30           HA       GLU  30  19.507  13.159  -0.588
  241   1HB   GLU  30          2HB       GLU  30  18.006  11.894   0.984
  242   2HB   GLU  30          1HB       GLU  30  18.265  10.455  -0.004
  243   1HG   GLU  30          2HG       GLU  30  20.796  10.945   0.339
  244   2HG   GLU  30          1HG       GLU  30  20.261  11.971   1.670
  245    H    ASP  31           H        ASP  31  18.189  10.636  -2.690
  246    HA   ASP  31           HA       ASP  31  20.887  10.382  -3.916
  247   1HB   ASP  31          2HB       ASP  31  19.171   7.953  -3.391
  248   2HB   ASP  31          1HB       ASP  31  20.874   8.010  -3.849
  249    H    GLY  32           H        GLY  32  19.123  11.908  -5.155
  250   1HA   GLY  32          2HA       GLY  32  18.738  10.849  -7.701
  251   2HA   GLY  32          1HA       GLY  32  17.243  10.484  -6.841
  252    H    SER  33           H        SER  33  19.157  13.359  -6.165
  253    HA   SER  33           HA       SER  33  16.915  15.107  -6.430
  254   1HB   SER  33          2HB       SER  33  18.931  15.672  -5.103
  255   2HB   SER  33          1HB       SER  33  19.870  15.778  -6.590
  256    HG   SER  33           HG       SER  33  18.116  17.557  -5.473
  257    H    ASP  34           H        ASP  34  19.317  16.627  -8.171
  258    HA   ASP  34           HA       ASP  34  19.276  17.453 -10.376
  259   1HB   ASP  34          2HB       ASP  34  19.908  14.760 -10.357
  260   2HB   ASP  34          1HB       ASP  34  18.618  14.848 -11.557
  261    HA   PRO  35           HA       PRO  35  14.546  16.926 -10.476
  262   1HB   PRO  35          2HB       PRO  35  13.928  19.438  -9.543
  263   2HB   PRO  35          1HB       PRO  35  14.063  18.006  -8.505
  264   1HG   PRO  35          2HG       PRO  35  16.017  20.197  -8.973
  265   2HG   PRO  35          1HG       PRO  35  15.635  19.321  -7.482
  266   1HD   PRO  35          2HD       PRO  35  17.864  18.795  -8.979
  267   2HD   PRO  35          1HD       PRO  35  17.050  17.564  -7.991
  268    H    ASP  36           H        ASP  36  16.970  18.929 -11.743
  269    HA   ASP  36           HA       ASP  36  15.217  20.553 -13.442
  270   1HB   ASP  36          2HB       ASP  36  17.429  21.197 -14.521
  271   2HB   ASP  36          1HB       ASP  36  17.297  21.571 -12.802
  272    H    ALA  37           H        ALA  37  15.902  17.367 -13.472
  273    HA   ALA  37           HA       ALA  37  16.332  17.158 -16.402
  274   1HB   ALA  37          1HB       ALA  37  17.646  15.672 -14.934
  275   2HB   ALA  37          2HB       ALA  37  16.559  14.736 -15.961
  276   3HB   ALA  37          3HB       ALA  37  16.154  15.009 -14.266
  277    H    LEU  38           H        LEU  38  14.582  14.570 -15.073
  278    HA   LEU  38           HA       LEU  38  11.907  15.621 -15.424
  279   1HB   LEU  38          2HB       LEU  38  13.276  14.877 -17.794
  280   2HB   LEU  38          1HB       LEU  38  12.106  13.598 -17.468
  281    HG   LEU  38           HG       LEU  38  11.375  16.531 -17.381
  282   1HD1  LEU  38          1HD1      LEU  38  11.751  14.704 -19.678
  283   2HD1  LEU  38          2HD1      LEU  38  11.748  16.466 -19.630
  284   3HD1  LEU  38          3HD1      LEU  38  10.223  15.583 -19.662
  285   1HD2  LEU  38          1HD2      LEU  38   9.085  15.573 -17.698
  286   2HD2  LEU  38          2HD2      LEU  38   9.848  15.032 -16.203
  287   3HD2  LEU  38          3HD2      LEU  38   9.782  13.956 -17.599
  288    H    TYR  39           H        TYR  39  10.374  14.131 -14.661
  289    HA   TYR  39           HA       TYR  39  11.445  11.451 -13.880
  290   1HB   TYR  39          2HB       TYR  39  10.216  13.576 -12.242
  291   2HB   TYR  39          1HB       TYR  39   9.536  11.970 -11.982
  292    HD1  TYR  39           HD1      TYR  39  10.647  10.440 -10.604
  293    HD2  TYR  39           HD2      TYR  39  12.822  13.753 -12.255
  294    HE1  TYR  39           HE1      TYR  39  12.627   9.813  -9.248
  295    HE2  TYR  39           HE2      TYR  39  14.804  13.127 -10.900
  296    HH   TYR  39           HH       TYR  39  15.211  11.851  -8.723
  297    H    GLU  40           H        GLU  40  10.210   9.809 -14.676
  298    HA   GLU  40           HA       GLU  40   7.535  10.496 -15.778
  299   1HB   GLU  40          2HB       GLU  40   7.851   8.003 -16.640
  300   2HB   GLU  40          1HB       GLU  40   8.655   9.346 -17.453
  301   1HG   GLU  40          2HG       GLU  40  10.724   8.907 -16.341
  302   2HG   GLU  40          1HG       GLU  40   9.958   7.794 -15.207
  303    H    ILE  41           H        ILE  41   5.791  10.015 -14.548
  304    HA   ILE  41           HA       ILE  41   6.105   8.105 -12.303
  305    HB   ILE  41           HB       ILE  41   4.019  10.160 -13.040
  306   1HG1  ILE  41          2HG1      ILE  41   4.654  11.130 -10.904
  307   2HG1  ILE  41          1HG1      ILE  41   5.664   9.734 -10.525
  308   1HG2  ILE  41          1HG2      ILE  41   2.740   8.273 -12.266
  309   2HG2  ILE  41          2HG2      ILE  41   2.861   9.402 -10.916
  310   3HG2  ILE  41          3HG2      ILE  41   3.881   7.964 -10.958
  311   1HD1  ILE  41          1HD1      ILE  41   7.287  10.312 -12.109
  312   2HD1  ILE  41          2HD1      ILE  41   6.790  11.891 -11.497
  313   3HD1  ILE  41          3HD1      ILE  41   6.165  11.306 -13.039
  314    H    GLU  42           H        GLU  42   4.751   6.279 -12.065
  315    HA   GLU  42           HA       GLU  42   3.192   5.523 -14.505
  316   1HB   GLU  42          2HB       GLU  42   5.368   4.254 -14.207
  317   2HB   GLU  42          1HB       GLU  42   4.699   3.600 -12.712
  318   1HG   GLU  42          2HG       GLU  42   2.912   2.513 -13.878
  319   2HG   GLU  42          1HG       GLU  42   3.275   3.376 -15.372
  320    H    HIS  43           H        HIS  43   1.074   5.564 -13.911
  321    HA   HIS  43           HA       HIS  43   0.358   4.900 -11.107
  322   1HB   HIS  43          2HB       HIS  43  -1.297   6.062 -13.368
  323   2HB   HIS  43          1HB       HIS  43  -1.875   5.798 -11.722
  324    HD2  HIS  43           HD2      HIS  43   0.087   8.454 -13.716
  325    HE1  HIS  43           HE1      HIS  43   0.508   9.458  -9.636
  326    HE2  HIS  43           HE2      HIS  43   0.883  10.260 -12.012
  327    H    HIS  44           H        HIS  44  -1.444   3.404 -10.718
  328    HA   HIS  44           HA       HIS  44  -1.879   1.445 -12.929
  329   1HB   HIS  44          2HB       HIS  44  -1.611   0.493 -10.095
  330   2HB   HIS  44          1HB       HIS  44  -1.330  -0.387 -11.597
  331    HD2  HIS  44           HD2      HIS  44   0.953   1.345 -13.037
  332    HE1  HIS  44           HE1      HIS  44   3.011   1.310  -9.348
  333    HE2  HIS  44           HE2      HIS  44   3.244   1.710 -11.843
  334    H    LEU  45           H        LEU  45  -4.032   1.785 -13.320
  335    HA   LEU  45           HA       LEU  45  -5.862   1.748 -10.951
  336   1HB   LEU  45          2HB       LEU  45  -6.744   2.934 -13.549
  337   2HB   LEU  45          1HB       LEU  45  -7.190   3.384 -11.903
  338    HG   LEU  45           HG       LEU  45  -4.634   4.048 -11.733
  339   1HD1  LEU  45          1HD1      LEU  45  -4.515   3.125 -14.240
  340   2HD1  LEU  45          2HD1      LEU  45  -3.529   4.488 -13.713
  341   3HD1  LEU  45          3HD1      LEU  45  -5.022   4.774 -14.604
  342   1HD2  LEU  45          1HD2      LEU  45  -5.250   6.333 -12.394
  343   2HD2  LEU  45          2HD2      LEU  45  -6.580   5.580 -11.516
  344   3HD2  LEU  45          3HD2      LEU  45  -6.650   5.717 -13.272
  345    H    PHE  46           H        PHE  46  -7.449   0.183 -10.988
  346    HA   PHE  46           HA       PHE  46  -7.672  -1.424 -13.501
  347   1HB   PHE  46          2HB       PHE  46  -8.628  -3.003 -11.399
  348   2HB   PHE  46          1HB       PHE  46  -7.069  -3.170 -12.205
  349    HD1  PHE  46           HD1      PHE  46  -8.655  -2.618  -9.098
  350    HD2  PHE  46           HD2      PHE  46  -5.199  -1.473 -11.377
  351    HE1  PHE  46           HE1      PHE  46  -7.502  -1.944  -7.010
  352    HE2  PHE  46           HE2      PHE  46  -4.044  -0.800  -9.288
  353    HZ   PHE  46           HZ       PHE  46  -5.195  -1.035  -7.103
  354    H    ALA  47           H        ALA  47  -9.797  -2.293 -13.973
  355    HA   ALA  47           HA       ALA  47 -12.010  -0.782 -12.639
  356   1HB   ALA  47          1HB       ALA  47 -11.345  -0.164 -15.089
  357   2HB   ALA  47          2HB       ALA  47 -13.050  -0.401 -14.711
  358   3HB   ALA  47          3HB       ALA  47 -12.138  -1.680 -15.511
  359    H    GLU  48           H        GLU  48 -14.196  -1.956 -13.126
  360    HA   GLU  48           HA       GLU  48 -13.731  -4.892 -12.783
  361   1HB   GLU  48          2HB       GLU  48 -15.878  -3.070 -11.668
  362   2HB   GLU  48          1HB       GLU  48 -15.988  -4.831 -11.613
  363   1HG   GLU  48          2HG       GLU  48 -13.845  -4.925 -10.385
  364   2HG   GLU  48          1HG       GLU  48 -13.748  -3.164 -10.426
  365    H    ASP  49           H        ASP  49 -15.054  -2.512 -14.809
  366    HA   ASP  49           HA       ASP  49 -16.568  -4.622 -16.287
  367   1HB   ASP  49          2HB       ASP  49 -18.086  -2.996 -15.073
  368   2HB   ASP  49          1HB       ASP  49 -17.417  -1.720 -16.091
  369    H    PHE  50           H        PHE  50 -15.637  -4.881 -18.256
  370    HA   PHE  50           HA       PHE  50 -13.564  -3.347 -19.333
  371   1HB   PHE  50          2HB       PHE  50 -14.076  -4.382 -21.485
  372   2HB   PHE  50          1HB       PHE  50 -14.305  -5.571 -20.201
  373    HD1  PHE  50           HD1      PHE  50 -15.832  -3.887 -22.968
  374    HD2  PHE  50           HD2      PHE  50 -16.692  -5.832 -19.236
  375    HE1  PHE  50           HE1      PHE  50 -18.190  -4.199 -23.673
  376    HE2  PHE  50           HE2      PHE  50 -19.049  -6.144 -19.941
  377    HZ   PHE  50           HZ       PHE  50 -19.798  -5.326 -22.160
  378    H    ASP  51           H        ASP  51 -16.996  -2.691 -19.350
  379    HA   ASP  51           HA       ASP  51 -16.991  -0.745 -21.471
  380   1HB   ASP  51          2HB       ASP  51 -18.828  -1.334 -19.155
  381   2HB   ASP  51          1HB       ASP  51 -19.097   0.079 -20.177
  382    H    LYS  52           H        LYS  52 -17.480  -0.044 -17.995
  383    HA   LYS  52           HA       LYS  52 -16.787   2.680 -18.143
  384   1HB   LYS  52          2HB       LYS  52 -17.780   1.380 -16.160
  385   2HB   LYS  52          1HB       LYS  52 -16.117   0.951 -15.758
  386   1HG   LYS  52          2HG       LYS  52 -16.065   2.910 -14.622
  387   2HG   LYS  52          1HG       LYS  52 -15.944   3.672 -16.209
  388   1HD   LYS  52          2HD       LYS  52 -18.593   2.998 -14.908
  389   2HD   LYS  52          1HD       LYS  52 -17.804   4.565 -14.722
  390   1HE   LYS  52          2HE       LYS  52 -19.206   4.937 -16.561
  391   2HE   LYS  52          1HE       LYS  52 -17.677   4.524 -17.336
  392   1HZ   LYS  52          1HZ       LYS  52 -20.001   3.316 -17.864
  393   2HZ   LYS  52          2HZ       LYS  52 -19.372   2.272 -16.680
  394   3HZ   LYS  52          3HZ       LYS  52 -18.484   2.592 -18.093
  395    H    LEU  53           H        LEU  53 -14.747  -0.153 -18.096
  396    HA   LEU  53           HA       LEU  53 -12.294   1.029 -17.285
  397   1HB   LEU  53          2HB       LEU  53 -12.700  -1.429 -17.630
  398   2HB   LEU  53          1HB       LEU  53 -12.651  -1.145 -19.369
  399    HG   LEU  53           HG       LEU  53 -10.401  -0.334 -17.515
  400   1HD1  LEU  53          1HD1      LEU  53 -10.285  -2.752 -19.291
  401   2HD1  LEU  53          2HD1      LEU  53 -11.029  -2.888 -17.698
  402   3HD1  LEU  53          3HD1      LEU  53  -9.345  -2.386 -17.846
  403   1HD2  LEU  53          1HD2      LEU  53  -9.911   0.784 -19.450
  404   2HD2  LEU  53          2HD2      LEU  53 -10.950  -0.252 -20.429
  405   3HD2  LEU  53          3HD2      LEU  53  -9.336  -0.796 -19.978
  406    H    GLU  54           H        GLU  54 -13.631   0.612 -20.581
  407    HA   GLU  54           HA       GLU  54 -11.502   2.026 -21.885
  408   1HB   GLU  54          2HB       GLU  54 -13.191   0.500 -22.996
  409   2HB   GLU  54          1HB       GLU  54 -14.367   1.806 -22.841
  410   1HG   GLU  54          2HG       GLU  54 -13.466   2.100 -25.009
  411   2HG   GLU  54          1HG       GLU  54 -12.602   3.280 -24.020
  412    H    LYS  55           H        LYS  55 -14.503   3.081 -20.359
  413    HA   LYS  55           HA       LYS  55 -14.499   5.748 -21.436
  414   1HB   LYS  55          2HB       LYS  55 -15.984   4.245 -19.436
  415   2HB   LYS  55          1HB       LYS  55 -15.666   5.890 -18.889
  416   1HG   LYS  55          2HG       LYS  55 -17.694   6.073 -20.085
  417   2HG   LYS  55          1HG       LYS  55 -16.479   6.617 -21.239
  418   1HD   LYS  55          2HD       LYS  55 -17.462   5.092 -22.619
  419   2HD   LYS  55          1HD       LYS  55 -16.476   3.933 -21.726
  420   1HE   LYS  55          2HE       LYS  55 -18.400   3.726 -20.081
  421   2HE   LYS  55          1HE       LYS  55 -19.371   4.659 -21.220
  422   1HZ   LYS  55          1HZ       LYS  55 -19.820   2.650 -22.073
  423   2HZ   LYS  55          2HZ       LYS  55 -18.450   1.920 -21.381
  424   3HZ   LYS  55          3HZ       LYS  55 -18.307   2.806 -22.823
  425    H    ALA  56           H        ALA  56 -13.651   4.706 -18.109
  426    HA   ALA  56           HA       ALA  56 -12.414   7.145 -17.363
  427   1HB   ALA  56          1HB       ALA  56 -11.793   6.052 -15.427
  428   2HB   ALA  56          2HB       ALA  56 -11.314   4.586 -16.282
  429   3HB   ALA  56          3HB       ALA  56 -13.022   4.926 -16.004
  430    H    ALA  57           H        ALA  57 -11.104   4.326 -19.054
  431    HA   ALA  57           HA       ALA  57  -8.348   5.178 -18.902
  432   1HB   ALA  57          1HB       ALA  57  -8.708   2.880 -19.399
  433   2HB   ALA  57          2HB       ALA  57  -8.119   3.581 -20.907
  434   3HB   ALA  57          3HB       ALA  57  -9.841   3.257 -20.698
  435    H    VAL  58           H        VAL  58 -10.947   5.661 -21.271
  436    HA   VAL  58           HA       VAL  58  -9.307   6.972 -23.238
  437    HB   VAL  58           HB       VAL  58 -12.252   6.783 -22.694
  438   1HG1  VAL  58          1HG1      VAL  58 -12.279   9.021 -23.361
  439   2HG1  VAL  58          2HG1      VAL  58 -12.402   8.190 -24.911
  440   3HG1  VAL  58          3HG1      VAL  58 -10.851   8.838 -24.379
  441   1HG2  VAL  58          1HG2      VAL  58 -10.892   6.371 -25.332
  442   2HG2  VAL  58          2HG2      VAL  58 -12.267   5.514 -24.639
  443   3HG2  VAL  58          3HG2      VAL  58 -10.636   5.178 -24.060
  444    H    GLU  59           H        GLU  59 -11.476   8.260 -20.698
  445    HA   GLU  59           HA       GLU  59 -10.983  11.011 -21.202
  446   1HB   GLU  59          2HB       GLU  59 -12.244   9.424 -19.142
  447   2HB   GLU  59          1HB       GLU  59 -11.292  10.714 -18.408
  448   1HG   GLU  59          2HG       GLU  59 -13.529  11.557 -18.853
  449   2HG   GLU  59          1HG       GLU  59 -12.398  12.342 -19.957
  450    H    ALA  60           H        ALA  60  -9.423   8.887 -18.768
  451    HA   ALA  60           HA       ALA  60  -7.529  10.705 -17.795
  452   1HB   ALA  60          1HB       ALA  60  -6.988   7.774 -18.356
  453   2HB   ALA  60          2HB       ALA  60  -7.892   8.360 -16.959
  454   3HB   ALA  60          3HB       ALA  60  -6.191   8.786 -17.151
  455    H    PHE  61           H        PHE  61  -7.465   8.829 -20.796
  456    HA   PHE  61           HA       PHE  61  -4.749   9.614 -21.480
  457   1HB   PHE  61          2HB       PHE  61  -5.428   7.646 -22.565
  458   2HB   PHE  61          1HB       PHE  61  -7.021   8.296 -22.951
  459    HD1  PHE  61           HD1      PHE  61  -7.406   8.998 -25.138
  460    HD2  PHE  61           HD2      PHE  61  -3.402   9.077 -23.584
  461    HE1  PHE  61           HE1      PHE  61  -6.563   9.754 -27.344
  462    HE2  PHE  61           HE2      PHE  61  -2.560   9.834 -25.790
  463    HZ   PHE  61           HZ       PHE  61  -4.140  10.172 -27.670
  464    H    LYS  62           H        LYS  62  -7.980  10.878 -22.092
  465    HA   LYS  62           HA       LYS  62  -7.297  12.737 -24.152
  466   1HB   LYS  62          2HB       LYS  62  -9.634  12.031 -23.193
  467   2HB   LYS  62          1HB       LYS  62  -9.369  13.359 -22.061
  468   1HG   LYS  62          2HG       LYS  62  -8.926  14.857 -24.035
  469   2HG   LYS  62          1HG       LYS  62  -9.412  13.526 -25.086
  470   1HD   LYS  62          2HD       LYS  62 -11.619  13.795 -24.612
  471   2HD   LYS  62          1HD       LYS  62 -11.309  14.104 -22.903
  472   1HE   LYS  62          2HE       LYS  62 -10.955  16.383 -23.239
  473   2HE   LYS  62          1HE       LYS  62 -10.522  16.168 -24.935
  474   1HZ   LYS  62          1HZ       LYS  62 -13.240  15.589 -23.925
  475   2HZ   LYS  62          2HZ       LYS  62 -12.743  15.833 -25.530
  476   3HZ   LYS  62          3HZ       LYS  62 -12.791  17.139 -24.445
  477    H    MET  63           H        MET  63  -7.223  12.989 -20.609
  478    HA   MET  63           HA       MET  63  -6.600  15.758 -20.437
  479   1HB   MET  63          2HB       MET  63  -5.620  13.538 -18.616
  480   2HB   MET  63          1HB       MET  63  -5.739  15.250 -18.209
  481   1HG   MET  63          2HG       MET  63  -8.276  14.801 -19.035
  482   2HG   MET  63          1HG       MET  63  -7.877  13.200 -18.411
  483   1HE   MET  63          1HE       MET  63  -9.030  13.589 -15.012
  484   2HE   MET  63          2HE       MET  63  -8.077  12.547 -16.067
  485   3HE   MET  63          3HE       MET  63  -9.603  13.213 -16.643
  486    H    GLY  64           H        GLY  64  -4.393  12.937 -20.506
  487   1HA   GLY  64          2HA       GLY  64  -2.487  13.669 -22.262
  488   2HA   GLY  64          1HA       GLY  64  -2.101  14.752 -20.924
  489    H    PHE  65           H        PHE  65  -3.358  11.471 -20.548
  490    HA   PHE  65           HA       PHE  65  -0.783  10.768 -19.202
  491   1HB   PHE  65          2HB       PHE  65  -3.620   9.806 -18.772
  492   2HB   PHE  65          1HB       PHE  65  -2.223   8.981 -18.081
  493    HD1  PHE  65           HD1      PHE  65  -3.590  12.466 -18.414
  494    HD2  PHE  65           HD2      PHE  65  -1.537   9.609 -15.949
  495    HE1  PHE  65           HE1      PHE  65  -3.531  14.111 -16.558
  496    HE2  PHE  65           HE2      PHE  65  -1.478  11.253 -14.094
  497    HZ   PHE  65           HZ       PHE  65  -2.474  13.503 -14.397
  498    H    GLU  66           H        GLU  66   0.274   8.874 -19.809
  499    HA   GLU  66           HA       GLU  66  -0.531   7.727 -22.398
  500   1HB   GLU  66          2HB       GLU  66   1.914   7.894 -20.799
  501   2HB   GLU  66          1HB       GLU  66   1.662   6.282 -21.469
  502   1HG   GLU  66          2HG       GLU  66   2.869   7.455 -23.144
  503   2HG   GLU  66          1HG       GLU  66   1.197   7.466 -23.705
  504    H    VAL  67           H        VAL  67  -2.521   6.697 -21.552
  505    HA   VAL  67           HA       VAL  67  -2.502   4.739 -19.478
  506    HB   VAL  67           HB       VAL  67  -4.601   5.642 -20.313
  507   1HG1  VAL  67          1HG1      VAL  67  -5.364   5.350 -22.547
  508   2HG1  VAL  67          2HG1      VAL  67  -4.128   4.140 -22.892
  509   3HG1  VAL  67          3HG1      VAL  67  -3.674   5.833 -22.703
  510   1HG2  VAL  67          1HG2      VAL  67  -4.346   2.704 -21.035
  511   2HG2  VAL  67          2HG2      VAL  67  -5.841   3.546 -20.630
  512   3HG2  VAL  67          3HG2      VAL  67  -4.594   3.325 -19.402
  513    H    LEU  68           H        LEU  68  -1.655   2.716 -19.450
  514    HA   LEU  68           HA       LEU  68  -0.681   1.581 -22.029
  515   1HB   LEU  68          2HB       LEU  68   0.770   1.918 -19.839
  516   2HB   LEU  68          1HB       LEU  68   0.000   0.406 -19.355
  517    HG   LEU  68           HG       LEU  68   0.696  -0.413 -21.742
  518   1HD1  LEU  68          1HD1      LEU  68   2.963   1.507 -21.369
  519   2HD1  LEU  68          2HD1      LEU  68   1.489   2.092 -22.142
  520   3HD1  LEU  68          3HD1      LEU  68   2.377   0.740 -22.846
  521   1HD2  LEU  68          1HD2      LEU  68   2.207  -0.194 -19.209
  522   2HD2  LEU  68          2HD2      LEU  68   3.189  -0.574 -20.623
  523   3HD2  LEU  68          3HD2      LEU  68   1.840  -1.620 -20.181
  524    H    GLU  69           H        GLU  69  -1.365  -0.472 -22.695
  525    HA   GLU  69           HA       GLU  69  -3.932  -1.360 -22.194
  526   1HB   GLU  69          2HB       GLU  69  -1.458  -2.967 -22.869
  527   2HB   GLU  69          1HB       GLU  69  -3.072  -3.676 -22.837
  528   1HG   GLU  69          2HG       GLU  69  -3.118  -1.201 -24.327
  529   2HG   GLU  69          1HG       GLU  69  -1.870  -2.268 -24.972
  530    H    ALA  70           H        ALA  70  -4.684  -3.313 -20.962
  531    HA   ALA  70           HA       ALA  70  -3.315  -3.428 -18.307
  532   1HB   ALA  70          1HB       ALA  70  -5.545  -2.477 -18.131
  533   2HB   ALA  70          2HB       ALA  70  -5.571  -4.097 -17.434
  534   3HB   ALA  70          3HB       ALA  70  -6.228  -3.820 -19.047
  535    H    GLU  71           H        GLU  71  -3.810  -5.601 -17.153
  536    HA   GLU  71           HA       GLU  71  -3.754  -7.835 -19.141
  537   1HB   GLU  71          2HB       GLU  71  -1.471  -7.287 -18.209
  538   2HB   GLU  71          1HB       GLU  71  -2.088  -7.708 -16.611
  539   1HG   GLU  71          2HG       GLU  71  -2.877  -9.868 -18.138
  540   2HG   GLU  71          1HG       GLU  71  -1.307  -9.464 -18.832
  541    H    GLU  72           H        GLU  72  -4.890  -9.687 -18.510
  542    HA   GLU  72           HA       GLU  72  -7.061  -9.452 -16.746
  543   1HB   GLU  72          2HB       GLU  72  -6.981 -12.017 -16.707
  544   2HB   GLU  72          1HB       GLU  72  -7.090 -11.262 -18.298
  545   1HG   GLU  72          2HG       GLU  72  -4.862 -11.721 -18.819
  546   2HG   GLU  72          1HG       GLU  72  -4.389 -11.849 -17.125
  547    H    THR  73           H        THR  73  -7.308  -9.709 -14.552
  548    HA   THR  73           HA       THR  73  -4.878 -10.546 -13.018
  549    HB   THR  73           HB       THR  73  -6.665  -8.874 -11.473
  550    HG1  THR  73           HG1      THR  73  -6.376  -8.209 -14.056
  551   1HG2  THR  73          1HG2      THR  73  -4.167  -9.417 -11.202
  552   2HG2  THR  73          2HG2      THR  73  -4.650  -7.741 -10.941
  553   3HG2  THR  73          3HG2      THR  73  -3.891  -8.213 -12.462
  554    H    GLU  74           H        GLU  74  -5.906 -10.806 -10.525
  555    HA   GLU  74           HA       GLU  74  -8.464 -12.007 -10.269
  556   1HB   GLU  74          2HB       GLU  74  -7.688 -14.429 -10.127
  557   2HB   GLU  74          1HB       GLU  74  -7.758 -13.754 -11.754
  558   1HG   GLU  74          2HG       GLU  74  -5.607 -14.400 -11.985
  559   2HG   GLU  74          1HG       GLU  74  -5.197 -13.095 -10.873
  560    H    ASP  75           H        ASP  75  -8.827 -12.609  -8.099
  561    HA   ASP  75           HA       ASP  75  -6.593 -11.938  -6.263
  562   1HB   ASP  75          2HB       ASP  75  -9.570 -12.282  -5.806
  563   2HB   ASP  75          1HB       ASP  75  -8.411 -11.926  -4.525
  564    H    GLU  76           H        GLU  76  -8.248 -14.662  -7.511
  565    HA   GLU  76           HA       GLU  76  -6.618 -16.479  -5.952
  566   1HB   GLU  76          2HB       GLU  76  -8.487 -15.803  -4.342
  567   2HB   GLU  76          1HB       GLU  76  -9.595 -16.639  -5.430
  568   1HG   GLU  76          2HG       GLU  76  -7.232 -18.244  -4.798
  569   2HG   GLU  76          1HG       GLU  76  -8.164 -17.819  -3.363
  570    H    ASP  77           H        ASP  77  -7.163 -15.989  -8.742
  571    HA   ASP  77           HA       ASP  77  -7.588 -17.220 -10.696
  572   1HB   ASP  77          2HB       ASP  77  -6.410 -18.957  -9.019
  573   2HB   ASP  77          1HB       ASP  77  -7.987 -19.735  -9.145
  574    H    GLY  78           H        GLY  78  -9.816 -16.115  -9.031
  575   1HA   GLY  78          2HA       GLY  78 -11.973 -17.850 -10.154
  576   2HA   GLY  78          1HA       GLY  78 -12.103 -17.213  -8.515
  577    H    ASN  79           H        ASN  79 -10.559 -14.796  -9.991
  578    HA   ASN  79           HA       ASN  79 -13.044 -13.581 -11.119
  579   1HB   ASN  79          2HB       ASN  79 -11.857 -12.870  -8.677
  580   2HB   ASN  79          1HB       ASN  79 -11.337 -11.624  -9.811
  581   1HD2  ASN  79          1HD2      ASN  79 -13.650 -12.010  -7.596
  582   2HD2  ASN  79          2HD2      ASN  79 -14.966 -11.254  -8.353
  583    H    LYS  80           H        LYS  80 -12.601 -11.813 -12.640
  584    HA   LYS  80           HA       LYS  80  -9.813 -11.851 -13.713
  585   1HB   LYS  80          2HB       LYS  80 -12.396 -11.923 -15.303
  586   2HB   LYS  80          1HB       LYS  80 -10.785 -11.744 -16.001
  587   1HG   LYS  80          2HG       LYS  80 -10.482 -13.950 -14.369
  588   2HG   LYS  80          1HG       LYS  80 -12.123 -14.154 -14.985
  589   1HD   LYS  80          2HD       LYS  80 -11.287 -13.860 -17.295
  590   2HD   LYS  80          1HD       LYS  80  -9.645 -13.693 -16.672
  591   1HE   LYS  80          2HE       LYS  80  -9.487 -15.931 -16.091
  592   2HE   LYS  80          1HE       LYS  80 -11.229 -16.105 -15.876
  593   1HZ   LYS  80          1HZ       LYS  80  -9.734 -15.924 -18.428
  594   2HZ   LYS  80          2HZ       LYS  80 -11.425 -15.795 -18.331
  595   3HZ   LYS  80          3HZ       LYS  80 -10.652 -17.231 -17.857
  596    H    LEU  81           H        LEU  81  -9.212  -9.814 -12.988
  597    HA   LEU  81           HA       LEU  81 -11.024  -7.538 -13.661
  598   1HB   LEU  81          2HB       LEU  81  -8.591  -7.128 -11.988
  599   2HB   LEU  81          1HB       LEU  81 -10.194  -6.411 -11.833
  600    HG   LEU  81           HG       LEU  81  -9.541  -9.300 -11.184
  601   1HD1  LEU  81          1HD1      LEU  81  -9.297  -8.720  -8.962
  602   2HD1  LEU  81          2HD1      LEU  81 -10.298  -7.277  -9.119
  603   3HD1  LEU  81          3HD1      LEU  81  -8.638  -7.269  -9.716
  604   1HD2  LEU  81          1HD2      LEU  81 -11.882  -8.858 -11.884
  605   2HD2  LEU  81          2HD2      LEU  81 -12.001  -7.603 -10.651
  606   3HD2  LEU  81          3HD2      LEU  81 -11.787  -9.289 -10.177
  607    H    LEU  82           H        LEU  82  -9.634  -5.459 -14.162
  608    HA   LEU  82           HA       LEU  82  -7.387  -6.225 -15.979
  609   1HB   LEU  82          2HB       LEU  82  -9.671  -4.306 -16.509
  610   2HB   LEU  82          1HB       LEU  82  -8.204  -4.358 -17.489
  611    HG   LEU  82           HG       LEU  82  -8.941  -7.022 -17.339
  612   1HD1  LEU  82          1HD1      LEU  82 -11.398  -5.259 -17.530
  613   2HD1  LEU  82          2HD1      LEU  82 -11.098  -6.556 -16.374
  614   3HD1  LEU  82          3HD1      LEU  82 -11.365  -6.936 -18.075
  615   1HD2  LEU  82          1HD2      LEU  82  -8.138  -5.699 -19.313
  616   2HD2  LEU  82          2HD2      LEU  82  -9.759  -5.024 -19.472
  617   3HD2  LEU  82          3HD2      LEU  82  -9.498  -6.754 -19.695
  618    H    CYS  83           H        CYS  83  -5.584  -4.925 -15.793
  619    HA   CYS  83           HA       CYS  83  -5.861  -2.487 -14.083
  620   1HB   CYS  83          2HB       CYS  83  -3.417  -4.265 -14.170
  621   2HB   CYS  83          1HB       CYS  83  -3.785  -2.987 -13.012
  622    HG   CYS  83           HG       CYS  83  -4.907  -5.846 -12.935
  623    H    PHE  84           H        PHE  84  -5.782  -0.925 -15.698
  624    HA   PHE  84           HA       PHE  84  -3.695  -1.129 -17.785
  625   1HB   PHE  84          2HB       PHE  84  -4.760   1.108 -18.508
  626   2HB   PHE  84          1HB       PHE  84  -5.755  -0.340 -18.661
  627    HD1  PHE  84           HD1      PHE  84  -7.283  -0.936 -16.642
  628    HD2  PHE  84           HD2      PHE  84  -5.538   2.939 -17.263
  629    HE1  PHE  84           HE1      PHE  84  -8.984   0.071 -15.144
  630    HE2  PHE  84           HE2      PHE  84  -7.238   3.946 -15.765
  631    HZ   PHE  84           HZ       PHE  84  -8.962   2.511 -14.706
  632    H    ASP  85           H        ASP  85  -1.921   0.296 -17.888
  633    HA   ASP  85           HA       ASP  85  -1.412   1.788 -15.359
  634   1HB   ASP  85          2HB       ASP  85   0.679   1.301 -17.457
  635   2HB   ASP  85          1HB       ASP  85   0.868   1.449 -15.710
  636    H    ALA  86           H        ALA  86  -0.278   3.895 -15.568
  637    HA   ALA  86           HA       ALA  86  -0.796   5.286 -18.152
  638   1HB   ALA  86          1HB       ALA  86  -2.373   5.634 -15.855
  639   2HB   ALA  86          2HB       ALA  86  -2.320   6.696 -17.263
  640   3HB   ALA  86          3HB       ALA  86  -1.287   7.023 -15.872
  641    H    THR  87           H        THR  87   0.835   6.730 -18.687
  642    HA   THR  87           HA       THR  87   2.975   7.113 -16.629
  643    HB   THR  87           HB       THR  87   4.128   7.553 -19.139
  644    HG1  THR  87           HG1      THR  87   3.489   5.836 -20.361
  645   1HG2  THR  87          1HG2      THR  87   5.280   5.394 -18.652
  646   2HG2  THR  87          2HG2      THR  87   4.114   5.098 -17.363
  647   3HG2  THR  87          3HG2      THR  87   5.221   6.467 -17.254
  648    H    MET  88           H        MET  88   3.643   9.204 -16.256
  649    HA   MET  88           HA       MET  88   2.737  11.331 -18.132
  650   1HB   MET  88          2HB       MET  88   1.061  11.157 -16.296
  651   2HB   MET  88          1HB       MET  88   2.350  11.433 -15.124
  652   1HG   MET  88          2HG       MET  88   1.323  13.564 -15.501
  653   2HG   MET  88          1HG       MET  88   2.856  13.595 -16.372
  654   1HE   MET  88          1HE       MET  88  -0.695  14.111 -16.297
  655   2HE   MET  88          2HE       MET  88  -1.053  14.722 -17.910
  656   3HE   MET  88          3HE       MET  88   0.174  15.517 -16.927
  657    H    GLN  89           H        GLN  89   4.505  12.525 -18.639
  658    HA   GLN  89           HA       GLN  89   6.924  12.347 -16.997
  659   1HB   GLN  89          2HB       GLN  89   6.284  13.906 -19.518
  660   2HB   GLN  89          1HB       GLN  89   7.873  13.872 -18.752
  661   1HG   GLN  89          2HG       GLN  89   8.329  11.980 -19.878
  662   2HG   GLN  89          1HG       GLN  89   7.049  11.175 -18.971
  663   1HE2  GLN  89          1HE2      GLN  89   5.286  10.445 -20.185
  664   2HE2  GLN  89          2HE2      GLN  89   4.929  10.943 -21.767
  665    H    SER  90           H        SER  90   7.278  13.679 -15.298
  666    HA   SER  90           HA       SER  90   6.417  16.508 -15.479
  667   1HB   SER  90          2HB       SER  90   4.811  16.375 -13.897
  668   2HB   SER  90          1HB       SER  90   4.903  14.624 -14.065
  669    HG   SER  90           HG       SER  90   5.494  14.761 -12.040
  670    H    ALA  91           H        ALA  91   7.231  17.604 -13.272
  671    HA   ALA  91           HA       ALA  91  10.083  16.846 -13.073
  672   1HB   ALA  91          1HB       ALA  91   8.762  19.182 -11.689
  673   2HB   ALA  91          2HB       ALA  91   9.207  19.254 -13.394
  674   3HB   ALA  91          3HB       ALA  91  10.450  19.005 -12.169
  675    H    LEU  92           H        LEU  92  11.043  16.156 -11.152
  676    HA   LEU  92           HA       LEU  92   9.519  14.672  -9.299
  677   1HB   LEU  92          2HB       LEU  92  12.010  14.505  -9.662
  678   2HB   LEU  92          1HB       LEU  92  12.189  15.990  -8.726
  679    HG   LEU  92           HG       LEU  92  10.733  14.698  -6.950
  680   1HD1  LEU  92          1HD1      LEU  92  10.651  12.400  -7.099
  681   2HD1  LEU  92          2HD1      LEU  92  12.146  12.302  -8.029
  682   3HD1  LEU  92          3HD1      LEU  92  10.645  12.782  -8.821
  683   1HD2  LEU  92          1HD2      LEU  92  13.627  13.932  -7.457
  684   2HD2  LEU  92          2HD2      LEU  92  12.792  13.902  -5.903
  685   3HD2  LEU  92          3HD2      LEU  92  13.110  15.440  -6.703
  686    H    ASP  93           H        ASP  93   7.845  15.690  -8.227
  687    HA   ASP  93           HA       ASP  93   8.580  17.674  -6.189
  688   1HB   ASP  93          2HB       ASP  93   7.192  18.404  -8.687
  689   2HB   ASP  93          1HB       ASP  93   6.373  18.943  -7.222
  690    H    ALA  94           H        ALA  94   7.443  17.140  -4.389
  691    HA   ALA  94           HA       ALA  94   5.481  15.070  -4.360
  692   1HB   ALA  94          1HB       ALA  94   5.658  15.269  -2.108
  693   2HB   ALA  94          2HB       ALA  94   5.265  16.989  -2.148
  694   3HB   ALA  94          3HB       ALA  94   6.920  16.453  -2.443
  695    H    LYS  95           H        LYS  95   5.167  18.614  -4.373
  696    HA   LYS  95           HA       LYS  95   2.330  18.700  -4.046
  697   1HB   LYS  95          2HB       LYS  95   3.924  20.659  -5.709
  698   2HB   LYS  95          1HB       LYS  95   2.465  20.967  -4.767
  699   1HG   LYS  95          2HG       LYS  95   4.009  20.084  -2.775
  700   2HG   LYS  95          1HG       LYS  95   5.289  20.663  -3.842
  701   1HD   LYS  95          2HD       LYS  95   3.810  22.812  -4.034
  702   2HD   LYS  95          1HD       LYS  95   3.065  22.219  -2.549
  703   1HE   LYS  95          2HE       LYS  95   5.808  21.924  -2.106
  704   2HE   LYS  95          1HE       LYS  95   5.664  23.477  -2.928
  705   1HZ   LYS  95          1HZ       LYS  95   4.896  22.756  -0.279
  706   2HZ   LYS  95          2HZ       LYS  95   3.599  23.443  -1.135
  707   3HZ   LYS  95          3HZ       LYS  95   5.059  24.296  -0.972
  708    H    LEU  96           H        LEU  96   4.266  18.949  -7.057
  709    HA   LEU  96           HA       LEU  96   2.135  18.884  -8.886
  710   1HB   LEU  96          2HB       LEU  96   5.008  18.110  -8.966
  711   2HB   LEU  96          1HB       LEU  96   3.988  17.429 -10.233
  712    HG   LEU  96           HG       LEU  96   3.118  19.875 -10.521
  713   1HD1  LEU  96          1HD1      LEU  96   5.837  20.654  -9.562
  714   2HD1  LEU  96          2HD1      LEU  96   4.585  20.404  -8.346
  715   3HD1  LEU  96          3HD1      LEU  96   4.352  21.604  -9.617
  716   1HD2  LEU  96          1HD2      LEU  96   4.295  19.094 -12.356
  717   2HD2  LEU  96          2HD2      LEU  96   5.715  18.673 -11.397
  718   3HD2  LEU  96          3HD2      LEU  96   5.397  20.358 -11.810
  719    H    ILE  97           H        ILE  97   3.830  16.159  -7.343
  720    HA   ILE  97           HA       ILE  97   2.354  14.095  -8.676
  721    HB   ILE  97           HB       ILE  97   3.866  14.205  -6.063
  722   1HG1  ILE  97          2HG1      ILE  97   4.398  12.518  -8.512
  723   2HG1  ILE  97          1HG1      ILE  97   4.969  14.184  -8.404
  724   1HG2  ILE  97          1HG2      ILE  97   2.535  12.468  -5.420
  725   2HG2  ILE  97          2HG2      ILE  97   3.536  11.542  -6.538
  726   3HG2  ILE  97          3HG2      ILE  97   1.971  12.162  -7.063
  727   1HD1  ILE  97          1HD1      ILE  97   5.515  12.444  -6.055
  728   2HD1  ILE  97          2HD1      ILE  97   6.522  13.693  -6.789
  729   3HD1  ILE  97          3HD1      ILE  97   6.426  12.093  -7.523
  730    H    ASP  98           H        ASP  98   1.662  16.127  -5.902
  731    HA   ASP  98           HA       ASP  98  -0.500  14.547  -4.840
  732   1HB   ASP  98          2HB       ASP  98   0.772  16.521  -3.737
  733   2HB   ASP  98          1HB       ASP  98  -0.347  17.550  -4.632
  734    H    GLU  99           H        GLU  99  -0.510  17.470  -6.920
  735    HA   GLU  99           HA       GLU  99  -3.319  17.504  -7.368
  736   1HB   GLU  99          2HB       GLU  99  -1.169  18.367  -9.324
  737   2HB   GLU  99          1HB       GLU  99  -2.838  18.933  -9.270
  738   1HG   GLU  99          2HG       GLU  99  -2.244  19.612  -6.807
  739   2HG   GLU  99          1HG       GLU  99  -0.579  19.532  -7.382
  740    H    GLN 100           H        GLN 100  -0.705  16.024  -9.309
  741    HA   GLN 100           HA       GLN 100  -2.263  14.943 -11.379
  742   1HB   GLN 100          2HB       GLN 100   0.142  13.716  -9.991
  743   2HB   GLN 100          1HB       GLN 100  -0.505  13.177 -11.541
  744   1HG   GLN 100          2HG       GLN 100   0.272  16.056 -11.094
  745   2HG   GLN 100          1HG       GLN 100   1.466  14.854 -11.585
  746   1HE2  GLN 100          1HE2      GLN 100  -0.026  17.213 -13.049
  747   2HE2  GLN 100          2HE2      GLN 100  -0.521  16.494 -14.506
  748    H    VAL 101           H        VAL 101  -1.409  13.361  -8.281
  749    HA   VAL 101           HA       VAL 101  -3.014  11.038  -8.702
  750    HB   VAL 101           HB       VAL 101  -2.191  12.384  -6.110
  751   1HG1  VAL 101          1HG1      VAL 101  -2.449   9.847  -5.398
  752   2HG1  VAL 101          2HG1      VAL 101  -3.577   9.803  -6.753
  753   3HG1  VAL 101          3HG1      VAL 101  -3.853  10.915  -5.413
  754   1HG2  VAL 101          1HG2      VAL 101  -0.197  11.265  -6.272
  755   2HG2  VAL 101          2HG2      VAL 101  -0.544  11.350  -8.000
  756   3HG2  VAL 101          3HG2      VAL 101  -0.923   9.883  -7.095
  757    H    GLU 102           H        GLU 102  -3.728  13.864  -6.616
  758    HA   GLU 102           HA       GLU 102  -6.335  13.292  -5.898
  759   1HB   GLU 102          2HB       GLU 102  -5.128  15.336  -5.195
  760   2HB   GLU 102          1HB       GLU 102  -5.325  16.001  -6.818
  761   1HG   GLU 102          2HG       GLU 102  -7.834  15.684  -6.508
  762   2HG   GLU 102          1HG       GLU 102  -7.492  15.361  -4.807
  763    H    LYS 103           H        LYS 103  -5.193  14.346  -9.063
  764    HA   LYS 103           HA       LYS 103  -7.805  14.898 -10.158
  765   1HB   LYS 103          2HB       LYS 103  -5.616  15.683 -11.136
  766   2HB   LYS 103          1HB       LYS 103  -5.323  14.025 -11.662
  767   1HG   LYS 103          2HG       LYS 103  -6.373  14.773 -13.560
  768   2HG   LYS 103          1HG       LYS 103  -7.814  14.350 -12.636
  769   1HD   LYS 103          2HD       LYS 103  -7.810  16.725 -11.742
  770   2HD   LYS 103          1HD       LYS 103  -6.559  17.088 -12.931
  771   1HE   LYS 103          2HE       LYS 103  -8.740  15.670 -14.192
  772   2HE   LYS 103          1HE       LYS 103  -9.349  17.093 -13.347
  773   1HZ   LYS 103          1HZ       LYS 103  -8.242  18.488 -14.702
  774   2HZ   LYS 103          2HZ       LYS 103  -8.314  17.181 -15.785
  775   3HZ   LYS 103          3HZ       LYS 103  -6.906  17.458 -14.875
  776    H    LEU 104           H        LEU 104  -5.645  12.056 -10.396
  777    HA   LEU 104           HA       LEU 104  -7.541  10.471 -11.872
  778   1HB   LEU 104          2HB       LEU 104  -5.069   9.828 -10.266
  779   2HB   LEU 104          1HB       LEU 104  -6.063   8.546 -10.962
  780    HG   LEU 104           HG       LEU 104  -5.130  10.857 -12.656
  781   1HD1  LEU 104          1HD1      LEU 104  -3.169   9.739 -11.496
  782   2HD1  LEU 104          2HD1      LEU 104  -3.140   9.646 -13.256
  783   3HD1  LEU 104          3HD1      LEU 104  -3.636   8.244 -12.308
  784   1HD2  LEU 104          1HD2      LEU 104  -6.808   8.672 -13.077
  785   2HD2  LEU 104          2HD2      LEU 104  -5.277   8.164 -13.791
  786   3HD2  LEU 104          3HD2      LEU 104  -6.054   9.651 -14.336
  787    H    VAL 105           H        VAL 105  -7.127  11.188  -8.485
  788    HA   VAL 105           HA       VAL 105  -8.644   8.935  -7.483
  789    HB   VAL 105           HB       VAL 105  -8.147  11.651  -6.222
  790   1HG1  VAL 105          1HG1      VAL 105  -8.821   9.015  -4.891
  791   2HG1  VAL 105          2HG1      VAL 105 -10.035  10.232  -5.282
  792   3HG1  VAL 105          3HG1      VAL 105  -8.745  10.608  -4.140
  793   1HG2  VAL 105          1HG2      VAL 105  -6.117  10.871  -5.486
  794   2HG2  VAL 105          2HG2      VAL 105  -6.230   9.879  -6.939
  795   3HG2  VAL 105          3HG2      VAL 105  -6.682   9.205  -5.373
  796    H    ASN 106           H        ASN 106  -9.487  12.395  -7.908
  797    HA   ASN 106           HA       ASN 106 -12.246  12.114  -7.284
  798   1HB   ASN 106          2HB       ASN 106 -10.532  14.128  -8.569
  799   2HB   ASN 106          1HB       ASN 106 -12.190  14.131  -9.172
  800   1HD2  ASN 106          1HD2      ASN 106 -10.575  13.783  -5.951
  801   2HD2  ASN 106          2HD2      ASN 106 -11.646  14.825  -5.144
  802    H    LEU 107           H        LEU 107 -10.589  12.005 -10.448
  803    HA   LEU 107           HA       LEU 107 -12.930  11.518 -12.005
  804   1HB   LEU 107          2HB       LEU 107 -10.964  12.138 -13.191
  805   2HB   LEU 107          1HB       LEU 107 -10.008  10.867 -12.426
  806    HG   LEU 107           HG       LEU 107 -12.388   9.917 -13.899
  807   1HD1  LEU 107          1HD1      LEU 107 -11.879  11.470 -15.573
  808   2HD1  LEU 107          2HD1      LEU 107 -10.906  10.081 -16.055
  809   3HD1  LEU 107          3HD1      LEU 107 -10.152  11.437 -15.215
  810   1HD2  LEU 107          1HD2      LEU 107 -10.834   8.326 -12.974
  811   2HD2  LEU 107          2HD2      LEU 107  -9.461   9.158 -13.703
  812   3HD2  LEU 107          3HD2      LEU 107 -10.614   8.298 -14.724
  813    H    ALA 108           H        ALA 108 -10.602   9.254 -10.517
  814    HA   ALA 108           HA       ALA 108 -11.584   6.824 -11.446
  815   1HB   ALA 108          1HB       ALA 108  -9.667   6.891  -9.966
  816   2HB   ALA 108          2HB       ALA 108 -10.902   5.880  -9.213
  817   3HB   ALA 108          3HB       ALA 108 -10.650   7.533  -8.650
  818    H    GLU 109           H        GLU 109 -12.722   8.452  -8.457
  819    HA   GLU 109           HA       GLU 109 -14.965   6.683  -8.120
  820   1HB   GLU 109          2HB       GLU 109 -14.034   9.241  -6.923
  821   2HB   GLU 109          1HB       GLU 109 -15.757   8.892  -6.779
  822   1HG   GLU 109          2HG       GLU 109 -14.264   8.010  -4.892
  823   2HG   GLU 109          1HG       GLU 109 -15.352   6.839  -5.640
  824    H    LYS 110           H        LYS 110 -14.411   9.423 -10.153
  825    HA   LYS 110           HA       LYS 110 -17.153  10.244 -10.491
  826   1HB   LYS 110          2HB       LYS 110 -14.980  11.491 -11.167
  827   2HB   LYS 110          1HB       LYS 110 -15.036  10.498 -12.624
  828   1HG   LYS 110          2HG       LYS 110 -17.571  11.318 -12.652
  829   2HG   LYS 110          1HG       LYS 110 -16.895  12.663 -11.733
  830   1HD   LYS 110          2HD       LYS 110 -15.311  13.157 -13.490
  831   2HD   LYS 110          1HD       LYS 110 -15.764  11.698 -14.373
  832   1HE   LYS 110          2HE       LYS 110 -16.834  14.180 -14.836
  833   2HE   LYS 110          1HE       LYS 110 -17.628  12.660 -15.249
  834   1HZ   LYS 110          1HZ       LYS 110 -19.245  13.515 -13.961
  835   2HZ   LYS 110          2HZ       LYS 110 -18.192  14.526 -13.093
  836   3HZ   LYS 110          3HZ       LYS 110 -18.309  12.878 -12.697
  837    H    PHE 111           H        PHE 111 -15.157   7.741 -11.944
  838    HA   PHE 111           HA       PHE 111 -17.373   7.077 -13.821
  839   1HB   PHE 111          2HB       PHE 111 -14.432   6.549 -13.769
  840   2HB   PHE 111          1HB       PHE 111 -15.468   5.361 -14.561
  841    HD1  PHE 111           HD1      PHE 111 -13.658   8.338 -15.040
  842    HD2  PHE 111           HD2      PHE 111 -17.345   6.430 -16.139
  843    HE1  PHE 111           HE1      PHE 111 -13.829   9.813 -17.027
  844    HE2  PHE 111           HE2      PHE 111 -17.517   7.905 -18.125
  845    HZ   PHE 111           HZ       PHE 111 -15.759   9.597 -18.569
  846    H    ASP 112           H        ASP 112 -14.990   4.993 -12.173
  847    HA   ASP 112           HA       ASP 112 -16.522   3.763 -10.240
  848   1HB   ASP 112          2HB       ASP 112 -17.480   3.092 -12.943
  849   2HB   ASP 112          1HB       ASP 112 -17.166   1.685 -11.928
  850    H    ILE 113           H        ILE 113 -13.814   4.138 -10.735
  851    HA   ILE 113           HA       ILE 113 -12.852   1.314 -10.935
  852    HB   ILE 113           HB       ILE 113 -10.696   2.321 -11.826
  853   1HG1  ILE 113          2HG1      ILE 113 -12.484   4.727 -12.290
  854   2HG1  ILE 113          1HG1      ILE 113 -11.248   4.646 -11.035
  855   1HG2  ILE 113          1HG2      ILE 113 -12.993   1.523 -13.126
  856   2HG2  ILE 113          2HG2      ILE 113 -11.454   1.864 -13.917
  857   3HG2  ILE 113          3HG2      ILE 113 -12.697   3.112 -13.833
  858   1HD1  ILE 113          1HD1      ILE 113  -9.489   4.523 -12.614
  859   2HD1  ILE 113          2HD1      ILE 113 -10.583   5.736 -13.280
  860   3HD1  ILE 113          3HD1      ILE 113 -10.586   4.095 -13.927
  861    H    ILE 114           H        ILE 114 -11.092   0.792  -9.510
  862    HA   ILE 114           HA       ILE 114 -10.971   2.583  -7.142
  863    HB   ILE 114           HB       ILE 114 -11.504   0.374  -6.488
  864   1HG1  ILE 114          2HG1      ILE 114  -9.584  -0.350  -5.198
  865   2HG1  ILE 114          1HG1      ILE 114  -8.481   0.505  -6.277
  866   1HG2  ILE 114          1HG2      ILE 114  -9.673  -1.427  -7.366
  867   2HG2  ILE 114          2HG2      ILE 114  -9.696  -0.319  -8.736
  868   3HG2  ILE 114          3HG2      ILE 114 -11.187  -1.099  -8.209
  869   1HD1  ILE 114          1HD1      ILE 114  -9.337   1.581  -3.970
  870   2HD1  ILE 114          2HD1      ILE 114 -10.654   2.109  -5.018
  871   3HD1  ILE 114          3HD1      ILE 114  -8.992   2.565  -5.393
  872    H    TYR 115           H        TYR 115  -9.328   4.046  -7.278
  873    HA   TYR 115           HA       TYR 115  -6.837   3.338  -8.703
  874   1HB   TYR 115          2HB       TYR 115  -7.486   5.548  -9.185
  875   2HB   TYR 115          1HB       TYR 115  -7.967   5.868  -7.519
  876    HD1  TYR 115           HD1      TYR 115  -5.031   5.270  -9.728
  877    HD2  TYR 115           HD2      TYR 115  -6.412   6.691  -5.917
  878    HE1  TYR 115           HE1      TYR 115  -2.771   6.172  -9.246
  879    HE2  TYR 115           HE2      TYR 115  -4.153   7.594  -5.434
  880    HH   TYR 115           HH       TYR 115  -1.599   6.811  -6.484
  881    H    ASP 116           H        ASP 116  -5.054   2.611  -7.642
  882    HA   ASP 116           HA       ASP 116  -4.213   3.514  -5.069
  883   1HB   ASP 116          2HB       ASP 116  -5.899   2.354  -3.955
  884   2HB   ASP 116          1HB       ASP 116  -5.935   1.057  -5.150
  885    H    GLY 117           H        GLY 117  -2.329   3.533  -6.533
  886   1HA   GLY 117          2HA       GLY 117  -0.413   1.600  -6.057
  887   2HA   GLY 117          1HA       GLY 117  -1.245   1.004  -7.494
  888    H    TRP 118           H        TRP 118   0.619   3.729  -6.211
  889    HA   TRP 118           HA       TRP 118   1.255   4.468  -9.039
  890   1HB   TRP 118          2HB       TRP 118   1.111   6.719  -8.542
  891   2HB   TRP 118          1HB       TRP 118  -0.076   6.106  -7.392
  892    HD1  TRP 118           HD1      TRP 118   0.610   6.009  -4.832
  893    HE1  TRP 118           HE1      TRP 118   2.479   7.184  -3.498
  894    HE3  TRP 118           HE3      TRP 118   3.564   7.610  -8.677
  895    HZ2  TRP 118           HZ2      TRP 118   4.906   8.614  -3.998
  896    HZ3  TRP 118           HZ3      TRP 118   5.646   8.875  -8.221
  897    HH2  TRP 118           HH2      TRP 118   6.319   9.380  -5.887
  898    H    GLY 119           H        GLY 119   3.411   4.429  -9.552
  899   1HA   GLY 119          2HA       GLY 119   5.387   4.496  -7.326
  900   2HA   GLY 119          1HA       GLY 119   5.439   3.154  -8.470
  901    H    THR 120           H        THR 120   7.640   4.835  -8.200
  902    HA   THR 120           HA       THR 120   7.651   6.150 -10.876
  903    HB   THR 120           HB       THR 120   7.473   8.055  -9.508
  904    HG1  THR 120           HG1      THR 120   9.356   8.980  -9.885
  905   1HG2  THR 120          1HG2      THR 120   9.326   7.903  -7.452
  906   2HG2  THR 120          2HG2      THR 120   8.673   6.266  -7.529
  907   3HG2  THR 120          3HG2      THR 120   7.590   7.638  -7.291
  908    H    TYR 121           H        TYR 121   9.735   6.121 -11.895
  909    HA   TYR 121           HA       TYR 121  11.661   4.234 -10.598
  910   1HB   TYR 121          2HB       TYR 121  10.412   4.084 -13.108
  911   2HB   TYR 121          1HB       TYR 121  12.059   4.608 -13.455
  912    HD1  TYR 121           HD1      TYR 121  13.880   3.347 -11.857
  913    HD2  TYR 121           HD2      TYR 121  10.069   1.786 -13.077
  914    HE1  TYR 121           HE1      TYR 121  14.700   1.039 -11.465
  915    HE2  TYR 121           HE2      TYR 121  10.888  -0.522 -12.685
  916    HH   TYR 121           HH       TYR 121  12.649  -1.634 -11.299
  917    H    TYR 122           H        TYR 122  13.735   4.959 -10.279
  918    HA   TYR 122           HA       TYR 122  14.307   7.775 -10.698
  919   1HB   TYR 122          2HB       TYR 122  15.317   6.834  -8.775
  920   2HB   TYR 122          1HB       TYR 122  15.907   5.432  -9.667
  921    HD1  TYR 122           HD1      TYR 122  16.164   9.179  -9.777
  922    HD2  TYR 122           HD2      TYR 122  18.154   5.405 -10.266
  923    HE1  TYR 122           HE1      TYR 122  18.296  10.362 -10.229
  924    HE2  TYR 122           HE2      TYR 122  20.286   6.588 -10.717
  925    HH   TYR 122           HH       TYR 122  21.337   8.626 -10.507
  926    H    GLU 123           H        GLU 123  14.633   8.438 -12.780
  927    HA   GLU 123           HA       GLU 123  15.439   6.946 -14.988
  928   1HB   GLU 123          2HB       GLU 123  14.682   9.310 -15.091
  929   2HB   GLU 123          1HB       GLU 123  16.223   9.818 -14.404
  930   1HG   GLU 123          2HG       GLU 123  16.397   8.041 -16.773
  931   2HG   GLU 123          1HG       GLU 123  15.760   9.656 -17.077
  932    H    GLY 124           H        GLY 124  17.106   5.468 -14.631
  933   1HA   GLY 124          2HA       GLY 124  19.818   6.565 -14.652
  934   2HA   GLY 124          1HA       GLY 124  19.434   5.657 -13.190
  935    H    LEU 125           H        LEU 125  18.289   3.447 -13.750
  936    HA   LEU 125           HA       LEU 125  18.750   1.287 -14.573
  937   1HB   LEU 125          2HB       LEU 125  18.994   2.400 -17.329
  938   2HB   LEU 125          1HB       LEU 125  18.017   1.053 -16.743
  939    HG   LEU 125           HG       LEU 125  17.454   4.002 -16.317
  940   1HD1  LEU 125          1HD1      LEU 125  16.887   2.370 -18.488
  941   2HD1  LEU 125          2HD1      LEU 125  16.031   3.855 -18.071
  942   3HD1  LEU 125          3HD1      LEU 125  15.407   2.296 -17.532
  943   1HD2  LEU 125          1HD2      LEU 125  15.243   2.882 -15.416
  944   2HD2  LEU 125          2HD2      LEU 125  16.642   3.032 -14.354
  945   3HD2  LEU 125          3HD2      LEU 125  16.294   1.493 -15.140
  946    H    GLU 126           H        GLU 126  20.792   0.635 -13.950
  947    HA   GLU 126           HA       GLU 126  23.137   1.699 -15.435
  948   1HB   GLU 126          2HB       GLU 126  23.704  -0.291 -13.376
  949   2HB   GLU 126          1HB       GLU 126  24.294   1.365 -13.523
  950   1HG   GLU 126          2HG       GLU 126  22.187   2.214 -12.576
  951   2HG   GLU 126          1HG       GLU 126  21.574   0.565 -12.447
  952    H    HIS 127           H        HIS 127  24.741  -0.688 -14.943
  953    HA   HIS 127           HA       HIS 127  23.756  -2.295 -17.225
  954   1HB   HIS 127          2HB       HIS 127  26.372  -2.441 -15.694
  955   2HB   HIS 127          1HB       HIS 127  25.998  -3.310 -17.183
  956    HD2  HIS 127           HD2      HIS 127  25.903  -1.667 -19.532
  957    HE1  HIS 127           HE1      HIS 127  27.433   1.794 -17.655
  958    HE2  HIS 127           HE2      HIS 127  26.848   0.738 -19.886
  959    H    HIS 128           H        HIS 128  22.082  -3.530 -16.285
  960    HA   HIS 128           HA       HIS 128  22.924  -5.916 -14.876
  961   1HB   HIS 128          2HB       HIS 128  22.653  -3.898 -13.141
  962   2HB   HIS 128          1HB       HIS 128  20.953  -4.349 -13.267
  963    HD2  HIS 128           HD2      HIS 128  24.141  -6.743 -12.991
  964    HE1  HIS 128           HE1      HIS 128  21.313  -7.824 -10.047
  965    HE2  HIS 128           HE2      HIS 128  23.567  -8.398 -11.059
  966    H    HIS 129           H        HIS 129  21.038  -7.390 -14.541
  967    HA   HIS 129           HA       HIS 129  18.384  -6.768 -15.309
  968   1HB   HIS 129          2HB       HIS 129  20.256  -7.161 -17.539
  969   2HB   HIS 129          1HB       HIS 129  18.847  -8.218 -17.614
  970    HD2  HIS 129           HD2      HIS 129  19.641  -4.860 -18.927
  971    HE1  HIS 129           HE1      HIS 129  15.588  -4.519 -17.789
  972    HE2  HIS 129           HE2      HIS 129  17.461  -3.441 -19.118
  973    H    HIS 130           H        HIS 130  20.976  -9.141 -15.187
  974    HA   HIS 130           HA       HIS 130  19.134 -11.054 -13.929
  975   1HB   HIS 130          2HB       HIS 130  19.867 -12.877 -15.558
  976   2HB   HIS 130          1HB       HIS 130  18.727 -11.694 -16.198
  977    HD2  HIS 130           HD2      HIS 130  22.223 -13.052 -17.020
  978    HE1  HIS 130           HE1      HIS 130  21.789  -9.486 -19.241
  979    HE2  HIS 130           HE2      HIS 130  23.208 -11.564 -18.922
  980    H    HIS 131           H        HIS 131  20.386 -11.348 -12.121
  981    HA   HIS 131           HA       HIS 131  22.327 -11.718 -10.823
  982   1HB   HIS 131          2HB       HIS 131  22.470 -13.715 -13.083
  983   2HB   HIS 131          1HB       HIS 131  23.684 -13.693 -11.806
  984    HD2  HIS 131           HD2      HIS 131  21.256 -12.979  -9.418
  985    HE1  HIS 131           HE1      HIS 131  20.023 -16.885 -10.440
  986    HE2  HIS 131           HE2      HIS 131  19.835 -15.044  -8.705
  987    H    HIS 132           HN       HIS 132  24.300 -12.782 -13.407
  988    HA   HIS 132           HA       HIS 132  26.200 -10.649 -12.981
  989   1HB   HIS 132          2HB       HIS 132  25.980 -12.953 -14.901
  990   2HB   HIS 132          1HB       HIS 132  27.203 -11.709 -15.161
  991    HD2  HIS 132           HD2      HIS 132  29.458 -13.050 -14.203
  992    HE1  HIS 132           HE1      HIS 132  27.902 -14.084 -10.415
  993    HE2  HIS 132           HE2      HIS 132  29.981 -14.089 -11.867
  Start of MODEL   17
    1   1H    MET   1          1H        MET   1 -24.997  -0.100  -2.108
    2   2H    MET   1          2H        MET   1 -24.636   0.438  -0.537
    3   3H    MET   1          3H        MET   1 -25.814   1.238  -1.463
    4    HA   MET   1           HA       MET   1 -26.488  -1.490  -1.283
    5   1HB   MET   1          2HB       MET   1 -25.237  -0.370   1.078
    6   2HB   MET   1          1HB       MET   1 -26.933  -0.735   1.398
    7   1HG   MET   1          2HG       MET   1 -25.576  -2.708   1.880
    8   2HG   MET   1          1HG       MET   1 -26.584  -3.021   0.466
    9   1HE   MET   1          1HE       MET   1 -24.661  -5.143  -0.368
   10   2HE   MET   1          2HE       MET   1 -24.485  -4.683   1.324
   11   3HE   MET   1          3HE       MET   1 -23.057  -4.810   0.299
   12    H    SER   2           H        SER   2 -27.294   1.318   0.777
   13    HA   SER   2           HA       SER   2 -29.727   1.796  -0.837
   14   1HB   SER   2          2HB       SER   2 -30.222   1.613   2.082
   15   2HB   SER   2          1HB       SER   2 -31.260   1.157   0.734
   16    HG   SER   2           HG       SER   2 -30.243  -0.755   0.583
   17    H    HIS   3           H        HIS   3 -30.566   3.915  -0.525
   18    HA   HIS   3           HA       HIS   3 -28.920   6.045  -0.106
   19   1HB   HIS   3          2HB       HIS   3 -31.833   5.685   0.531
   20   2HB   HIS   3          1HB       HIS   3 -31.037   7.203   0.948
   21    HD2  HIS   3           HD2      HIS   3 -31.154   5.015  -2.401
   22    HE1  HIS   3           HE1      HIS   3 -31.311   9.118  -3.389
   23    HE2  HIS   3           HE2      HIS   3 -31.322   6.763  -4.330
   24    H    GLN   4           H        GLN   4 -27.507   6.437   1.523
   25    HA   GLN   4           HA       GLN   4 -28.455   5.984   4.325
   26   1HB   GLN   4          2HB       GLN   4 -26.694   4.335   3.451
   27   2HB   GLN   4          1HB       GLN   4 -25.580   5.701   3.436
   28   1HG   GLN   4          2HG       GLN   4 -25.182   5.256   5.612
   29   2HG   GLN   4          1HG       GLN   4 -26.809   5.856   5.937
   30   1HE2  GLN   4          1HE2      GLN   4 -24.859   2.932   5.588
   31   2HE2  GLN   4          2HE2      GLN   4 -26.057   1.852   6.117
   32    H    ASP   5           H        ASP   5 -25.385   7.093   4.506
   33    HA   ASP   5           HA       ASP   5 -26.319   9.926   4.670
   34   1HB   ASP   5          2HB       ASP   5 -23.933   8.651   6.040
   35   2HB   ASP   5          1HB       ASP   5 -24.575  10.269   6.328
   36    H    ASP   6           H        ASP   6 -23.146  10.220   4.995
   37    HA   ASP   6           HA       ASP   6 -22.272   9.859   2.225
   38   1HB   ASP   6          2HB       ASP   6 -23.611  11.922   2.033
   39   2HB   ASP   6          1HB       ASP   6 -22.673  12.656   3.334
   40    H    TYR   7           H        TYR   7 -20.289   9.017   2.701
   41    HA   TYR   7           HA       TYR   7 -18.708  10.262   4.898
   42   1HB   TYR   7          2HB       TYR   7 -19.128   7.713   4.732
   43   2HB   TYR   7          1HB       TYR   7 -17.970   7.745   3.401
   44    HD1  TYR   7           HD1      TYR   7 -15.788   7.204   3.989
   45    HD2  TYR   7           HD2      TYR   7 -18.257   9.291   6.818
   46    HE1  TYR   7           HE1      TYR   7 -13.916   7.216   5.614
   47    HE2  TYR   7           HE2      TYR   7 -16.385   9.303   8.443
   48    HH   TYR   7           HH       TYR   7 -13.586   9.140   8.022
   49    H    LEU   8           H        LEU   8 -16.160   9.920   4.224
   50    HA   LEU   8           HA       LEU   8 -15.896  11.365   1.619
   51   1HB   LEU   8          2HB       LEU   8 -13.858  11.374   3.852
   52   2HB   LEU   8          1HB       LEU   8 -14.007  12.506   2.507
   53    HG   LEU   8           HG       LEU   8 -16.487  12.462   3.967
   54   1HD1  LEU   8          1HD1      LEU   8 -15.617  13.405   6.114
   55   2HD1  LEU   8          2HD1      LEU   8 -13.987  12.955   5.613
   56   3HD1  LEU   8          3HD1      LEU   8 -15.200  11.705   5.895
   57   1HD2  LEU   8          1HD2      LEU   8 -15.829  14.344   2.624
   58   2HD2  LEU   8          2HD2      LEU   8 -14.303  14.507   3.492
   59   3HD2  LEU   8          3HD2      LEU   8 -15.822  14.896   4.300
   60    H    SER   9           H        SER   9 -13.525   9.632   3.641
   61    HA   SER   9           HA       SER   9 -12.293   7.674   3.141
   62   1HB   SER   9          2HB       SER   9 -13.387   7.417   0.393
   63   2HB   SER   9          1HB       SER   9 -13.127   6.180   1.620
   64    HG   SER   9           HG       SER   9 -15.090   6.488   2.319
   65    H    VAL  10           H        VAL  10 -12.833   9.521   0.111
   66    HA   VAL  10           HA       VAL  10 -10.252   9.216  -0.953
   67    HB   VAL  10           HB       VAL  10 -10.706  11.478  -2.057
   68   1HG1  VAL  10          1HG1      VAL  10 -11.338   9.382  -3.134
   69   2HG1  VAL  10          2HG1      VAL  10 -12.627  10.563  -3.368
   70   3HG1  VAL  10          3HG1      VAL  10 -12.805   9.292  -2.159
   71   1HG2  VAL  10          1HG2      VAL  10 -12.934  12.429  -1.726
   72   2HG2  VAL  10          2HG2      VAL  10 -12.103  12.350  -0.172
   73   3HG2  VAL  10          3HG2      VAL  10 -13.335  11.155  -0.575
   74    H    GLU  11           H        GLU  11 -11.336  11.243   1.682
   75    HA   GLU  11           HA       GLU  11  -9.044  13.002   1.718
   76   1HB   GLU  11          2HB       GLU  11 -11.336  13.285   2.904
   77   2HB   GLU  11          1HB       GLU  11 -10.650  12.251   4.159
   78   1HG   GLU  11          2HG       GLU  11  -9.712  14.109   5.029
   79   2HG   GLU  11          1HG       GLU  11  -8.639  14.120   3.628
   80    H    GLU  12           H        GLU  12  -9.899  10.400   4.035
   81    HA   GLU  12           HA       GLU  12  -7.484  10.167   5.366
   82   1HB   GLU  12          2HB       GLU  12  -8.553   7.541   4.577
   83   2HB   GLU  12          1HB       GLU  12  -8.347   8.233   6.186
   84   1HG   GLU  12          2HG       GLU  12 -10.592   8.870   4.247
   85   2HG   GLU  12          1HG       GLU  12 -10.732   7.905   5.717
   86    H    LEU  13           H        LEU  13  -8.308   8.289   2.422
   87    HA   LEU  13           HA       LEU  13  -5.800   7.117   1.982
   88   1HB   LEU  13          2HB       LEU  13  -7.630   8.219  -0.171
   89   2HB   LEU  13          1HB       LEU  13  -6.441   6.931  -0.361
   90    HG   LEU  13           HG       LEU  13  -8.886   6.842   1.430
   91   1HD1  LEU  13          1HD1      LEU  13  -9.125   6.621  -1.139
   92   2HD1  LEU  13          2HD1      LEU  13  -9.829   5.348  -0.142
   93   3HD1  LEU  13          3HD1      LEU  13  -8.282   5.083  -0.946
   94   1HD2  LEU  13          1HD2      LEU  13  -6.448   5.160   1.177
   95   2HD2  LEU  13          2HD2      LEU  13  -7.981   4.294   1.291
   96   3HD2  LEU  13          3HD2      LEU  13  -7.500   5.410   2.569
   97    H    ILE  14           H        ILE  14  -6.943  10.138   0.422
   98    HA   ILE  14           HA       ILE  14  -4.587  10.950  -0.792
   99    HB   ILE  14           HB       ILE  14  -6.702  12.573   0.632
  100   1HG1  ILE  14          2HG1      ILE  14  -6.036  12.389  -2.316
  101   2HG1  ILE  14          1HG1      ILE  14  -7.144  11.262  -1.531
  102   1HG2  ILE  14          1HG2      ILE  14  -5.515  14.379  -0.990
  103   2HG2  ILE  14          2HG2      ILE  14  -4.106  13.413  -0.553
  104   3HG2  ILE  14          3HG2      ILE  14  -5.070  14.186   0.705
  105   1HD1  ILE  14          1HD1      ILE  14  -7.972  13.801  -0.670
  106   2HD1  ILE  14          2HD1      ILE  14  -8.778  12.777  -1.859
  107   3HD1  ILE  14          3HD1      ILE  14  -7.618  13.995  -2.387
  108    H    GLU  15           H        GLU  15  -5.498  11.555   2.615
  109    HA   GLU  15           HA       GLU  15  -3.199  12.992   3.389
  110   1HB   GLU  15          2HB       GLU  15  -5.403  11.859   4.693
  111   2HB   GLU  15          1HB       GLU  15  -4.004  11.077   5.431
  112   1HG   GLU  15          2HG       GLU  15  -3.019  13.496   5.533
  113   2HG   GLU  15          1HG       GLU  15  -4.696  14.004   5.337
  114    H    ILE  16           H        ILE  16  -3.721   9.451   3.503
  115    HA   ILE  16           HA       ILE  16  -1.079   8.814   4.381
  116    HB   ILE  16           HB       ILE  16  -3.028   7.183   2.722
  117   1HG1  ILE  16          2HG1      ILE  16  -2.403   6.962   5.674
  118   2HG1  ILE  16          1HG1      ILE  16  -3.690   8.004   5.068
  119   1HG2  ILE  16          1HG2      ILE  16  -1.406   5.478   4.220
  120   2HG2  ILE  16          2HG2      ILE  16  -0.285   6.688   3.597
  121   3HG2  ILE  16          3HG2      ILE  16  -1.288   5.759   2.482
  122   1HD1  ILE  16          1HD1      ILE  16  -4.858   6.026   5.463
  123   2HD1  ILE  16          2HD1      ILE  16  -3.491   5.010   5.003
  124   3HD1  ILE  16          3HD1      ILE  16  -4.431   5.839   3.762
  125    H    GLN  17           H        GLN  17  -2.358   9.716   1.274
  126    HA   GLN  17           HA       GLN  17  -0.150   8.660  -0.291
  127   1HB   GLN  17          2HB       GLN  17  -2.125  10.870  -0.948
  128   2HB   GLN  17          1HB       GLN  17  -1.065  10.061  -2.102
  129   1HG   GLN  17          2HG       GLN  17  -2.908   8.421  -0.390
  130   2HG   GLN  17          1HG       GLN  17  -3.544   9.232  -1.822
  131   1HE2  GLN  17          1HE2      GLN  17  -2.964   8.389  -3.893
  132   2HE2  GLN  17          2HE2      GLN  17  -2.007   7.000  -4.091
  133    H    LYS  18           H        LYS  18  -0.929  11.809   1.166
  134    HA   LYS  18           HA       LYS  18   1.313  13.223   0.079
  135   1HB   LYS  18          2HB       LYS  18  -0.400  13.624   2.536
  136   2HB   LYS  18          1HB       LYS  18   0.957  14.693   2.175
  137   1HG   LYS  18          2HG       LYS  18  -0.243  15.787   0.617
  138   2HG   LYS  18          1HG       LYS  18  -0.641  14.276  -0.201
  139   1HD   LYS  18          2HD       LYS  18  -2.576  13.936   1.118
  140   2HD   LYS  18          1HD       LYS  18  -2.060  15.114   2.327
  141   1HE   LYS  18          2HE       LYS  18  -2.244  16.895   0.546
  142   2HE   LYS  18          1HE       LYS  18  -2.975  15.682  -0.505
  143   1HZ   LYS  18          1HZ       LYS  18  -4.900  16.140   0.458
  144   2HZ   LYS  18          2HZ       LYS  18  -4.161  17.174   1.585
  145   3HZ   LYS  18          3HZ       LYS  18  -4.298  15.513   1.914
  146    H    GLU  19           H        GLU  19   0.922  11.141   2.900
  147    HA   GLU  19           HA       GLU  19   3.517  11.765   4.040
  148   1HB   GLU  19          2HB       GLU  19   1.537   9.518   4.449
  149   2HB   GLU  19          1HB       GLU  19   3.091   9.551   5.281
  150   1HG   GLU  19          2HG       GLU  19   2.559  11.522   6.458
  151   2HG   GLU  19          1HG       GLU  19   1.256  11.940   5.344
  152    H    GLU  20           H        GLU  20   2.401   8.649   2.667
  153    HA   GLU  20           HA       GLU  20   4.806   7.389   2.275
  154   1HB   GLU  20          2HB       GLU  20   2.460   6.620   1.543
  155   2HB   GLU  20          1HB       GLU  20   2.775   7.483   0.038
  156   1HG   GLU  20          2HG       GLU  20   4.088   5.819  -0.721
  157   2HG   GLU  20          1HG       GLU  20   5.047   5.831   0.760
  158    H    THR  21           H        THR  21   3.360   9.353  -0.356
  159    HA   THR  21           HA       THR  21   5.543   9.523  -2.050
  160    HB   THR  21           HB       THR  21   3.972  12.016  -1.425
  161    HG1  THR  21           HG1      THR  21   3.049   9.777  -2.897
  162   1HG2  THR  21          1HG2      THR  21   5.608  12.193  -3.196
  163   2HG2  THR  21          2HG2      THR  21   4.008  12.142  -3.936
  164   3HG2  THR  21          3HG2      THR  21   5.028  10.703  -3.941
  165    H    ARG  22           H        ARG  22   4.852  12.146   0.288
  166    HA   ARG  22           HA       ARG  22   7.199  13.543   0.233
  167   1HB   ARG  22          2HB       ARG  22   5.778  14.396   1.838
  168   2HB   ARG  22          1HB       ARG  22   5.353  12.804   2.459
  169   1HG   ARG  22          2HG       ARG  22   7.489  12.620   3.605
  170   2HG   ARG  22          1HG       ARG  22   8.062  14.104   2.853
  171   1HD   ARG  22          2HD       ARG  22   7.091  15.361   4.438
  172   2HD   ARG  22          1HD       ARG  22   5.533  14.585   4.174
  173    HE   ARG  22           HE       ARG  22   7.166  14.181   6.438
  174   1HH1  ARG  22          1HH2      ARG  22   5.654  12.268   3.993
  175   2HH1  ARG  22          2HH2      ARG  22   5.633  10.830   4.955
  176   1HH2  ARG  22          2HH1      ARG  22   7.141  12.321   7.694
  177   2HH2  ARG  22          1HH1      ARG  22   6.472  10.860   7.048
  178    H    ASP  23           H        ASP  23   6.727  10.446   1.933
  179    HA   ASP  23           HA       ASP  23   9.353  10.274   3.042
  180   1HB   ASP  23          2HB       ASP  23   7.044   8.676   3.005
  181   2HB   ASP  23          1HB       ASP  23   8.295   7.681   2.260
  182    H    ILE  24           H        ILE  24   8.027   9.011  -0.027
  183    HA   ILE  24           HA       ILE  24  10.509   7.863  -0.916
  184    HB   ILE  24           HB       ILE  24   8.141   8.861  -2.532
  185   1HG1  ILE  24          2HG1      ILE  24   8.844   6.086  -1.517
  186   2HG1  ILE  24          1HG1      ILE  24   7.591   7.125  -0.839
  187   1HG2  ILE  24          1HG2      ILE  24  10.682   7.474  -3.221
  188   2HG2  ILE  24          2HG2      ILE  24   9.680   8.541  -4.204
  189   3HG2  ILE  24          3HG2      ILE  24   9.219   6.854  -3.985
  190   1HD1  ILE  24          1HD1      ILE  24   6.173   6.205  -2.333
  191   2HD1  ILE  24          2HD1      ILE  24   7.496   5.432  -3.208
  192   3HD1  ILE  24          3HD1      ILE  24   7.047   7.097  -3.578
  193    H    ILE  25           H        ILE  25   8.865  10.858  -2.017
  194    HA   ILE  25           HA       ILE  25  10.784  11.957  -3.644
  195    HB   ILE  25           HB       ILE  25   9.493  13.582  -1.442
  196   1HG1  ILE  25          2HG1      ILE  25   7.688  12.304  -2.309
  197   2HG1  ILE  25          1HG1      ILE  25   7.626  13.823  -3.203
  198   1HG2  ILE  25          1HG2      ILE  25   9.522  14.656  -4.146
  199   2HG2  ILE  25          2HG2      ILE  25  11.149  14.254  -3.596
  200   3HG2  ILE  25          3HG2      ILE  25  10.150  15.364  -2.658
  201   1HD1  ILE  25          1HD1      ILE  25   8.684  11.152  -4.134
  202   2HD1  ILE  25          2HD1      ILE  25   9.102  12.654  -4.956
  203   3HD1  ILE  25          3HD1      ILE  25   7.418  12.139  -4.865
  204    H    GLN  26           H        GLN  26  10.817  12.115  -0.076
  205    HA   GLN  26           HA       GLN  26  13.236  13.564   0.206
  206   1HB   GLN  26          2HB       GLN  26  11.887  11.493   1.943
  207   2HB   GLN  26          1HB       GLN  26  13.388  12.281   2.431
  208   1HG   GLN  26          2HG       GLN  26  11.470  14.232   1.462
  209   2HG   GLN  26          1HG       GLN  26  10.783  13.275   2.775
  210   1HE2  GLN  26          1HE2      GLN  26  11.991  16.159   2.601
  211   2HE2  GLN  26          2HE2      GLN  26  13.053  16.209   3.923
  212    H    ALA  27           H        ALA  27  12.703  10.039  -0.002
  213    HA   ALA  27           HA       ALA  27  15.438   9.285   0.279
  214   1HB   ALA  27          1HB       ALA  27  13.002   7.967  -0.144
  215   2HB   ALA  27          2HB       ALA  27  14.581   7.210   0.066
  216   3HB   ALA  27          3HB       ALA  27  13.979   7.561  -1.555
  217    H    LEU  28           H        LEU  28  13.509  10.034  -2.629
  218    HA   LEU  28           HA       LEU  28  15.613   9.477  -4.500
  219   1HB   LEU  28          2HB       LEU  28  13.250  11.365  -4.744
  220   2HB   LEU  28          1HB       LEU  28  14.258  10.815  -6.085
  221    HG   LEU  28           HG       LEU  28  12.525   9.089  -4.292
  222   1HD1  LEU  28          1HD1      LEU  28  12.346   9.136  -7.270
  223   2HD1  LEU  28          2HD1      LEU  28  11.707  10.531  -6.401
  224   3HD1  LEU  28          3HD1      LEU  28  11.071   8.919  -6.073
  225   1HD2  LEU  28          1HD2      LEU  28  14.722   8.452  -6.233
  226   2HD2  LEU  28          2HD2      LEU  28  13.334   7.368  -6.143
  227   3HD2  LEU  28          3HD2      LEU  28  14.315   7.664  -4.709
  228    H    LEU  29           H        LEU  29  14.352  12.694  -3.518
  229    HA   LEU  29           HA       LEU  29  16.423  14.239  -4.593
  230   1HB   LEU  29          2HB       LEU  29  14.351  14.603  -2.587
  231   2HB   LEU  29          1HB       LEU  29  15.823  15.470  -2.141
  232    HG   LEU  29           HG       LEU  29  15.871  16.410  -4.490
  233   1HD1  LEU  29          1HD1      LEU  29  13.580  14.608  -4.682
  234   2HD1  LEU  29          2HD1      LEU  29  14.504  15.384  -5.968
  235   3HD1  LEU  29          3HD1      LEU  29  13.178  16.247  -5.191
  236   1HD2  LEU  29          1HD2      LEU  29  14.156  18.098  -4.028
  237   2HD2  LEU  29          2HD2      LEU  29  14.983  17.673  -2.530
  238   3HD2  LEU  29          3HD2      LEU  29  13.379  17.022  -2.865
  239    H    GLU  30           H        GLU  30  16.263  13.230  -1.149
  240    HA   GLU  30           HA       GLU  30  18.780  13.978  -0.305
  241   1HB   GLU  30          2HB       GLU  30  17.052  12.738   1.061
  242   2HB   GLU  30          1HB       GLU  30  17.605  11.249   0.294
  243   1HG   GLU  30          2HG       GLU  30  19.695  13.009   1.483
  244   2HG   GLU  30          1HG       GLU  30  18.652  12.135   2.605
  245    H    ASP  31           H        ASP  31  18.033  10.910  -1.992
  246    HA   ASP  31           HA       ASP  31  20.640   9.871  -2.130
  247   1HB   ASP  31          2HB       ASP  31  18.432   8.824  -2.952
  248   2HB   ASP  31          1HB       ASP  31  18.710   9.715  -4.449
  249    H    GLY  32           H        GLY  32  19.056  12.200  -4.316
  250   1HA   GLY  32          2HA       GLY  32  20.801  14.012  -4.989
  251   2HA   GLY  32          1HA       GLY  32  21.698  12.636  -5.630
  252    H    SER  33           H        SER  33  18.408  12.054  -5.962
  253    HA   SER  33           HA       SER  33  18.264  11.809  -8.682
  254   1HB   SER  33          2HB       SER  33  15.890  12.165  -8.548
  255   2HB   SER  33          1HB       SER  33  16.382  11.440  -7.019
  256    HG   SER  33           HG       SER  33  16.220  14.240  -7.429
  257    H    ASP  34           H        ASP  34  17.552  13.244 -10.432
  258    HA   ASP  34           HA       ASP  34  18.215  16.116  -9.904
  259   1HB   ASP  34          2HB       ASP  34  19.149  14.226 -11.993
  260   2HB   ASP  34          1HB       ASP  34  18.733  15.845 -12.555
  261    HA   PRO  35           HA       PRO  35  13.826  15.994 -11.276
  262   1HB   PRO  35          2HB       PRO  35  13.876  18.704 -10.097
  263   2HB   PRO  35          1HB       PRO  35  12.796  17.343  -9.748
  264   1HG   PRO  35          2HG       PRO  35  14.699  18.153  -8.035
  265   2HG   PRO  35          1HG       PRO  35  14.194  16.460  -8.175
  266   1HD   PRO  35          2HD       PRO  35  16.673  17.780  -9.212
  267   2HD   PRO  35          1HD       PRO  35  16.445  16.127  -8.595
  268    H    ASP  36           H        ASP  36  16.516  17.578 -12.365
  269    HA   ASP  36           HA       ASP  36  15.139  19.616 -13.986
  270   1HB   ASP  36          2HB       ASP  36  17.294  20.304 -13.311
  271   2HB   ASP  36          1HB       ASP  36  18.007  18.734 -13.687
  272    H    ALA  37           H        ALA  37  16.068  16.303 -14.283
  273    HA   ALA  37           HA       ALA  37  15.905  16.404 -17.246
  274   1HB   ALA  37          1HB       ALA  37  17.605  15.001 -15.779
  275   2HB   ALA  37          2HB       ALA  37  16.939  14.322 -17.264
  276   3HB   ALA  37          3HB       ALA  37  16.263  13.859 -15.701
  277    H    LEU  38           H        LEU  38  13.565  16.795 -15.356
  278    HA   LEU  38           HA       LEU  38  11.316  16.125 -15.253
  279   1HB   LEU  38          2HB       LEU  38  12.260  15.237 -17.950
  280   2HB   LEU  38          1HB       LEU  38  10.688  14.667 -17.390
  281    HG   LEU  38           HG       LEU  38  11.305  17.569 -17.061
  282   1HD1  LEU  38          1HD1      LEU  38  10.647  16.218 -19.694
  283   2HD1  LEU  38          2HD1      LEU  38  12.038  17.241 -19.336
  284   3HD1  LEU  38          3HD1      LEU  38  10.422  17.943 -19.401
  285   1HD2  LEU  38          1HD2      LEU  38   8.769  16.374 -18.130
  286   2HD2  LEU  38          2HD2      LEU  38   8.986  17.776 -17.083
  287   3HD2  LEU  38          3HD2      LEU  38   9.160  16.150 -16.425
  288    H    TYR  39           H        TYR  39  10.091  14.368 -14.466
  289    HA   TYR  39           HA       TYR  39  11.616  11.809 -14.183
  290   1HB   TYR  39          2HB       TYR  39  10.592  13.520 -12.182
  291   2HB   TYR  39          1HB       TYR  39   9.522  12.120 -12.211
  292    HD1  TYR  39           HD1      TYR  39  10.110  10.537 -10.615
  293    HD2  TYR  39           HD2      TYR  39  13.212  12.627 -12.730
  294    HE1  TYR  39           HE1      TYR  39  11.824   9.199  -9.424
  295    HE2  TYR  39           HE2      TYR  39  14.926  11.288 -11.537
  296    HH   TYR  39           HH       TYR  39  14.418   9.659  -8.813
  297    H    GLU  40           H        GLU  40  10.091   9.892 -13.830
  298    HA   GLU  40           HA       GLU  40   7.628  10.248 -15.493
  299   1HB   GLU  40          2HB       GLU  40   9.590   8.936 -16.529
  300   2HB   GLU  40          1HB       GLU  40   9.224   7.687 -15.338
  301   1HG   GLU  40          2HG       GLU  40   7.994   7.101 -17.304
  302   2HG   GLU  40          1HG       GLU  40   6.817   7.773 -16.176
  303    H    ILE  41           H        ILE  41   5.758   9.448 -14.608
  304    HA   ILE  41           HA       ILE  41   6.014   7.744 -12.165
  305    HB   ILE  41           HB       ILE  41   4.097  10.056 -12.604
  306   1HG1  ILE  41          2HG1      ILE  41   5.402  10.664 -10.346
  307   2HG1  ILE  41          1HG1      ILE  41   6.658   9.686 -11.106
  308   1HG2  ILE  41          1HG2      ILE  41   4.445   8.263 -10.183
  309   2HG2  ILE  41          2HG2      ILE  41   3.144   8.090 -11.361
  310   3HG2  ILE  41          3HG2      ILE  41   3.258   9.552 -10.382
  311   1HD1  ILE  41          1HD1      ILE  41   6.660  11.093 -13.072
  312   2HD1  ILE  41          2HD1      ILE  41   6.797  12.142 -11.661
  313   3HD1  ILE  41          3HD1      ILE  41   5.250  11.982 -12.493
  314    H    GLU  42           H        GLU  42   4.261   6.240 -11.864
  315    HA   GLU  42           HA       GLU  42   2.425   5.978 -14.205
  316   1HB   GLU  42          2HB       GLU  42   2.743   3.421 -13.778
  317   2HB   GLU  42          1HB       GLU  42   3.985   4.289 -14.680
  318   1HG   GLU  42          2HG       GLU  42   4.327   4.310 -11.742
  319   2HG   GLU  42          1HG       GLU  42   4.510   2.731 -12.507
  320    H    HIS  43           H        HIS  43   0.383   5.025 -13.708
  321    HA   HIS  43           HA       HIS  43  -0.177   4.726 -10.782
  322   1HB   HIS  43          2HB       HIS  43  -1.998   5.935 -12.889
  323   2HB   HIS  43          1HB       HIS  43  -2.387   5.732 -11.180
  324    HD2  HIS  43           HD2      HIS  43   0.686   7.514 -13.027
  325    HE1  HIS  43           HE1      HIS  43  -0.628   9.929  -9.820
  326    HE2  HIS  43           HE2      HIS  43   1.051   9.737 -11.712
  327    H    HIS  44           H        HIS  44  -1.851   3.163 -10.276
  328    HA   HIS  44           HA       HIS  44  -2.351   1.239 -12.513
  329   1HB   HIS  44          2HB       HIS  44  -1.440   0.859  -9.720
  330   2HB   HIS  44          1HB       HIS  44  -2.664  -0.283 -10.280
  331    HD2  HIS  44           HD2      HIS  44  -1.827  -1.365 -13.027
  332    HE1  HIS  44           HE1      HIS  44   2.236  -1.235 -11.881
  333    HE2  HIS  44           HE2      HIS  44   0.593  -2.171 -13.572
  334    H    LEU  45           H        LEU  45  -4.449   1.495 -13.121
  335    HA   LEU  45           HA       LEU  45  -6.497   1.681 -10.946
  336   1HB   LEU  45          2HB       LEU  45  -6.699   2.903 -13.715
  337   2HB   LEU  45          1HB       LEU  45  -7.857   3.075 -12.399
  338    HG   LEU  45           HG       LEU  45  -5.808   4.006 -11.059
  339   1HD1  LEU  45          1HD1      LEU  45  -4.393   5.359 -12.808
  340   2HD1  LEU  45          2HD1      LEU  45  -4.892   4.089 -13.925
  341   3HD1  LEU  45          3HD1      LEU  45  -3.974   3.679 -12.477
  342   1HD2  LEU  45          1HD2      LEU  45  -6.365   6.266 -11.820
  343   2HD2  LEU  45          2HD2      LEU  45  -7.830   5.288 -11.756
  344   3HD2  LEU  45          3HD2      LEU  45  -7.057   5.618 -13.307
  345    H    PHE  46           H        PHE  46  -8.024   0.074 -11.023
  346    HA   PHE  46           HA       PHE  46  -8.155  -1.545 -13.536
  347   1HB   PHE  46          2HB       PHE  46  -9.138  -3.128 -11.436
  348   2HB   PHE  46          1HB       PHE  46  -7.582  -3.303 -12.247
  349    HD1  PHE  46           HD1      PHE  46  -9.038  -2.990  -9.118
  350    HD2  PHE  46           HD2      PHE  46  -5.817  -1.361 -11.446
  351    HE1  PHE  46           HE1      PHE  46  -7.871  -2.322  -7.034
  352    HE2  PHE  46           HE2      PHE  46  -4.649  -0.694  -9.363
  353    HZ   PHE  46           HZ       PHE  46  -5.675  -1.175  -7.157
  354    H    ALA  47           H        ALA  47 -10.286  -2.621 -13.877
  355    HA   ALA  47           HA       ALA  47 -12.565  -1.254 -12.548
  356   1HB   ALA  47          1HB       ALA  47 -13.386  -0.274 -14.445
  357   2HB   ALA  47          2HB       ALA  47 -12.818  -1.581 -15.484
  358   3HB   ALA  47          3HB       ALA  47 -11.698  -0.326 -14.953
  359    H    GLU  48           H        GLU  48 -14.690  -2.347 -13.544
  360    HA   GLU  48           HA       GLU  48 -14.135  -5.281 -13.756
  361   1HB   GLU  48          2HB       GLU  48 -16.724  -5.036 -12.763
  362   2HB   GLU  48          1HB       GLU  48 -15.294  -5.453 -11.821
  363   1HG   GLU  48          2HG       GLU  48 -16.534  -3.530 -10.842
  364   2HG   GLU  48          1HG       GLU  48 -14.895  -3.091 -11.321
  365    H    ASP  49           H        ASP  49 -15.332  -2.602 -15.344
  366    HA   ASP  49           HA       ASP  49 -17.053  -4.333 -17.076
  367   1HB   ASP  49          2HB       ASP  49 -17.980  -2.229 -15.592
  368   2HB   ASP  49          1HB       ASP  49 -17.591  -1.429 -17.115
  369    H    PHE  50           H        PHE  50 -15.774  -4.687 -18.852
  370    HA   PHE  50           HA       PHE  50 -13.610  -3.356 -19.841
  371   1HB   PHE  50          2HB       PHE  50 -14.617  -5.330 -20.950
  372   2HB   PHE  50          1HB       PHE  50 -15.923  -4.312 -21.558
  373    HD1  PHE  50           HD1      PHE  50 -15.651  -3.022 -23.527
  374    HD2  PHE  50           HD2      PHE  50 -12.219  -4.762 -21.616
  375    HE1  PHE  50           HE1      PHE  50 -14.242  -2.368 -25.461
  376    HE2  PHE  50           HE2      PHE  50 -10.811  -4.109 -23.550
  377    HZ   PHE  50           HZ       PHE  50 -11.822  -2.912 -25.473
  378    H    ASP  51           H        ASP  51 -16.991  -2.385 -20.440
  379    HA   ASP  51           HA       ASP  51 -16.387  -0.104 -22.045
  380   1HB   ASP  51          2HB       ASP  51 -18.686  -1.294 -21.408
  381   2HB   ASP  51          1HB       ASP  51 -18.722  -0.033 -20.176
  382    H    LYS  52           H        LYS  52 -17.540   0.011 -18.656
  383    HA   LYS  52           HA       LYS  52 -16.900   2.607 -18.016
  384   1HB   LYS  52          2HB       LYS  52 -17.819   0.762 -16.476
  385   2HB   LYS  52          1HB       LYS  52 -16.133   0.354 -16.153
  386   1HG   LYS  52          2HG       LYS  52 -16.476   1.890 -14.462
  387   2HG   LYS  52          1HG       LYS  52 -15.956   2.984 -15.744
  388   1HD   LYS  52          2HD       LYS  52 -17.963   3.913 -14.779
  389   2HD   LYS  52          1HD       LYS  52 -18.391   3.271 -16.365
  390   1HE   LYS  52          2HE       LYS  52 -19.623   1.537 -15.487
  391   2HE   LYS  52          1HE       LYS  52 -18.621   1.417 -14.040
  392   1HZ   LYS  52          1HZ       LYS  52 -19.947   3.930 -14.183
  393   2HZ   LYS  52          2HZ       LYS  52 -19.977   2.765 -12.946
  394   3HZ   LYS  52          3HZ       LYS  52 -21.063   2.654 -14.248
  395    H    LEU  53           H        LEU  53 -14.645  -0.054 -18.475
  396    HA   LEU  53           HA       LEU  53 -12.318   1.275 -17.431
  397   1HB   LEU  53          2HB       LEU  53 -12.607  -1.217 -17.970
  398   2HB   LEU  53          1HB       LEU  53 -12.315  -0.778 -19.652
  399    HG   LEU  53           HG       LEU  53 -10.420   0.055 -17.452
  400   1HD1  LEU  53          1HD1      LEU  53 -10.898  -2.556 -17.836
  401   2HD1  LEU  53          2HD1      LEU  53  -9.271  -1.943 -17.543
  402   3HD1  LEU  53          3HD1      LEU  53  -9.799  -2.292 -19.190
  403   1HD2  LEU  53          1HD2      LEU  53  -9.945   1.259 -19.408
  404   2HD2  LEU  53          2HD2      LEU  53 -10.395  -0.083 -20.459
  405   3HD2  LEU  53          3HD2      LEU  53  -8.878  -0.136 -19.562
  406    H    GLU  54           H        GLU  54 -13.509   0.868 -20.786
  407    HA   GLU  54           HA       GLU  54 -11.493   2.467 -22.009
  408   1HB   GLU  54          2HB       GLU  54 -14.224   1.530 -22.769
  409   2HB   GLU  54          1HB       GLU  54 -13.534   2.857 -23.702
  410   1HG   GLU  54          2HG       GLU  54 -11.429   1.411 -23.921
  411   2HG   GLU  54          1HG       GLU  54 -12.412   0.077 -23.316
  412    H    LYS  55           H        LYS  55 -14.668   3.340 -20.655
  413    HA   LYS  55           HA       LYS  55 -14.756   6.038 -21.473
  414   1HB   LYS  55          2HB       LYS  55 -15.717   4.746 -18.906
  415   2HB   LYS  55          1HB       LYS  55 -16.114   6.399 -19.378
  416   1HG   LYS  55          2HG       LYS  55 -17.003   5.438 -21.560
  417   2HG   LYS  55          1HG       LYS  55 -16.841   3.842 -20.825
  418   1HD   LYS  55          2HD       LYS  55 -18.273   4.652 -18.920
  419   2HD   LYS  55          1HD       LYS  55 -18.549   6.139 -19.830
  420   1HE   LYS  55          2HE       LYS  55 -20.352   4.396 -20.125
  421   2HE   LYS  55          1HE       LYS  55 -19.602   4.924 -21.632
  422   1HZ   LYS  55          1HZ       LYS  55 -18.142   2.986 -21.521
  423   2HZ   LYS  55          2HZ       LYS  55 -19.778   2.532 -21.573
  424   3HZ   LYS  55          3HZ       LYS  55 -18.922   2.469 -20.107
  425    H    ALA  56           H        ALA  56 -13.666   4.927 -18.241
  426    HA   ALA  56           HA       ALA  56 -12.470   7.383 -17.490
  427   1HB   ALA  56          1HB       ALA  56 -12.786   5.790 -15.765
  428   2HB   ALA  56          2HB       ALA  56 -11.037   5.857 -15.976
  429   3HB   ALA  56          3HB       ALA  56 -11.959   4.523 -16.670
  430    H    ALA  57           H        ALA  57 -11.014   4.536 -19.079
  431    HA   ALA  57           HA       ALA  57  -8.348   5.400 -19.190
  432   1HB   ALA  57          1HB       ALA  57  -8.668   4.215 -21.645
  433   2HB   ALA  57          2HB       ALA  57 -10.049   3.570 -20.758
  434   3HB   ALA  57          3HB       ALA  57  -8.414   3.334 -20.139
  435    H    VAL  58           H        VAL  58 -10.682   5.803 -21.887
  436    HA   VAL  58           HA       VAL  58  -9.225   7.536 -23.482
  437    HB   VAL  58           HB       VAL  58 -12.183   7.795 -22.855
  438   1HG1  VAL  58          1HG1      VAL  58 -11.259   9.729 -24.072
  439   2HG1  VAL  58          2HG1      VAL  58 -12.299   8.771 -25.126
  440   3HG1  VAL  58          3HG1      VAL  58 -10.545   8.643 -25.266
  441   1HG2  VAL  58          1HG2      VAL  58 -11.669   6.475 -25.326
  442   2HG2  VAL  58          2HG2      VAL  58 -12.410   5.798 -23.876
  443   3HG2  VAL  58          3HG2      VAL  58 -10.665   5.694 -24.105
  444    H    GLU  59           H        GLU  59 -11.189   8.435 -20.640
  445    HA   GLU  59           HA       GLU  59 -10.809  11.242 -20.801
  446   1HB   GLU  59          2HB       GLU  59 -11.765   9.340 -18.842
  447   2HB   GLU  59          1HB       GLU  59 -10.763  10.563 -18.058
  448   1HG   GLU  59          2HG       GLU  59 -12.959  11.269 -20.015
  449   2HG   GLU  59          1HG       GLU  59 -13.237  11.145 -18.278
  450    H    ALA  60           H        ALA  60  -8.808   8.741 -19.237
  451    HA   ALA  60           HA       ALA  60  -6.862  10.563 -18.176
  452   1HB   ALA  60          1HB       ALA  60  -5.694   8.015 -18.891
  453   2HB   ALA  60          2HB       ALA  60  -7.285   7.771 -18.172
  454   3HB   ALA  60          3HB       ALA  60  -6.045   8.660 -17.288
  455    H    PHE  61           H        PHE  61  -6.976   8.690 -21.216
  456    HA   PHE  61           HA       PHE  61  -4.438   9.630 -22.187
  457   1HB   PHE  61          2HB       PHE  61  -5.359   7.673 -23.215
  458   2HB   PHE  61          1HB       PHE  61  -6.872   8.500 -23.587
  459    HD1  PHE  61           HD1      PHE  61  -6.802  10.496 -25.194
  460    HD2  PHE  61           HD2      PHE  61  -3.548   7.729 -24.734
  461    HE1  PHE  61           HE1      PHE  61  -5.865  11.235 -27.368
  462    HE2  PHE  61           HE2      PHE  61  -2.613   8.467 -26.909
  463    HZ   PHE  61           HZ       PHE  61  -3.771  10.220 -28.226
  464    H    LYS  62           H        LYS  62  -7.556  11.097 -21.980
  465    HA   LYS  62           HA       LYS  62  -7.129  13.015 -24.137
  466   1HB   LYS  62          2HB       LYS  62  -9.406  12.374 -23.411
  467   2HB   LYS  62          1HB       LYS  62  -9.090  13.072 -21.821
  468   1HG   LYS  62          2HG       LYS  62  -9.296  15.220 -22.576
  469   2HG   LYS  62          1HG       LYS  62  -8.557  14.850 -24.135
  470   1HD   LYS  62          2HD       LYS  62 -10.622  13.764 -24.886
  471   2HD   LYS  62          1HD       LYS  62 -11.367  14.054 -23.314
  472   1HE   LYS  62          2HE       LYS  62 -10.230  16.387 -24.806
  473   2HE   LYS  62          1HE       LYS  62 -11.780  15.728 -25.328
  474   1HZ   LYS  62          1HZ       LYS  62 -11.103  16.661 -22.590
  475   2HZ   LYS  62          2HZ       LYS  62 -12.583  15.962 -23.047
  476   3HZ   LYS  62          3HZ       LYS  62 -12.110  17.457 -23.699
  477    H    MET  63           H        MET  63  -6.731  12.992 -20.612
  478    HA   MET  63           HA       MET  63  -6.065  15.788 -20.391
  479   1HB   MET  63          2HB       MET  63  -5.900  13.384 -18.649
  480   2HB   MET  63          1HB       MET  63  -4.803  14.708 -18.258
  481   1HG   MET  63          2HG       MET  63  -6.697  16.275 -18.184
  482   2HG   MET  63          1HG       MET  63  -7.804  14.969 -18.609
  483   1HE   MET  63          1HE       MET  63  -8.103  13.021 -17.601
  484   2HE   MET  63          2HE       MET  63  -9.140  13.656 -16.325
  485   3HE   MET  63          3HE       MET  63  -7.833  12.547 -15.917
  486    H    GLY  64           H        GLY  64  -4.029  12.842 -20.511
  487   1HA   GLY  64          2HA       GLY  64  -2.065  13.654 -22.234
  488   2HA   GLY  64          1HA       GLY  64  -1.594  14.458 -20.735
  489    H    PHE  65           H        PHE  65  -2.961  11.998 -19.364
  490    HA   PHE  65           HA       PHE  65  -0.532  10.570 -18.839
  491   1HB   PHE  65          2HB       PHE  65  -3.377   9.619 -18.398
  492   2HB   PHE  65          1HB       PHE  65  -1.932   9.016 -17.589
  493    HD1  PHE  65           HD1      PHE  65  -0.915  10.218 -15.773
  494    HD2  PHE  65           HD2      PHE  65  -4.170  11.946 -17.978
  495    HE1  PHE  65           HE1      PHE  65  -1.135  11.992 -14.056
  496    HE2  PHE  65           HE2      PHE  65  -4.390  13.722 -16.262
  497    HZ   PHE  65           HZ       PHE  65  -2.873  13.746 -14.300
  498    H    GLU  66           H        GLU  66   0.381   8.869 -19.911
  499    HA   GLU  66           HA       GLU  66  -0.926   7.915 -22.374
  500   1HB   GLU  66          2HB       GLU  66   1.604   8.451 -22.045
  501   2HB   GLU  66          1HB       GLU  66   1.678   6.865 -21.275
  502   1HG   GLU  66          2HG       GLU  66   0.444   6.016 -23.397
  503   2HG   GLU  66          1HG       GLU  66   0.957   7.539 -24.123
  504    H    VAL  67           H        VAL  67  -2.567   6.480 -21.875
  505    HA   VAL  67           HA       VAL  67  -2.527   4.650 -19.680
  506    HB   VAL  67           HB       VAL  67  -4.603   5.295 -20.853
  507   1HG1  VAL  67          1HG1      VAL  67  -3.685   3.491 -23.099
  508   2HG1  VAL  67          2HG1      VAL  67  -3.459   5.239 -23.141
  509   3HG1  VAL  67          3HG1      VAL  67  -5.086   4.562 -23.073
  510   1HG2  VAL  67          1HG2      VAL  67  -5.464   3.358 -20.086
  511   2HG2  VAL  67          2HG2      VAL  67  -3.835   2.686 -20.026
  512   3HG2  VAL  67          3HG2      VAL  67  -4.816   2.490 -21.478
  513    H    LEU  68           H        LEU  68  -1.808   2.541 -19.526
  514    HA   LEU  68           HA       LEU  68  -0.276   1.503 -21.874
  515   1HB   LEU  68          2HB       LEU  68   0.277   1.599 -18.978
  516   2HB   LEU  68          1HB       LEU  68   0.593   0.032 -19.723
  517    HG   LEU  68           HG       LEU  68   1.940   1.189 -21.482
  518   1HD1  LEU  68          1HD1      LEU  68   0.812   3.399 -21.257
  519   2HD1  LEU  68          2HD1      LEU  68   2.566   3.531 -21.137
  520   3HD1  LEU  68          3HD1      LEU  68   1.575   3.603 -19.680
  521   1HD2  LEU  68          1HD2      LEU  68   2.846   1.828 -18.657
  522   2HD2  LEU  68          2HD2      LEU  68   3.880   1.579 -20.065
  523   3HD2  LEU  68          3HD2      LEU  68   2.961   0.230 -19.395
  524    H    GLU  69           H        GLU  69  -0.778  -0.554 -22.616
  525    HA   GLU  69           HA       GLU  69  -3.277  -1.668 -22.367
  526   1HB   GLU  69          2HB       GLU  69  -0.627  -3.090 -22.717
  527   2HB   GLU  69          1HB       GLU  69  -2.183  -3.906 -22.881
  528   1HG   GLU  69          2HG       GLU  69  -2.133  -1.418 -24.388
  529   2HG   GLU  69          1HG       GLU  69  -0.828  -2.496 -24.886
  530    H    ALA  70           H        ALA  70  -4.292  -3.193 -21.022
  531    HA   ALA  70           HA       ALA  70  -3.155  -3.349 -18.288
  532   1HB   ALA  70          1HB       ALA  70  -5.892  -4.139 -19.337
  533   2HB   ALA  70          2HB       ALA  70  -5.503  -2.606 -18.557
  534   3HB   ALA  70          3HB       ALA  70  -5.409  -4.110 -17.641
  535    H    GLU  71           H        GLU  71  -3.894  -5.606 -17.207
  536    HA   GLU  71           HA       GLU  71  -3.394  -7.855 -19.075
  537   1HB   GLU  71          2HB       GLU  71  -1.161  -7.159 -18.242
  538   2HB   GLU  71          1HB       GLU  71  -1.729  -7.365 -16.585
  539   1HG   GLU  71          2HG       GLU  71  -0.967  -9.493 -16.782
  540   2HG   GLU  71          1HG       GLU  71  -2.422  -9.768 -17.740
  541    H    GLU  72           H        GLU  72  -5.247  -8.998 -18.662
  542    HA   GLU  72           HA       GLU  72  -6.922  -9.018 -16.501
  543   1HB   GLU  72          2HB       GLU  72  -6.380 -11.782 -17.243
  544   2HB   GLU  72          1HB       GLU  72  -7.831 -10.818 -17.518
  545   1HG   GLU  72          2HG       GLU  72  -6.983 -11.392 -19.685
  546   2HG   GLU  72          1HG       GLU  72  -6.581  -9.695 -19.428
  547    H    THR  73           H        THR  73  -6.425  -9.079 -14.367
  548    HA   THR  73           HA       THR  73  -4.497 -11.165 -13.450
  549    HB   THR  73           HB       THR  73  -3.211  -9.161 -13.329
  550    HG1  THR  73           HG1      THR  73  -2.786  -9.827 -11.393
  551   1HG2  THR  73          1HG2      THR  73  -5.509  -7.789 -11.923
  552   2HG2  THR  73          2HG2      THR  73  -5.262  -7.687 -13.666
  553   3HG2  THR  73          3HG2      THR  73  -4.040  -7.054 -12.564
  554    H    GLU  74           H        GLU  74  -4.743 -10.474 -10.688
  555    HA   GLU  74           HA       GLU  74  -7.644 -10.598 -10.113
  556   1HB   GLU  74          2HB       GLU  74  -7.601 -12.695  -9.045
  557   2HB   GLU  74          1HB       GLU  74  -6.617 -12.965 -10.485
  558   1HG   GLU  74          2HG       GLU  74  -5.654 -12.446  -7.662
  559   2HG   GLU  74          1HG       GLU  74  -5.384 -13.886  -8.645
  560    H    ASP  75           H        ASP  75  -8.030 -10.442  -7.725
  561    HA   ASP  75           HA       ASP  75  -5.721  -9.238  -6.268
  562   1HB   ASP  75          2HB       ASP  75  -8.293  -7.989  -7.014
  563   2HB   ASP  75          1HB       ASP  75  -7.842  -7.791  -5.320
  564    H    GLU  76           H        GLU  76  -7.106 -11.890  -6.170
  565    HA   GLU  76           HA       GLU  76  -7.675 -13.392  -4.453
  566   1HB   GLU  76          2HB       GLU  76  -6.195 -11.411  -3.179
  567   2HB   GLU  76          1HB       GLU  76  -7.689 -11.477  -2.243
  568   1HG   GLU  76          2HG       GLU  76  -7.362 -14.056  -2.322
  569   2HG   GLU  76          1HG       GLU  76  -5.697 -13.676  -2.762
  570    H    ASP  77           H        ASP  77  -9.408 -10.788  -5.445
  571    HA   ASP  77           HA       ASP  77 -11.868 -11.839  -4.199
  572   1HB   ASP  77          2HB       ASP  77 -12.604  -9.638  -3.415
  573   2HB   ASP  77          1HB       ASP  77 -11.074 -10.060  -2.645
  574    H    GLY  78           H        GLY  78 -10.178 -10.391  -6.759
  575   1HA   GLY  78          2HA       GLY  78 -12.687  -9.585  -8.145
  576   2HA   GLY  78          1HA       GLY  78 -11.055  -9.155  -8.663
  577    H    ASN  79           H        ASN  79 -10.179 -12.000  -8.123
  578    HA   ASN  79           HA       ASN  79  -9.926 -13.968  -9.371
  579   1HB   ASN  79          2HB       ASN  79 -12.329 -14.240  -8.730
  580   2HB   ASN  79          1HB       ASN  79 -12.784 -13.413 -10.220
  581   1HD2  ASN  79          1HD2      ASN  79 -13.707 -16.001  -9.983
  582   2HD2  ASN  79          2HD2      ASN  79 -12.825 -17.049 -10.986
  583    H    LYS  80           H        LYS  80 -12.041 -11.913 -11.419
  584    HA   LYS  80           HA       LYS  80  -9.862 -11.928 -13.459
  585   1HB   LYS  80          2HB       LYS  80 -11.960 -13.558 -13.776
  586   2HB   LYS  80          1HB       LYS  80 -12.692 -12.078 -14.398
  587   1HG   LYS  80          2HG       LYS  80 -10.343 -11.930 -15.682
  588   2HG   LYS  80          1HG       LYS  80 -10.433 -13.681 -15.497
  589   1HD   LYS  80          2HD       LYS  80 -12.961 -13.191 -16.312
  590   2HD   LYS  80          1HD       LYS  80 -12.131 -11.859 -17.119
  591   1HE   LYS  80          2HE       LYS  80 -12.125 -13.750 -18.626
  592   2HE   LYS  80          1HE       LYS  80 -10.481 -13.537 -18.022
  593   1HZ   LYS  80          1HZ       LYS  80 -10.645 -15.693 -17.509
  594   2HZ   LYS  80          2HZ       LYS  80 -12.342 -15.699 -17.583
  595   3HZ   LYS  80          3HZ       LYS  80 -11.552 -15.166 -16.177
  596    H    LEU  81           H        LEU  81  -9.312  -9.783 -13.450
  597    HA   LEU  81           HA       LEU  81 -11.469  -7.842 -14.091
  598   1HB   LEU  81          2HB       LEU  81 -10.593  -6.232 -12.450
  599   2HB   LEU  81          1HB       LEU  81 -11.102  -7.714 -11.642
  600    HG   LEU  81           HG       LEU  81  -8.523  -8.345 -12.187
  601   1HD1  LEU  81          1HD1      LEU  81  -7.881  -6.246 -13.145
  602   2HD1  LEU  81          2HD1      LEU  81  -7.213  -6.260 -11.514
  603   3HD1  LEU  81          3HD1      LEU  81  -8.676  -5.339 -11.860
  604   1HD2  LEU  81          1HD2      LEU  81  -9.146  -8.670  -9.988
  605   2HD2  LEU  81          2HD2      LEU  81  -9.921  -7.091  -9.865
  606   3HD2  LEU  81          3HD2      LEU  81  -8.164  -7.219  -9.782
  607    H    LEU  82           H        LEU  82 -10.353  -5.647 -14.685
  608    HA   LEU  82           HA       LEU  82  -7.915  -6.304 -16.288
  609   1HB   LEU  82          2HB       LEU  82 -10.162  -4.336 -16.784
  610   2HB   LEU  82          1HB       LEU  82  -8.661  -4.336 -17.711
  611    HG   LEU  82           HG       LEU  82  -9.112  -6.807 -18.185
  612   1HD1  LEU  82          1HD1      LEU  82 -11.818  -7.004 -18.090
  613   2HD1  LEU  82          2HD1      LEU  82 -11.531  -6.041 -16.641
  614   3HD1  LEU  82          3HD1      LEU  82 -10.760  -7.617 -16.820
  615   1HD2  LEU  82          1HD2      LEU  82  -9.515  -4.908 -19.791
  616   2HD2  LEU  82          2HD2      LEU  82 -11.182  -4.847 -19.222
  617   3HD2  LEU  82          3HD2      LEU  82 -10.583  -6.288 -20.043
  618    H    CYS  83           H        CYS  83  -6.106  -5.034 -15.991
  619    HA   CYS  83           HA       CYS  83  -6.400  -2.660 -14.196
  620   1HB   CYS  83          2HB       CYS  83  -4.261  -3.239 -13.156
  621   2HB   CYS  83          1HB       CYS  83  -5.381  -4.593 -13.002
  622    HG   CYS  83           HG       CYS  83  -3.740  -4.926 -15.511
  623    H    PHE  84           H        PHE  84  -6.165  -1.028 -15.708
  624    HA   PHE  84           HA       PHE  84  -3.990  -1.257 -17.712
  625   1HB   PHE  84          2HB       PHE  84  -4.977   0.901 -18.581
  626   2HB   PHE  84          1HB       PHE  84  -6.086  -0.468 -18.610
  627    HD1  PHE  84           HD1      PHE  84  -7.628  -0.775 -16.529
  628    HD2  PHE  84           HD2      PHE  84  -5.596   2.886 -17.493
  629    HE1  PHE  84           HE1      PHE  84  -9.225   0.485 -15.111
  630    HE2  PHE  84           HE2      PHE  84  -7.194   4.145 -16.074
  631    HZ   PHE  84           HZ       PHE  84  -9.008   2.945 -14.884
  632    H    ASP  85           H        ASP  85  -2.288   0.300 -17.814
  633    HA   ASP  85           HA       ASP  85  -1.908   1.794 -15.247
  634   1HB   ASP  85          2HB       ASP  85  -0.172   0.199 -15.378
  635   2HB   ASP  85          1HB       ASP  85   0.040   0.444 -17.111
  636    H    ALA  86           H        ALA  86  -1.158   3.943 -15.353
  637    HA   ALA  86           HA       ALA  86  -1.106   5.158 -18.086
  638   1HB   ALA  86          1HB       ALA  86  -1.947   7.031 -16.038
  639   2HB   ALA  86          2HB       ALA  86  -3.012   5.626 -16.064
  640   3HB   ALA  86          3HB       ALA  86  -2.771   6.576 -17.529
  641    H    THR  87           H        THR  87   0.507   6.725 -18.402
  642    HA   THR  87           HA       THR  87   2.383   7.087 -16.099
  643    HB   THR  87           HB       THR  87   4.013   7.564 -18.140
  644    HG1  THR  87           HG1      THR  87   3.129   5.705 -19.639
  645   1HG2  THR  87          1HG2      THR  87   4.068   4.831 -18.223
  646   2HG2  THR  87          2HG2      THR  87   3.184   5.116 -16.722
  647   3HG2  THR  87          3HG2      THR  87   4.794   5.801 -16.942
  648    H    MET  88           H        MET  88   3.689   9.151 -16.280
  649    HA   MET  88           HA       MET  88   2.665  11.335 -17.886
  650   1HB   MET  88          2HB       MET  88   0.834  11.550 -16.454
  651   2HB   MET  88          1HB       MET  88   1.744  11.000 -15.045
  652   1HG   MET  88          2HG       MET  88   2.959  13.079 -14.925
  653   2HG   MET  88          1HG       MET  88   2.302  13.612 -16.472
  654   1HE   MET  88          1HE       MET  88  -0.966  15.052 -15.909
  655   2HE   MET  88          2HE       MET  88  -0.686  13.490 -16.674
  656   3HE   MET  88          3HE       MET  88   0.486  14.789 -16.882
  657    H    GLN  89           H        GLN  89   4.255  12.893 -18.000
  658    HA   GLN  89           HA       GLN  89   6.644  12.479 -16.299
  659   1HB   GLN  89          2HB       GLN  89   7.531  14.344 -17.903
  660   2HB   GLN  89          1HB       GLN  89   7.288  12.718 -18.540
  661   1HG   GLN  89          2HG       GLN  89   4.855  14.335 -18.664
  662   2HG   GLN  89          1HG       GLN  89   6.185  15.046 -19.580
  663   1HE2  GLN  89          1HE2      GLN  89   6.014  11.552 -19.100
  664   2HE2  GLN  89          2HE2      GLN  89   5.627  11.169 -20.707
  665    H    SER  90           H        SER  90   7.502  14.112 -14.965
  666    HA   SER  90           HA       SER  90   6.123  16.703 -14.765
  667   1HB   SER  90          2HB       SER  90   5.511  16.442 -12.421
  668   2HB   SER  90          1HB       SER  90   4.758  15.149 -13.352
  669    HG   SER  90           HG       SER  90   6.151  13.724 -12.523
  670    H    ALA  91           H        ALA  91   7.187  17.817 -12.626
  671    HA   ALA  91           HA       ALA  91  10.116  17.492 -13.044
  672   1HB   ALA  91          1HB       ALA  91   9.030  19.706 -11.372
  673   2HB   ALA  91          2HB       ALA  91   8.657  19.752 -13.095
  674   3HB   ALA  91          3HB       ALA  91  10.336  19.729 -12.556
  675    H    LEU  92           H        LEU  92   8.907  15.491 -11.488
  676    HA   LEU  92           HA       LEU  92   8.818  14.600  -9.286
  677   1HB   LEU  92          2HB       LEU  92  11.388  14.965 -10.242
  678   2HB   LEU  92          1HB       LEU  92  11.460  15.704  -8.642
  679    HG   LEU  92           HG       LEU  92  10.289  12.958  -9.143
  680   1HD1  LEU  92          1HD1      LEU  92  12.601  12.780  -9.745
  681   2HD1  LEU  92          2HD1      LEU  92  12.477  12.181  -8.090
  682   3HD1  LEU  92          3HD1      LEU  92  13.098  13.804  -8.398
  683   1HD2  LEU  92          1HD2      LEU  92  10.912  14.662  -6.750
  684   2HD2  LEU  92          2HD2      LEU  92  11.008  12.907  -6.597
  685   3HD2  LEU  92          3HD2      LEU  92   9.489  13.669  -7.072
  686    H    ASP  93           H        ASP  93   7.274  15.877  -8.187
  687    HA   ASP  93           HA       ASP  93   8.374  17.615  -6.110
  688   1HB   ASP  93          2HB       ASP  93   7.225  18.741  -8.546
  689   2HB   ASP  93          1HB       ASP  93   6.353  19.262  -7.104
  690    H    ALA  94           H        ALA  94   7.322  16.682  -4.416
  691    HA   ALA  94           HA       ALA  94   5.063  15.141  -4.324
  692   1HB   ALA  94          1HB       ALA  94   6.594  16.413  -2.418
  693   2HB   ALA  94          2HB       ALA  94   5.179  15.418  -2.073
  694   3HB   ALA  94          3HB       ALA  94   5.017  17.170  -2.194
  695    H    LYS  95           H        LYS  95   4.794  18.629  -3.563
  696    HA   LYS  95           HA       LYS  95   2.115  19.040  -3.629
  697   1HB   LYS  95          2HB       LYS  95   3.695  20.901  -3.452
  698   2HB   LYS  95          1HB       LYS  95   4.141  20.710  -5.149
  699   1HG   LYS  95          2HG       LYS  95   2.056  21.476  -5.914
  700   2HG   LYS  95          1HG       LYS  95   1.268  21.159  -4.368
  701   1HD   LYS  95          2HD       LYS  95   2.287  23.031  -3.333
  702   2HD   LYS  95          1HD       LYS  95   3.485  23.193  -4.618
  703   1HE   LYS  95          2HE       LYS  95   1.893  24.914  -5.034
  704   2HE   LYS  95          1HE       LYS  95   1.510  23.639  -6.192
  705   1HZ   LYS  95          1HZ       LYS  95  -0.345  24.704  -4.724
  706   2HZ   LYS  95          2HZ       LYS  95   0.212  23.595  -3.563
  707   3HZ   LYS  95          3HZ       LYS  95  -0.364  23.041  -5.061
  708    H    LEU  96           H        LEU  96   4.097  18.606  -6.565
  709    HA   LEU  96           HA       LEU  96   1.863  18.857  -8.377
  710   1HB   LEU  96          2HB       LEU  96   4.715  18.127  -8.547
  711   2HB   LEU  96          1HB       LEU  96   3.690  17.333  -9.742
  712    HG   LEU  96           HG       LEU  96   2.763  19.538 -10.393
  713   1HD1  LEU  96          1HD1      LEU  96   4.933  20.850  -8.781
  714   2HD1  LEU  96          2HD1      LEU  96   3.389  20.472  -8.017
  715   3HD1  LEU  96          3HD1      LEU  96   3.443  21.547  -9.414
  716   1HD2  LEU  96          1HD2      LEU  96   4.843  20.410 -11.458
  717   2HD2  LEU  96          2HD2      LEU  96   4.693  18.660 -11.621
  718   3HD2  LEU  96          3HD2      LEU  96   5.792  19.344 -10.423
  719    H    ILE  97           H        ILE  97   3.731  15.963  -7.376
  720    HA   ILE  97           HA       ILE  97   2.118  14.007  -8.549
  721    HB   ILE  97           HB       ILE  97   3.408  13.844  -5.808
  722   1HG1  ILE  97          2HG1      ILE  97   4.632  12.858  -8.372
  723   2HG1  ILE  97          1HG1      ILE  97   4.791  14.559  -7.929
  724   1HG2  ILE  97          1HG2      ILE  97   2.467  11.772  -7.805
  725   2HG2  ILE  97          2HG2      ILE  97   1.950  11.969  -6.130
  726   3HG2  ILE  97          3HG2      ILE  97   3.579  11.397  -6.488
  727   1HD1  ILE  97          1HD1      ILE  97   6.235  14.110  -6.230
  728   2HD1  ILE  97          2HD1      ILE  97   6.484  12.581  -7.074
  729   3HD1  ILE  97          3HD1      ILE  97   5.346  12.671  -5.731
  730    H    ASP  98           H        ASP  98   1.411  16.047  -5.818
  731    HA   ASP  98           HA       ASP  98  -0.748  14.417  -4.762
  732   1HB   ASP  98          2HB       ASP  98   0.509  16.972  -4.154
  733   2HB   ASP  98          1HB       ASP  98  -1.248  17.074  -4.034
  734    H    GLU  99           H        GLU  99  -0.772  17.517  -6.568
  735    HA   GLU  99           HA       GLU  99  -3.555  17.603  -7.036
  736   1HB   GLU  99          2HB       GLU  99  -1.292  18.593  -8.798
  737   2HB   GLU  99          1HB       GLU  99  -2.985  19.055  -8.980
  738   1HG   GLU  99          2HG       GLU  99  -3.013  20.239  -6.951
  739   2HG   GLU  99          1HG       GLU  99  -1.594  19.394  -6.331
  740    H    GLN 100           H        GLN 100  -0.991  15.987  -8.900
  741    HA   GLN 100           HA       GLN 100  -2.717  15.142 -11.044
  742   1HB   GLN 100          2HB       GLN 100  -0.022  14.243 -10.037
  743   2HB   GLN 100          1HB       GLN 100  -0.840  13.369 -11.331
  744   1HG   GLN 100          2HG       GLN 100   0.491  14.954 -12.474
  745   2HG   GLN 100          1HG       GLN 100  -1.115  15.683 -12.455
  746   1HE2  GLN 100          1HE2      GLN 100   2.117  16.358 -11.807
  747   2HE2  GLN 100          2HE2      GLN 100   1.903  17.675 -10.758
  748    H    VAL 101           H        VAL 101  -1.427  13.353  -8.219
  749    HA   VAL 101           HA       VAL 101  -2.872  10.956  -8.667
  750    HB   VAL 101           HB       VAL 101  -1.776  12.272  -6.187
  751   1HG1  VAL 101          1HG1      VAL 101  -3.685   9.998  -6.404
  752   2HG1  VAL 101          2HG1      VAL 101  -3.425  11.126  -5.072
  753   3HG1  VAL 101          3HG1      VAL 101  -2.315   9.776  -5.316
  754   1HG2  VAL 101          1HG2      VAL 101  -0.231  10.371  -6.274
  755   2HG2  VAL 101          2HG2      VAL 101  -0.246  11.193  -7.835
  756   3HG2  VAL 101          3HG2      VAL 101  -1.127   9.679  -7.627
  757    H    GLU 102           H        GLU 102  -3.852  13.987  -7.152
  758    HA   GLU 102           HA       GLU 102  -6.305  13.019  -6.012
  759   1HB   GLU 102          2HB       GLU 102  -5.129  15.679  -6.656
  760   2HB   GLU 102          1HB       GLU 102  -6.882  15.609  -6.461
  761   1HG   GLU 102          2HG       GLU 102  -6.470  14.361  -4.281
  762   2HG   GLU 102          1HG       GLU 102  -4.768  14.793  -4.455
  763    H    LYS 103           H        LYS 103  -5.488  14.385  -9.187
  764    HA   LYS 103           HA       LYS 103  -8.148  14.592 -10.191
  765   1HB   LYS 103          2HB       LYS 103  -5.426  14.358 -11.406
  766   2HB   LYS 103          1HB       LYS 103  -6.820  14.080 -12.450
  767   1HG   LYS 103          2HG       LYS 103  -7.668  16.253 -12.100
  768   2HG   LYS 103          1HG       LYS 103  -6.689  16.497 -10.652
  769   1HD   LYS 103          2HD       LYS 103  -4.639  16.379 -12.119
  770   2HD   LYS 103          1HD       LYS 103  -5.713  16.375 -13.518
  771   1HE   LYS 103          2HE       LYS 103  -6.305  18.576 -13.244
  772   2HE   LYS 103          1HE       LYS 103  -6.171  18.502 -11.488
  773   1HZ   LYS 103          1HZ       LYS 103  -3.979  18.716 -13.467
  774   2HZ   LYS 103          2HZ       LYS 103  -3.711  18.318 -11.837
  775   3HZ   LYS 103          3HZ       LYS 103  -4.390  19.820 -12.248
  776    H    LEU 104           H        LEU 104  -5.774  11.932 -10.548
  777    HA   LEU 104           HA       LEU 104  -7.537  10.155 -11.912
  778   1HB   LEU 104          2HB       LEU 104  -5.117   9.682 -10.159
  779   2HB   LEU 104          1HB       LEU 104  -5.980   8.362 -10.951
  780    HG   LEU 104           HG       LEU 104  -5.135  10.736 -12.580
  781   1HD1  LEU 104          1HD1      LEU 104  -3.123   8.853 -12.938
  782   2HD1  LEU 104          2HD1      LEU 104  -3.349   8.879 -11.189
  783   3HD1  LEU 104          3HD1      LEU 104  -2.966  10.370 -12.051
  784   1HD2  LEU 104          1HD2      LEU 104  -5.269   7.768 -13.194
  785   2HD2  LEU 104          2HD2      LEU 104  -5.092   9.081 -14.356
  786   3HD2  LEU 104          3HD2      LEU 104  -6.602   8.889 -13.466
  787    H    VAL 105           H        VAL 105  -7.273  11.037  -8.548
  788    HA   VAL 105           HA       VAL 105  -8.687   8.732  -7.502
  789    HB   VAL 105           HB       VAL 105  -7.925  11.436  -6.438
  790   1HG1  VAL 105          1HG1      VAL 105  -9.950   9.517  -5.281
  791   2HG1  VAL 105          2HG1      VAL 105 -10.105  11.258  -5.513
  792   3HG1  VAL 105          3HG1      VAL 105  -9.036  10.628  -4.260
  793   1HG2  VAL 105          1HG2      VAL 105  -6.553  10.190  -4.987
  794   2HG2  VAL 105          2HG2      VAL 105  -6.481   9.261  -6.485
  795   3HG2  VAL 105          3HG2      VAL 105  -7.528   8.731  -5.168
  796    H    ASN 106           H        ASN 106  -9.737  12.153  -7.793
  797    HA   ASN 106           HA       ASN 106 -12.480  11.687  -7.321
  798   1HB   ASN 106          2HB       ASN 106 -11.289  13.760  -9.191
  799   2HB   ASN 106          1HB       ASN 106 -12.878  13.831  -8.428
  800   1HD2  ASN 106          1HD2      ASN 106 -11.525  15.989  -7.732
  801   2HD2  ASN 106          2HD2      ASN 106 -10.779  15.862  -6.212
  802    H    LEU 107           H        LEU 107 -10.666  11.601 -10.383
  803    HA   LEU 107           HA       LEU 107 -12.946  11.100 -12.057
  804   1HB   LEU 107          2HB       LEU 107 -10.760  11.865 -12.933
  805   2HB   LEU 107          1HB       LEU 107 -10.042  10.322 -12.473
  806    HG   LEU 107           HG       LEU 107 -12.052   9.352 -13.924
  807   1HD1  LEU 107          1HD1      LEU 107 -11.550  12.106 -15.093
  808   2HD1  LEU 107          2HD1      LEU 107 -13.062  11.547 -14.376
  809   3HD1  LEU 107          3HD1      LEU 107 -12.475  10.825 -15.875
  810   1HD2  LEU 107          1HD2      LEU 107  -9.657  10.606 -15.289
  811   2HD2  LEU 107          2HD2      LEU 107 -10.509   9.132 -15.750
  812   3HD2  LEU 107          3HD2      LEU 107  -9.535   9.166 -14.279
  813    H    ALA 108           H        ALA 108 -10.481   8.879 -10.720
  814    HA   ALA 108           HA       ALA 108 -11.445   6.455 -11.674
  815   1HB   ALA 108          1HB       ALA 108 -10.652   5.545  -9.364
  816   2HB   ALA 108          2HB       ALA 108 -10.165   7.212  -9.055
  817   3HB   ALA 108          3HB       ALA 108  -9.467   6.326 -10.411
  818    H    GLU 109           H        GLU 109 -12.431   7.926  -8.548
  819    HA   GLU 109           HA       GLU 109 -14.528   6.018  -8.090
  820   1HB   GLU 109          2HB       GLU 109 -14.415   8.844  -7.008
  821   2HB   GLU 109          1HB       GLU 109 -15.210   7.446  -6.283
  822   1HG   GLU 109          2HG       GLU 109 -12.240   7.930  -6.595
  823   2HG   GLU 109          1HG       GLU 109 -13.150   7.711  -5.098
  824    H    LYS 110           H        LYS 110 -14.516   9.258  -9.565
  825    HA   LYS 110           HA       LYS 110 -17.264   9.698  -9.827
  826   1HB   LYS 110          2HB       LYS 110 -15.599  11.342 -10.547
  827   2HB   LYS 110          1HB       LYS 110 -15.093  10.280 -11.861
  828   1HG   LYS 110          2HG       LYS 110 -17.313  10.422 -12.876
  829   2HG   LYS 110          1HG       LYS 110 -17.888  11.408 -11.531
  830   1HD   LYS 110          2HD       LYS 110 -15.458  12.518 -12.675
  831   2HD   LYS 110          1HD       LYS 110 -16.714  12.342 -13.900
  832   1HE   LYS 110          2HE       LYS 110 -18.309  13.481 -12.311
  833   2HE   LYS 110          1HE       LYS 110 -16.933  13.811 -11.260
  834   1HZ   LYS 110          1HZ       LYS 110 -17.638  14.989 -13.821
  835   2HZ   LYS 110          2HZ       LYS 110 -15.985  14.686 -13.573
  836   3HZ   LYS 110          3HZ       LYS 110 -16.843  15.678 -12.492
  837    H    PHE 111           H        PHE 111 -15.253   7.400 -11.559
  838    HA   PHE 111           HA       PHE 111 -17.533   6.742 -13.355
  839   1HB   PHE 111          2HB       PHE 111 -14.583   6.285 -13.425
  840   2HB   PHE 111          1HB       PHE 111 -15.613   5.085 -14.207
  841    HD1  PHE 111           HD1      PHE 111 -13.998   8.229 -14.591
  842    HD2  PHE 111           HD2      PHE 111 -17.489   6.027 -15.782
  843    HE1  PHE 111           HE1      PHE 111 -14.286   9.739 -16.537
  844    HE2  PHE 111           HE2      PHE 111 -17.778   7.539 -17.728
  845    HZ   PHE 111           HZ       PHE 111 -16.176   9.393 -18.105
  846    H    ASP 112           H        ASP 112 -15.058   4.661 -11.853
  847    HA   ASP 112           HA       ASP 112 -16.549   3.316  -9.941
  848   1HB   ASP 112          2HB       ASP 112 -17.465   2.698 -12.659
  849   2HB   ASP 112          1HB       ASP 112 -17.016   1.261 -11.741
  850    H    ILE 113           H        ILE 113 -13.820   3.912 -10.779
  851    HA   ILE 113           HA       ILE 113 -12.709   1.134 -10.741
  852    HB   ILE 113           HB       ILE 113 -10.747   2.028 -11.971
  853   1HG1  ILE 113          2HG1      ILE 113 -12.432   4.548 -12.150
  854   2HG1  ILE 113          1HG1      ILE 113 -10.963   4.371 -11.191
  855   1HG2  ILE 113          1HG2      ILE 113 -12.950   2.929 -13.716
  856   2HG2  ILE 113          2HG2      ILE 113 -13.205   1.347 -12.979
  857   3HG2  ILE 113          3HG2      ILE 113 -11.773   1.640 -13.966
  858   1HD1  ILE 113          1HD1      ILE 113 -10.794   5.422 -13.581
  859   2HD1  ILE 113          2HD1      ILE 113 -10.913   3.752 -14.134
  860   3HD1  ILE 113          3HD1      ILE 113  -9.587   4.239 -13.081
  861    H    ILE 114           H        ILE 114 -10.693   0.924  -9.518
  862    HA   ILE 114           HA       ILE 114 -10.535   2.955  -7.337
  863    HB   ILE 114           HB       ILE 114 -10.922   0.922  -6.276
  864   1HG1  ILE 114          2HG1      ILE 114  -7.961   0.514  -6.533
  865   2HG1  ILE 114          1HG1      ILE 114  -8.549   2.011  -5.808
  866   1HG2  ILE 114          1HG2      ILE 114  -9.819  -1.215  -7.074
  867   2HG2  ILE 114          2HG2      ILE 114  -9.232  -0.308  -8.469
  868   3HG2  ILE 114          3HG2      ILE 114 -10.966  -0.509  -8.212
  869   1HD1  ILE 114          1HD1      ILE 114  -9.919  -0.390  -4.809
  870   2HD1  ILE 114          2HD1      ILE 114  -9.222   0.961  -3.915
  871   3HD1  ILE 114          3HD1      ILE 114  -8.191  -0.365  -4.454
  872    H    TYR 115           H        TYR 115  -8.542   3.882  -6.807
  873    HA   TYR 115           HA       TYR 115  -6.293   3.272  -8.687
  874   1HB   TYR 115          2HB       TYR 115  -6.787   5.441  -9.316
  875   2HB   TYR 115          1HB       TYR 115  -7.459   5.857  -7.741
  876    HD1  TYR 115           HD1      TYR 115  -6.142   6.948  -6.110
  877    HD2  TYR 115           HD2      TYR 115  -4.250   5.131  -9.511
  878    HE1  TYR 115           HE1      TYR 115  -3.983   7.979  -5.458
  879    HE2  TYR 115           HE2      TYR 115  -2.090   6.162  -8.859
  880    HH   TYR 115           HH       TYR 115  -1.587   7.599  -5.807
  881    H    ASP 116           H        ASP 116  -5.321   1.793  -7.205
  882    HA   ASP 116           HA       ASP 116  -4.053   3.136  -4.866
  883   1HB   ASP 116          2HB       ASP 116  -6.125   1.390  -4.526
  884   2HB   ASP 116          1HB       ASP 116  -4.750   0.287  -4.480
  885    H    GLY 117           H        GLY 117  -2.238   3.201  -6.438
  886   1HA   GLY 117          2HA       GLY 117  -0.241   1.320  -5.971
  887   2HA   GLY 117          1HA       GLY 117  -1.072   0.732  -7.412
  888    H    TRP 118           H        TRP 118   0.635   3.552  -6.085
  889    HA   TRP 118           HA       TRP 118   1.243   4.352  -8.904
  890   1HB   TRP 118          2HB       TRP 118   1.000   6.579  -8.356
  891   2HB   TRP 118          1HB       TRP 118  -0.134   5.891  -7.195
  892    HD1  TRP 118           HD1      TRP 118   0.418   6.122  -4.676
  893    HE1  TRP 118           HE1      TRP 118   2.334   7.228  -3.351
  894    HE3  TRP 118           HE3      TRP 118   3.666   7.103  -8.487
  895    HZ2  TRP 118           HZ2      TRP 118   4.911   8.379  -3.849
  896    HZ3  TRP 118           HZ3      TRP 118   5.840   8.201  -8.038
  897    HH2  TRP 118           HH2      TRP 118   6.467   8.841  -5.726
  898    H    GLY 119           H        GLY 119   3.412   4.690  -9.412
  899   1HA   GLY 119          2HA       GLY 119   5.418   4.812  -7.264
  900   2HA   GLY 119          1HA       GLY 119   5.479   3.359  -8.260
  901    H    THR 120           H        THR 120   7.678   4.968  -8.301
  902    HA   THR 120           HA       THR 120   7.520   6.165 -11.030
  903    HB   THR 120           HB       THR 120   7.582   8.095  -9.651
  904    HG1  THR 120           HG1      THR 120  10.300   7.456 -10.134
  905   1HG2  THR 120          1HG2      THR 120   9.302   8.249  -7.777
  906   2HG2  THR 120          2HG2      THR 120   9.549   6.515  -7.985
  907   3HG2  THR 120          3HG2      THR 120   7.968   7.127  -7.499
  908    H    TYR 121           H        TYR 121   9.260   5.629 -12.340
  909    HA   TYR 121           HA       TYR 121  10.945   3.439 -11.547
  910   1HB   TYR 121          2HB       TYR 121  10.209   4.237 -13.935
  911   2HB   TYR 121          1HB       TYR 121  11.640   5.265 -13.834
  912    HD1  TYR 121           HD1      TYR 121  13.884   4.158 -13.255
  913    HD2  TYR 121           HD2      TYR 121  10.409   1.943 -14.468
  914    HE1  TYR 121           HE1      TYR 121  15.321   2.219 -13.828
  915    HE2  TYR 121           HE2      TYR 121  11.846   0.003 -15.040
  916    HH   TYR 121           HH       TYR 121  15.205   0.225 -15.325
  917    H    TYR 122           H        TYR 122  13.002   3.441 -10.704
  918    HA   TYR 122           HA       TYR 122  14.062   6.027  -9.765
  919   1HB   TYR 122          2HB       TYR 122  14.100   4.176  -8.191
  920   2HB   TYR 122          1HB       TYR 122  14.976   3.165  -9.340
  921    HD1  TYR 122           HD1      TYR 122  17.319   3.124  -9.299
  922    HD2  TYR 122           HD2      TYR 122  15.235   6.444  -7.543
  923    HE1  TYR 122           HE1      TYR 122  19.469   4.027  -8.456
  924    HE2  TYR 122           HE2      TYR 122  17.385   7.348  -6.700
  925    HH   TYR 122           HH       TYR 122  19.606   7.142  -6.740
  926    H    GLU 123           H        GLU 123  15.615   7.127 -10.868
  927    HA   GLU 123           HA       GLU 123  16.798   5.926 -13.268
  928   1HB   GLU 123          2HB       GLU 123  16.141   8.514 -12.515
  929   2HB   GLU 123          1HB       GLU 123  17.902   8.501 -12.409
  930   1HG   GLU 123          2HG       GLU 123  16.400   7.442 -14.813
  931   2HG   GLU 123          1HG       GLU 123  16.954   9.111 -14.691
  932    H    GLY 124           H        GLY 124  18.260   4.337 -12.586
  933   1HA   GLY 124          2HA       GLY 124  20.905   4.986 -12.032
  934   2HA   GLY 124          1HA       GLY 124  20.164   4.792 -10.444
  935    H    LEU 125           H        LEU 125  18.986   2.695 -10.085
  936    HA   LEU 125           HA       LEU 125  19.173   0.353  -9.948
  937   1HB   LEU 125          2HB       LEU 125  18.279   1.099 -12.478
  938   2HB   LEU 125          1HB       LEU 125  19.566  -0.057 -12.815
  939    HG   LEU 125           HG       LEU 125  18.450  -1.524 -10.996
  940   1HD1  LEU 125          1HD1      LEU 125  16.963   0.185 -10.080
  941   2HD1  LEU 125          2HD1      LEU 125  15.998  -1.110 -10.790
  942   3HD1  LEU 125          3HD1      LEU 125  16.210   0.411 -11.659
  943   1HD2  LEU 125          1HD2      LEU 125  16.472  -1.845 -12.906
  944   2HD2  LEU 125          2HD2      LEU 125  18.078  -2.571 -12.975
  945   3HD2  LEU 125          3HD2      LEU 125  17.761  -1.051 -13.811
  946    H    GLU 126           H        GLU 126  21.361   0.625  -8.975
  947    HA   GLU 126           HA       GLU 126  23.689   0.251  -8.914
  948   1HB   GLU 126          2HB       GLU 126  22.636  -1.932 -10.724
  949   2HB   GLU 126          1HB       GLU 126  24.315  -1.874 -10.190
  950   1HG   GLU 126          2HG       GLU 126  22.460  -1.477  -7.975
  951   2HG   GLU 126          1HG       GLU 126  22.191  -3.017  -8.791
  952    H    HIS 127           H        HIS 127  24.823   1.915  -9.866
  953    HA   HIS 127           HA       HIS 127  25.225   1.729 -12.826
  954   1HB   HIS 127          2HB       HIS 127  23.919   3.726 -12.280
  955   2HB   HIS 127          1HB       HIS 127  25.124   4.214 -11.088
  956    HD2  HIS 127           HD2      HIS 127  24.350   5.368 -14.462
  957    HE1  HIS 127           HE1      HIS 127  28.570   5.194 -14.517
  958    HE2  HIS 127           HE2      HIS 127  26.522   6.091 -15.714
  959    H    HIS 128           H        HIS 128  27.063   0.308 -12.159
  960    HA   HIS 128           HA       HIS 128  29.275   1.542 -10.692
  961   1HB   HIS 128          2HB       HIS 128  28.583  -1.013 -10.947
  962   2HB   HIS 128          1HB       HIS 128  29.639  -0.919 -12.357
  963    HD2  HIS 128           HD2      HIS 128  29.940  -1.171  -8.512
  964    HE1  HIS 128           HE1      HIS 128  33.809  -0.335  -9.983
  965    HE2  HIS 128           HE2      HIS 128  32.479  -1.023  -7.936
  966    H    HIS 129           H        HIS 129  29.520  -0.079 -13.853
  967    HA   HIS 129           HA       HIS 129  30.208   2.252 -15.360
  968   1HB   HIS 129          2HB       HIS 129  32.181   1.858 -13.611
  969   2HB   HIS 129          1HB       HIS 129  32.690   0.673 -14.814
  970    HD2  HIS 129           HD2      HIS 129  34.396   3.541 -14.480
  971    HE1  HIS 129           HE1      HIS 129  32.621   4.514 -18.187
  972    HE2  HIS 129           HE2      HIS 129  34.484   5.100 -16.570
  973    H    HIS 130           H        HIS 130  28.948  -0.533 -15.393
  974    HA   HIS 130           HA       HIS 130  30.196  -1.388 -17.973
  975   1HB   HIS 130          2HB       HIS 130  29.513  -3.739 -17.327
  976   2HB   HIS 130          1HB       HIS 130  30.810  -3.058 -16.346
  977    HD2  HIS 130           HD2      HIS 130  26.834  -3.259 -15.955
  978    HE1  HIS 130           HE1      HIS 130  28.641  -3.573 -12.151
  979    HE2  HIS 130           HE2      HIS 130  26.434  -3.584 -13.399
  980    H    HIS 131           H        HIS 131  27.524  -0.087 -16.553
  981    HA   HIS 131           HA       HIS 131  25.405  -1.592 -17.827
  982   1HB   HIS 131          2HB       HIS 131  25.173   0.004 -15.845
  983   2HB   HIS 131          1HB       HIS 131  25.293   1.321 -17.012
  984    HD2  HIS 131           HD2      HIS 131  22.692   2.119 -17.486
  985    HE1  HIS 131           HE1      HIS 131  20.917  -1.707 -17.716
  986    HE2  HIS 131           HE2      HIS 131  20.493   0.785 -17.925
  987    H    HIS 132           HN       HIS 132  24.337  -1.136 -19.791
  988    HA   HIS 132           HA       HIS 132  24.968   1.177 -21.408
  989   1HB   HIS 132          2HB       HIS 132  26.531  -1.324 -21.770
  990   2HB   HIS 132          1HB       HIS 132  25.917  -0.574 -23.244
  991    HD2  HIS 132           HD2      HIS 132  29.058  -0.319 -21.321
  992    HE1  HIS 132           HE1      HIS 132  28.374   3.654 -22.582
  993    HE2  HIS 132           HE2      HIS 132  30.091   2.059 -21.612
  Start of MODEL   18
    1   1H    MET   1          1H        MET   1 -21.472   9.922  -5.549
    2   2H    MET   1          2H        MET   1 -22.487   8.562  -5.653
    3   3H    MET   1          3H        MET   1 -22.618   9.625  -4.334
    4    HA   MET   1           HA       MET   1 -23.005  11.322  -6.359
    5   1HB   MET   1          2HB       MET   1 -24.437   8.767  -7.129
    6   2HB   MET   1          1HB       MET   1 -24.393  10.287  -8.021
    7   1HG   MET   1          2HG       MET   1 -22.178   9.971  -8.711
    8   2HG   MET   1          1HG       MET   1 -21.831   8.835  -7.406
    9   1HE   MET   1          1HE       MET   1 -20.660   8.220  -9.492
   10   2HE   MET   1          2HE       MET   1 -21.328   7.370 -10.883
   11   3HE   MET   1          3HE       MET   1 -20.987   6.484  -9.399
   12    H    SER   2           H        SER   2 -23.702  10.021  -3.587
   13    HA   SER   2           HA       SER   2 -26.629  10.598  -3.652
   14   1HB   SER   2          2HB       SER   2 -26.667   9.446  -1.440
   15   2HB   SER   2          1HB       SER   2 -26.063   8.409  -2.728
   16    HG   SER   2           HG       SER   2 -24.012   9.758  -1.747
   17    H    HIS   3           H        HIS   3 -25.270  12.896  -3.822
   18    HA   HIS   3           HA       HIS   3 -24.686  14.897  -2.712
   19   1HB   HIS   3          2HB       HIS   3 -27.109  14.915  -2.434
   20   2HB   HIS   3          1HB       HIS   3 -26.983  13.867  -1.020
   21    HD2  HIS   3           HD2      HIS   3 -27.603  15.640   1.034
   22    HE1  HIS   3           HE1      HIS   3 -24.911  18.710  -0.043
   23    HE2  HIS   3           HE2      HIS   3 -26.576  17.941   1.709
   24    H    GLN   4           H        GLN   4 -22.612  13.770  -2.026
   25    HA   GLN   4           HA       GLN   4 -22.319  12.580   0.551
   26   1HB   GLN   4          2HB       GLN   4 -20.270  14.186  -1.007
   27   2HB   GLN   4          1HB       GLN   4 -19.927  13.031   0.283
   28   1HG   GLN   4          2HG       GLN   4 -20.622  11.187  -1.024
   29   2HG   GLN   4          1HG       GLN   4 -21.468  12.216  -2.180
   30   1HE2  GLN   4          1HE2      GLN   4 -20.065  11.046  -3.837
   31   2HE2  GLN   4          2HE2      GLN   4 -18.488  11.615  -4.098
   32    H    ASP   5           H        ASP   5 -23.776  14.120   1.749
   33    HA   ASP   5           HA       ASP   5 -22.889  16.841   2.212
   34   1HB   ASP   5          2HB       ASP   5 -24.513  16.532   4.256
   35   2HB   ASP   5          1HB       ASP   5 -25.175  16.570   2.622
   36    H    ASP   6           H        ASP   6 -20.724  15.077   2.616
   37    HA   ASP   6           HA       ASP   6 -20.030  15.781   5.384
   38   1HB   ASP   6          2HB       ASP   6 -21.201  13.440   5.305
   39   2HB   ASP   6          1HB       ASP   6 -19.673  12.895   4.613
   40    H    TYR   7           H        TYR   7 -19.186  14.521   2.229
   41    HA   TYR   7           HA       TYR   7 -17.048  14.189   1.242
   42   1HB   TYR   7          2HB       TYR   7 -17.327  16.968   2.268
   43   2HB   TYR   7          1HB       TYR   7 -15.714  16.480   1.749
   44    HD1  TYR   7           HD1      TYR   7 -19.247  16.843   0.674
   45    HD2  TYR   7           HD2      TYR   7 -15.203  16.089  -0.563
   46    HE1  TYR   7           HE1      TYR   7 -19.920  17.122  -1.696
   47    HE2  TYR   7           HE2      TYR   7 -15.876  16.366  -2.933
   48    HH   TYR   7           HH       TYR   7 -19.264  17.075  -3.809
   49    H    LEU   8           H        LEU   8 -16.672  12.533   3.107
   50    HA   LEU   8           HA       LEU   8 -14.182  13.369   4.520
   51   1HB   LEU   8          2HB       LEU   8 -16.461  13.145   5.915
   52   2HB   LEU   8          1HB       LEU   8 -15.999  11.443   5.894
   53    HG   LEU   8           HG       LEU   8 -13.619  12.456   6.544
   54   1HD1  LEU   8          1HD1      LEU   8 -13.743  14.441   7.854
   55   2HD1  LEU   8          2HD1      LEU   8 -15.506  14.406   7.877
   56   3HD1  LEU   8          3HD1      LEU   8 -14.651  14.801   6.385
   57   1HD2  LEU   8          1HD2      LEU   8 -16.011  11.747   8.202
   58   2HD2  LEU   8          2HD2      LEU   8 -14.580  12.371   9.024
   59   3HD2  LEU   8          3HD2      LEU   8 -14.468  10.907   8.048
   60    H    SER   9           H        SER   9 -13.243  12.215   2.626
   61    HA   SER   9           HA       SER   9 -12.526   9.517   3.290
   62   1HB   SER   9          2HB       SER   9 -13.608   8.781   0.907
   63   2HB   SER   9          1HB       SER   9 -14.408   8.525   2.456
   64    HG   SER   9           HG       SER   9 -14.865  11.021   1.670
   65    H    VAL  10           H        VAL  10 -13.121  11.194   0.178
   66    HA   VAL  10           HA       VAL  10 -10.733  10.439  -1.084
   67    HB   VAL  10           HB       VAL  10 -11.011  12.494  -2.468
   68   1HG1  VAL  10          1HG1      VAL  10 -12.492  11.137  -3.494
   69   2HG1  VAL  10          2HG1      VAL  10 -13.755  11.929  -2.553
   70   3HG1  VAL  10          3HG1      VAL  10 -13.012  10.444  -1.957
   71   1HG2  VAL  10          1HG2      VAL  10 -13.355  13.148  -0.672
   72   2HG2  VAL  10          2HG2      VAL  10 -12.624  14.155  -1.922
   73   3HG2  VAL  10          3HG2      VAL  10 -11.761  13.857  -0.413
   74    H    GLU  11           H        GLU  11 -11.240  12.763   1.456
   75    HA   GLU  11           HA       GLU  11  -8.719  14.165   1.093
   76   1HB   GLU  11          2HB       GLU  11 -10.891  14.880   2.407
   77   2HB   GLU  11          1HB       GLU  11 -10.133  14.004   3.739
   78   1HG   GLU  11          2HG       GLU  11  -8.005  15.422   2.969
   79   2HG   GLU  11          1HG       GLU  11  -9.257  16.514   2.377
   80    H    GLU  12           H        GLU  12  -9.780  11.289   2.800
   81    HA   GLU  12           HA       GLU  12  -7.432  11.047   4.476
   82   1HB   GLU  12          2HB       GLU  12  -9.108   8.716   3.555
   83   2HB   GLU  12          1HB       GLU  12  -8.293   8.942   5.103
   84   1HG   GLU  12          2HG       GLU  12 -10.604  10.650   4.138
   85   2HG   GLU  12          1HG       GLU  12 -10.778   9.275   5.228
   86    H    LEU  13           H        LEU  13  -8.441   9.295   1.514
   87    HA   LEU  13           HA       LEU  13  -6.112   7.805   1.089
   88   1HB   LEU  13          2HB       LEU  13  -7.628   9.207  -1.127
   89   2HB   LEU  13          1HB       LEU  13  -6.737   7.688  -1.229
   90    HG   LEU  13           HG       LEU  13  -9.168   8.119   0.531
   91   1HD1  LEU  13          1HD1      LEU  13 -10.347   6.728  -1.153
   92   2HD1  LEU  13          2HD1      LEU  13  -8.904   6.759  -2.168
   93   3HD1  LEU  13          3HD1      LEU  13  -9.786   8.251  -1.842
   94   1HD2  LEU  13          1HD2      LEU  13  -7.838   6.353   1.420
   95   2HD2  LEU  13          2HD2      LEU  13  -7.446   5.738  -0.186
   96   3HD2  LEU  13          3HD2      LEU  13  -9.077   5.550   0.456
   97    H    ILE  14           H        ILE  14  -6.789  11.093  -0.151
   98    HA   ILE  14           HA       ILE  14  -4.270  11.549  -1.353
   99    HB   ILE  14           HB       ILE  14  -6.166  13.485   0.008
  100   1HG1  ILE  14          2HG1      ILE  14  -5.693  13.052  -2.947
  101   2HG1  ILE  14          1HG1      ILE  14  -6.882  12.105  -2.050
  102   1HG2  ILE  14          1HG2      ILE  14  -4.266  14.793  -0.083
  103   2HG2  ILE  14          2HG2      ILE  14  -4.850  15.032  -1.730
  104   3HG2  ILE  14          3HG2      ILE  14  -3.565  13.867  -1.410
  105   1HD1  ILE  14          1HD1      ILE  14  -8.181  13.887  -2.823
  106   2HD1  ILE  14          2HD1      ILE  14  -6.870  15.052  -2.639
  107   3HD1  ILE  14          3HD1      ILE  14  -7.718  14.449  -1.216
  108    H    GLU  15           H        GLU  15  -5.304  11.918   2.016
  109    HA   GLU  15           HA       GLU  15  -2.905  13.195   2.946
  110   1HB   GLU  15          2HB       GLU  15  -5.253  11.855   4.163
  111   2HB   GLU  15          1HB       GLU  15  -3.788  11.868   5.146
  112   1HG   GLU  15          2HG       GLU  15  -4.634  14.401   3.786
  113   2HG   GLU  15          1HG       GLU  15  -5.480  13.899   5.250
  114    H    ILE  16           H        ILE  16  -3.956   9.782   3.274
  115    HA   ILE  16           HA       ILE  16  -1.638   8.710   4.382
  116    HB   ILE  16           HB       ILE  16  -3.281   7.418   2.183
  117   1HG1  ILE  16          2HG1      ILE  16  -3.672   7.279   5.188
  118   2HG1  ILE  16          1HG1      ILE  16  -4.608   8.335   4.129
  119   1HG2  ILE  16          1HG2      ILE  16  -0.961   6.540   3.432
  120   2HG2  ILE  16          2HG2      ILE  16  -2.144   5.512   2.625
  121   3HG2  ILE  16          3HG2      ILE  16  -2.242   5.768   4.368
  122   1HD1  ILE  16          1HD1      ILE  16  -4.406   5.409   3.485
  123   2HD1  ILE  16          2HD1      ILE  16  -5.686   6.554   3.079
  124   3HD1  ILE  16          3HD1      ILE  16  -5.535   5.947   4.729
  125    H    GLN  17           H        GLN  17  -2.301   8.986   0.867
  126    HA   GLN  17           HA       GLN  17   0.331   8.157   0.086
  127   1HB   GLN  17          2HB       GLN  17  -2.043   8.727  -1.230
  128   2HB   GLN  17          1HB       GLN  17  -0.967  10.018  -1.765
  129   1HG   GLN  17          2HG       GLN  17  -0.791   8.054  -3.249
  130   2HG   GLN  17          1HG       GLN  17   0.729   8.345  -2.405
  131   1HE2  GLN  17          1HE2      GLN  17  -2.327   6.478  -1.890
  132   2HE2  GLN  17          2HE2      GLN  17  -1.554   5.127  -1.213
  133    H    LYS  18           H        LYS  18  -0.872  11.133   1.346
  134    HA   LYS  18           HA       LYS  18   1.044  12.922   0.159
  135   1HB   LYS  18          2HB       LYS  18  -1.114  13.445   1.550
  136   2HB   LYS  18          1HB       LYS  18  -0.039  13.307   2.942
  137   1HG   LYS  18          2HG       LYS  18   1.368  15.073   2.148
  138   2HG   LYS  18          1HG       LYS  18   0.586  15.073   0.566
  139   1HD   LYS  18          2HD       LYS  18  -1.082  15.568   3.010
  140   2HD   LYS  18          1HD       LYS  18  -0.088  16.879   2.371
  141   1HE   LYS  18          2HE       LYS  18  -1.172  16.756   0.224
  142   2HE   LYS  18          1HE       LYS  18  -2.013  15.272   0.672
  143   1HZ   LYS  18          1HZ       LYS  18  -2.732  16.962   2.638
  144   2HZ   LYS  18          2HZ       LYS  18  -3.657  16.645   1.248
  145   3HZ   LYS  18          3HZ       LYS  18  -2.648  18.010   1.307
  146    H    GLU  19           H        GLU  19   1.030  11.094   3.224
  147    HA   GLU  19           HA       GLU  19   3.682  12.008   3.983
  148   1HB   GLU  19          2HB       GLU  19   1.658  10.872   5.367
  149   2HB   GLU  19          1HB       GLU  19   2.645   9.442   5.068
  150   1HG   GLU  19          2HG       GLU  19   3.706  10.157   6.972
  151   2HG   GLU  19          1HG       GLU  19   4.587  11.155   5.815
  152    H    GLU  20           H        GLU  20   2.448   8.833   2.863
  153    HA   GLU  20           HA       GLU  20   4.933   7.536   2.610
  154   1HB   GLU  20          2HB       GLU  20   2.799   6.356   2.342
  155   2HB   GLU  20          1HB       GLU  20   2.476   7.247   0.855
  156   1HG   GLU  20          2HG       GLU  20   4.385   6.238  -0.239
  157   2HG   GLU  20          1HG       GLU  20   4.897   5.473   1.266
  158    H    THR  21           H        THR  21   3.210   9.520   0.191
  159    HA   THR  21           HA       THR  21   5.047   9.239  -1.935
  160    HB   THR  21           HB       THR  21   3.370  11.630  -1.122
  161    HG1  THR  21           HG1      THR  21   2.314  10.672  -3.152
  162   1HG2  THR  21          1HG2      THR  21   5.240  12.318  -2.574
  163   2HG2  THR  21          2HG2      THR  21   3.704  12.411  -3.435
  164   3HG2  THR  21          3HG2      THR  21   4.801  11.062  -3.733
  165    H    ARG  22           H        ARG  22   5.010  11.734   0.636
  166    HA   ARG  22           HA       ARG  22   7.330  13.128  -0.133
  167   1HB   ARG  22          2HB       ARG  22   5.669  12.953   2.203
  168   2HB   ARG  22          1HB       ARG  22   7.359  12.935   2.710
  169   1HG   ARG  22          2HG       ARG  22   7.689  14.915   1.103
  170   2HG   ARG  22          1HG       ARG  22   5.928  15.023   1.063
  171   1HD   ARG  22          2HD       ARG  22   6.529  14.784   3.775
  172   2HD   ARG  22          1HD       ARG  22   7.785  15.855   3.158
  173    HE   ARG  22           HE       ARG  22   5.202  16.716   3.711
  174   1HH1  ARG  22          1HH2      ARG  22   7.201  16.485   0.904
  175   2HH1  ARG  22          2HH2      ARG  22   6.392  17.765   0.068
  176   1HH2  ARG  22          2HH1      ARG  22   4.148  18.388   2.631
  177   2HH2  ARG  22          1HH1      ARG  22   4.669  18.842   1.042
  178    H    ASP  23           H        ASP  23   7.064  10.200   1.890
  179    HA   ASP  23           HA       ASP  23   9.820   9.957   2.532
  180   1HB   ASP  23          2HB       ASP  23   8.315   8.536   3.698
  181   2HB   ASP  23          1HB       ASP  23   7.618   7.915   2.201
  182    H    ILE  24           H        ILE  24   7.991   8.572  -0.212
  183    HA   ILE  24           HA       ILE  24  10.168   7.221  -1.429
  184    HB   ILE  24           HB       ILE  24   7.751   8.537  -2.703
  185   1HG1  ILE  24          2HG1      ILE  24   8.293   5.636  -2.001
  186   2HG1  ILE  24          1HG1      ILE  24   7.336   6.730  -1.002
  187   1HG2  ILE  24          1HG2      ILE  24   8.996   8.176  -4.593
  188   2HG2  ILE  24          2HG2      ILE  24   8.434   6.519  -4.373
  189   3HG2  ILE  24          3HG2      ILE  24  10.036   6.990  -3.804
  190   1HD1  ILE  24          1HD1      ILE  24   6.508   5.244  -3.317
  191   2HD1  ILE  24          2HD1      ILE  24   6.354   6.967  -3.659
  192   3HD1  ILE  24          3HD1      ILE  24   5.533   6.268  -2.263
  193    H    ILE  25           H        ILE  25   8.805  10.330  -2.585
  194    HA   ILE  25           HA       ILE  25  10.870  11.079  -4.283
  195    HB   ILE  25           HB       ILE  25   9.039  12.680  -2.515
  196   1HG1  ILE  25          2HG1      ILE  25   8.082  13.338  -4.639
  197   2HG1  ILE  25          1HG1      ILE  25   9.432  12.622  -5.521
  198   1HG2  ILE  25          1HG2      ILE  25  10.975  14.070  -2.489
  199   2HG2  ILE  25          2HG2      ILE  25   9.964  14.709  -3.785
  200   3HG2  ILE  25          3HG2      ILE  25  11.357  13.696  -4.171
  201   1HD1  ILE  25          1HD1      ILE  25   8.770  10.412  -4.967
  202   2HD1  ILE  25          2HD1      ILE  25   7.268  11.235  -5.389
  203   3HD1  ILE  25          3HD1      ILE  25   7.682  10.972  -3.696
  204    H    GLN  26           H        GLN  26  10.728  11.586  -0.756
  205    HA   GLN  26           HA       GLN  26  13.084  13.058  -0.396
  206   1HB   GLN  26          2HB       GLN  26  11.725  10.951   1.275
  207   2HB   GLN  26          1HB       GLN  26  13.248  11.666   1.807
  208   1HG   GLN  26          2HG       GLN  26  11.093  13.518   0.884
  209   2HG   GLN  26          1HG       GLN  26  10.900  12.755   2.462
  210   1HE2  GLN  26          1HE2      GLN  26  14.187  13.202   1.451
  211   2HE2  GLN  26          2HE2      GLN  26  14.524  14.552   2.421
  212    H    ALA  27           H        ALA  27  12.925   9.500   0.008
  213    HA   ALA  27           HA       ALA  27  15.587   8.867   0.114
  214   1HB   ALA  27          1HB       ALA  27  13.623   7.250   0.007
  215   2HB   ALA  27          2HB       ALA  27  15.076   6.731  -0.848
  216   3HB   ALA  27          3HB       ALA  27  13.712   7.392  -1.749
  217    H    LEU  28           H        LEU  28  13.799   9.584  -2.892
  218    HA   LEU  28           HA       LEU  28  16.041   9.219  -4.641
  219   1HB   LEU  28          2HB       LEU  28  13.746  11.134  -5.106
  220   2HB   LEU  28          1HB       LEU  28  14.709  10.286  -6.317
  221    HG   LEU  28           HG       LEU  28  12.742   9.068  -4.361
  222   1HD1  LEU  28          1HD1      LEU  28  12.844   8.938  -7.385
  223   2HD1  LEU  28          2HD1      LEU  28  11.909  10.144  -6.502
  224   3HD1  LEU  28          3HD1      LEU  28  11.522   8.432  -6.334
  225   1HD2  LEU  28          1HD2      LEU  28  13.399   6.934  -5.682
  226   2HD2  LEU  28          2HD2      LEU  28  14.507   7.494  -4.430
  227   3HD2  LEU  28          3HD2      LEU  28  14.854   7.827  -6.126
  228    H    LEU  29           H        LEU  29  14.943  11.954  -2.707
  229    HA   LEU  29           HA       LEU  29  16.667  13.901  -3.972
  230   1HB   LEU  29          2HB       LEU  29  14.788  13.828  -1.756
  231   2HB   LEU  29          1HB       LEU  29  16.239  14.735  -1.328
  232    HG   LEU  29           HG       LEU  29  16.000  16.152  -3.284
  233   1HD1  LEU  29          1HD1      LEU  29  15.027  15.258  -5.112
  234   2HD1  LEU  29          2HD1      LEU  29  13.470  15.504  -4.321
  235   3HD1  LEU  29          3HD1      LEU  29  14.307  13.959  -4.159
  236   1HD2  LEU  29          1HD2      LEU  29  13.282  15.836  -1.972
  237   2HD2  LEU  29          2HD2      LEU  29  13.938  17.298  -2.708
  238   3HD2  LEU  29          3HD2      LEU  29  14.647  16.664  -1.223
  239    H    GLU  30           H        GLU  30  16.920  12.180  -0.833
  240    HA   GLU  30           HA       GLU  30  19.549  13.090  -0.225
  241   1HB   GLU  30          2HB       GLU  30  18.051  11.959   1.410
  242   2HB   GLU  30          1HB       GLU  30  18.278  10.443   0.538
  243   1HG   GLU  30          2HG       GLU  30  20.411  10.153   1.316
  244   2HG   GLU  30          1HG       GLU  30  20.757  11.883   1.312
  245    H    ASP  31           H        ASP  31  18.424  10.801  -2.540
  246    HA   ASP  31           HA       ASP  31  20.947   9.330  -2.732
  247   1HB   ASP  31          2HB       ASP  31  18.642   8.416  -3.343
  248   2HB   ASP  31          1HB       ASP  31  18.729   9.424  -4.787
  249    H    GLY  32           H        GLY  32  19.454  12.112  -4.276
  250   1HA   GLY  32          2HA       GLY  32  21.247  13.721  -5.151
  251   2HA   GLY  32          1HA       GLY  32  21.846  12.331  -6.058
  252    H    SER  33           H        SER  33  18.438  12.461  -5.714
  253    HA   SER  33           HA       SER  33  18.026  12.646  -8.554
  254   1HB   SER  33          2HB       SER  33  16.413  11.491  -7.123
  255   2HB   SER  33          1HB       SER  33  16.083  12.984  -6.248
  256    HG   SER  33           HG       SER  33  15.431  12.261  -8.892
  257    H    ASP  34           H        ASP  34  17.777  14.437  -9.819
  258    HA   ASP  34           HA       ASP  34  17.738  17.077  -8.440
  259   1HB   ASP  34          2HB       ASP  34  18.241  16.663 -11.385
  260   2HB   ASP  34          1HB       ASP  34  18.773  17.990 -10.350
  261    HA   PRO  35           HA       PRO  35  13.559  17.689  -9.759
  262   1HB   PRO  35          2HB       PRO  35  13.477  20.426  -9.744
  263   2HB   PRO  35          1HB       PRO  35  13.462  19.440  -8.270
  264   1HG   PRO  35          2HG       PRO  35  15.704  20.930  -9.528
  265   2HG   PRO  35          1HG       PRO  35  15.319  20.700  -7.814
  266   1HD   PRO  35          2HD       PRO  35  17.275  19.281  -9.128
  267   2HD   PRO  35          1HD       PRO  35  16.405  18.669  -7.705
  268    H    ASP  36           H        ASP  36  16.225  18.716 -11.643
  269    HA   ASP  36           HA       ASP  36  14.461  19.646 -13.855
  270   1HB   ASP  36          2HB       ASP  36  16.538  20.426 -14.917
  271   2HB   ASP  36          1HB       ASP  36  16.414  21.060 -13.275
  272    H    ALA  37           H        ALA  37  15.631  16.789 -12.748
  273    HA   ALA  37           HA       ALA  37  16.588  15.663 -15.276
  274   1HB   ALA  37          1HB       ALA  37  17.181  14.928 -12.836
  275   2HB   ALA  37          2HB       ALA  37  16.972  13.688 -14.072
  276   3HB   ALA  37          3HB       ALA  37  15.672  14.019 -12.928
  277    H    LEU  38           H        LEU  38  13.538  15.997 -13.618
  278    HA   LEU  38           HA       LEU  38  11.369  15.558 -14.432
  279   1HB   LEU  38          2HB       LEU  38  12.927  15.675 -16.751
  280   2HB   LEU  38          1HB       LEU  38  12.091  14.126 -16.866
  281    HG   LEU  38           HG       LEU  38   9.951  15.384 -16.268
  282   1HD1  LEU  38          1HD1      LEU  38  10.686  17.430 -15.371
  283   2HD1  LEU  38          2HD1      LEU  38  10.180  17.877 -17.000
  284   3HD1  LEU  38          3HD1      LEU  38  11.892  17.659 -16.637
  285   1HD2  LEU  38          1HD2      LEU  38  11.023  14.790 -18.663
  286   2HD2  LEU  38          2HD2      LEU  38  10.997  16.548 -18.808
  287   3HD2  LEU  38          3HD2      LEU  38   9.499  15.666 -18.510
  288    H    TYR  39           H        TYR  39  10.022  13.785 -14.069
  289    HA   TYR  39           HA       TYR  39  11.362  11.113 -13.946
  290   1HB   TYR  39          2HB       TYR  39   9.735  12.565 -11.903
  291   2HB   TYR  39          1HB       TYR  39   9.527  10.818 -12.024
  292    HD1  TYR  39           HD1      TYR  39  12.147  13.467 -11.714
  293    HD2  TYR  39           HD2      TYR  39  11.095   9.356 -11.051
  294    HE1  TYR  39           HE1      TYR  39  14.261  13.128 -10.464
  295    HE2  TYR  39           HE2      TYR  39  13.210   9.016  -9.801
  296    HH   TYR  39           HH       TYR  39  14.834  10.477  -8.506
  297    H    GLU  40           H        GLU  40   9.739   9.294 -14.031
  298    HA   GLU  40           HA       GLU  40   7.471  10.051 -15.827
  299   1HB   GLU  40          2HB       GLU  40   8.261   7.214 -15.732
  300   2HB   GLU  40          1HB       GLU  40   7.955   8.249 -17.126
  301   1HG   GLU  40          2HG       GLU  40  10.210   9.386 -16.479
  302   2HG   GLU  40          1HG       GLU  40  10.500   7.913 -15.553
  303    H    ILE  41           H        ILE  41   5.759  10.261 -14.397
  304    HA   ILE  41           HA       ILE  41   5.415   8.488 -12.120
  305    HB   ILE  41           HB       ILE  41   3.303  10.249 -13.384
  306   1HG1  ILE  41          2HG1      ILE  41   5.140  11.725 -13.104
  307   2HG1  ILE  41          1HG1      ILE  41   4.192  11.928 -11.631
  308   1HG2  ILE  41          1HG2      ILE  41   2.327   8.946 -11.680
  309   2HG2  ILE  41          2HG2      ILE  41   2.755  10.441 -10.849
  310   3HG2  ILE  41          3HG2      ILE  41   3.774   9.012 -10.675
  311   1HD1  ILE  41          1HD1      ILE  41   6.475  11.686 -10.937
  312   2HD1  ILE  41          2HD1      ILE  41   6.713  10.292 -11.990
  313   3HD1  ILE  41          3HD1      ILE  41   5.678  10.157 -10.569
  314    H    GLU  42           H        GLU  42   4.358   6.549 -12.082
  315    HA   GLU  42           HA       GLU  42   2.746   5.818 -14.494
  316   1HB   GLU  42          2HB       GLU  42   3.483   3.418 -13.885
  317   2HB   GLU  42          1HB       GLU  42   4.687   4.465 -14.637
  318   1HG   GLU  42          2HG       GLU  42   5.710   4.945 -12.511
  319   2HG   GLU  42          1HG       GLU  42   4.398   4.153 -11.638
  320    H    HIS  43           H        HIS  43   0.641   5.587 -13.933
  321    HA   HIS  43           HA       HIS  43  -0.001   4.848 -11.115
  322   1HB   HIS  43          2HB       HIS  43  -1.697   6.102 -13.295
  323   2HB   HIS  43          1HB       HIS  43  -2.293   5.676 -11.691
  324    HD2  HIS  43           HD2      HIS  43  -1.047   8.780 -13.298
  325    HE1  HIS  43           HE1      HIS  43   0.369   9.076  -9.330
  326    HE2  HIS  43           HE2      HIS  43  -0.027  10.354 -11.486
  327    H    HIS  44           H        HIS  44  -1.662   3.211 -10.755
  328    HA   HIS  44           HA       HIS  44  -2.139   1.417 -13.094
  329   1HB   HIS  44          2HB       HIS  44  -0.473   0.860 -10.845
  330   2HB   HIS  44          1HB       HIS  44  -1.913  -0.148 -10.698
  331    HD2  HIS  44           HD2      HIS  44  -2.317  -0.723 -13.979
  332    HE1  HIS  44           HE1      HIS  44   1.569  -2.359 -13.716
  333    HE2  HIS  44           HE2      HIS  44  -0.541  -2.257 -15.121
  334    H    LEU  45           H        LEU  45  -4.328   1.697 -13.323
  335    HA   LEU  45           HA       LEU  45  -6.003   1.410 -10.859
  336   1HB   LEU  45          2HB       LEU  45  -6.657   2.826 -13.463
  337   2HB   LEU  45          1HB       LEU  45  -7.738   2.686 -12.077
  338    HG   LEU  45           HG       LEU  45  -5.482   3.673 -10.888
  339   1HD1  LEU  45          1HD1      LEU  45  -4.539   5.402 -12.275
  340   2HD1  LEU  45          2HD1      LEU  45  -5.722   5.101 -13.549
  341   3HD1  LEU  45          3HD1      LEU  45  -4.474   3.903 -13.202
  342   1HD2  LEU  45          1HD2      LEU  45  -6.687   5.903 -11.047
  343   2HD2  LEU  45          2HD2      LEU  45  -7.684   4.562 -10.483
  344   3HD2  LEU  45          3HD2      LEU  45  -7.826   5.125 -12.147
  345    H    PHE  46           H        PHE  46  -7.909   0.077 -11.059
  346    HA   PHE  46           HA       PHE  46  -7.986  -1.630 -13.506
  347   1HB   PHE  46          2HB       PHE  46  -8.675  -3.445 -11.642
  348   2HB   PHE  46          1HB       PHE  46  -7.003  -3.202 -12.148
  349    HD1  PHE  46           HD1      PHE  46  -5.696  -1.299 -10.869
  350    HD2  PHE  46           HD2      PHE  46  -9.205  -3.273  -9.370
  351    HE1  PHE  46           HE1      PHE  46  -5.090  -0.622  -8.561
  352    HE2  PHE  46           HE2      PHE  46  -8.599  -2.596  -7.061
  353    HZ   PHE  46           HZ       PHE  46  -6.541  -1.270  -6.657
  354    H    ALA  47           H        ALA  47 -10.087  -2.818 -13.694
  355    HA   ALA  47           HA       ALA  47 -12.329  -1.680 -12.138
  356   1HB   ALA  47          1HB       ALA  47 -13.485  -0.768 -13.992
  357   2HB   ALA  47          2HB       ALA  47 -12.437  -1.584 -15.153
  358   3HB   ALA  47          3HB       ALA  47 -11.822  -0.222 -14.217
  359    H    GLU  48           H        GLU  48 -14.463  -2.756 -13.098
  360    HA   GLU  48           HA       GLU  48 -13.794  -5.627 -13.602
  361   1HB   GLU  48          2HB       GLU  48 -14.974  -5.048 -11.432
  362   2HB   GLU  48          1HB       GLU  48 -16.354  -4.538 -12.405
  363   1HG   GLU  48          2HG       GLU  48 -15.626  -7.061 -13.417
  364   2HG   GLU  48          1HG       GLU  48 -15.539  -7.220 -11.663
  365    H    ASP  49           H        ASP  49 -15.688  -2.869 -14.644
  366    HA   ASP  49           HA       ASP  49 -17.009  -4.523 -16.733
  367   1HB   ASP  49          2HB       ASP  49 -17.561  -1.912 -15.434
  368   2HB   ASP  49          1HB       ASP  49 -17.963  -2.017 -17.148
  369    H    PHE  50           H        PHE  50 -15.474  -4.841 -18.338
  370    HA   PHE  50           HA       PHE  50 -13.373  -3.261 -19.165
  371   1HB   PHE  50          2HB       PHE  50 -13.780  -5.376 -20.252
  372   2HB   PHE  50          1HB       PHE  50 -15.325  -4.811 -20.888
  373    HD1  PHE  50           HD1      PHE  50 -15.450  -3.549 -22.904
  374    HD2  PHE  50           HD2      PHE  50 -11.643  -4.289 -21.059
  375    HE1  PHE  50           HE1      PHE  50 -14.304  -2.662 -24.915
  376    HE2  PHE  50           HE2      PHE  50 -10.495  -3.401 -23.072
  377    HZ   PHE  50           HZ       PHE  50 -11.827  -2.588 -25.000
  378    H    ASP  51           H        ASP  51 -16.787  -2.835 -20.094
  379    HA   ASP  51           HA       ASP  51 -16.464  -0.700 -21.914
  380   1HB   ASP  51          2HB       ASP  51 -18.754  -0.459 -20.055
  381   2HB   ASP  51          1HB       ASP  51 -18.738  -0.540 -21.818
  382    H    LYS  52           H        LYS  52 -17.285  -0.396 -18.436
  383    HA   LYS  52           HA       LYS  52 -16.888   2.405 -18.281
  384   1HB   LYS  52          2HB       LYS  52 -17.936   0.920 -16.515
  385   2HB   LYS  52          1HB       LYS  52 -16.305   0.426 -16.061
  386   1HG   LYS  52          2HG       LYS  52 -16.536   2.205 -14.617
  387   2HG   LYS  52          1HG       LYS  52 -15.940   3.083 -16.026
  388   1HD   LYS  52          2HD       LYS  52 -17.879   4.272 -15.278
  389   2HD   LYS  52          1HD       LYS  52 -18.376   3.378 -16.717
  390   1HE   LYS  52          2HE       LYS  52 -18.671   1.815 -14.258
  391   2HE   LYS  52          1HE       LYS  52 -19.643   3.287 -14.253
  392   1HZ   LYS  52          1HZ       LYS  52 -20.874   1.500 -15.253
  393   2HZ   LYS  52          2HZ       LYS  52 -19.622   1.195 -16.360
  394   3HZ   LYS  52          3HZ       LYS  52 -20.499   2.647 -16.445
  395    H    LEU  53           H        LEU  53 -14.597  -0.187 -18.497
  396    HA   LEU  53           HA       LEU  53 -12.342   1.182 -17.332
  397   1HB   LEU  53          2HB       LEU  53 -12.633  -1.344 -17.919
  398   2HB   LEU  53          1HB       LEU  53 -12.091  -0.865 -19.528
  399    HG   LEU  53           HG       LEU  53 -10.549  -0.054 -17.067
  400   1HD1  LEU  53          1HD1      LEU  53  -9.289  -2.046 -17.108
  401   2HD1  LEU  53          2HD1      LEU  53  -9.889  -2.498 -18.703
  402   3HD1  LEU  53          3HD1      LEU  53 -10.949  -2.612 -17.298
  403   1HD2  LEU  53          1HD2      LEU  53  -9.885   1.116 -19.042
  404   2HD2  LEU  53          2HD2      LEU  53  -9.973  -0.347 -20.024
  405   3HD2  LEU  53          3HD2      LEU  53  -8.689  -0.162 -18.828
  406    H    GLU  54           H        GLU  54 -13.282   0.644 -20.749
  407    HA   GLU  54           HA       GLU  54 -11.244   2.328 -21.842
  408   1HB   GLU  54          2HB       GLU  54 -13.796   1.138 -22.818
  409   2HB   GLU  54          1HB       GLU  54 -13.151   2.503 -23.730
  410   1HG   GLU  54          2HG       GLU  54 -11.384   0.189 -22.945
  411   2HG   GLU  54          1HG       GLU  54 -12.371   0.122 -24.405
  412    H    LYS  55           H        LYS  55 -14.300   3.025 -20.333
  413    HA   LYS  55           HA       LYS  55 -14.675   5.662 -21.442
  414   1HB   LYS  55          2HB       LYS  55 -15.720   4.213 -19.018
  415   2HB   LYS  55          1HB       LYS  55 -16.039   5.935 -19.228
  416   1HG   LYS  55          2HG       LYS  55 -16.890   5.371 -21.559
  417   2HG   LYS  55          1HG       LYS  55 -16.821   3.675 -21.080
  418   1HD   LYS  55          2HD       LYS  55 -18.361   4.087 -19.236
  419   2HD   LYS  55          1HD       LYS  55 -18.368   5.815 -19.592
  420   1HE   LYS  55          2HE       LYS  55 -20.348   4.950 -20.604
  421   2HE   LYS  55          1HE       LYS  55 -19.205   5.185 -21.927
  422   1HZ   LYS  55          1HZ       LYS  55 -20.416   2.986 -21.850
  423   2HZ   LYS  55          2HZ       LYS  55 -19.456   2.604 -20.500
  424   3HZ   LYS  55          3HZ       LYS  55 -18.728   2.909 -22.005
  425    H    ALA  56           H        ALA  56 -13.581   4.688 -18.166
  426    HA   ALA  56           HA       ALA  56 -12.635   7.272 -17.430
  427   1HB   ALA  56          1HB       ALA  56 -13.002   5.247 -15.911
  428   2HB   ALA  56          2HB       ALA  56 -11.544   6.188 -15.600
  429   3HB   ALA  56          3HB       ALA  56 -11.438   4.662 -16.477
  430    H    ALA  57           H        ALA  57 -10.893   4.479 -18.827
  431    HA   ALA  57           HA       ALA  57  -8.322   5.658 -18.929
  432   1HB   ALA  57          1HB       ALA  57  -7.733   3.916 -20.367
  433   2HB   ALA  57          2HB       ALA  57  -9.297   3.928 -21.184
  434   3HB   ALA  57          3HB       ALA  57  -9.152   3.240 -19.567
  435    H    VAL  58           H        VAL  58 -10.918   5.688 -21.390
  436    HA   VAL  58           HA       VAL  58  -9.594   7.246 -23.338
  437    HB   VAL  58           HB       VAL  58 -12.495   6.962 -22.565
  438   1HG1  VAL  58          1HG1      VAL  58 -11.246   8.830 -24.577
  439   2HG1  VAL  58          2HG1      VAL  58 -12.506   9.173 -23.391
  440   3HG1  VAL  58          3HG1      VAL  58 -12.875   8.197 -24.813
  441   1HG2  VAL  58          1HG2      VAL  58 -12.609   5.521 -24.377
  442   2HG2  VAL  58          2HG2      VAL  58 -10.929   5.273 -23.905
  443   3HG2  VAL  58          3HG2      VAL  58 -11.318   6.349 -25.249
  444    H    GLU  59           H        GLU  59 -11.589   8.314 -20.577
  445    HA   GLU  59           HA       GLU  59 -11.315  11.118 -21.079
  446   1HB   GLU  59          2HB       GLU  59 -12.686   9.576 -19.250
  447   2HB   GLU  59          1HB       GLU  59 -11.455  10.339 -18.243
  448   1HG   GLU  59          2HG       GLU  59 -13.153  11.912 -20.191
  449   2HG   GLU  59          1HG       GLU  59 -13.637  11.642 -18.517
  450    H    ALA  60           H        ALA  60  -9.291   8.787 -19.360
  451    HA   ALA  60           HA       ALA  60  -7.532  10.747 -18.177
  452   1HB   ALA  60          1HB       ALA  60  -7.614   7.814 -18.478
  453   2HB   ALA  60          2HB       ALA  60  -7.100   8.790 -17.101
  454   3HB   ALA  60          3HB       ALA  60  -5.986   8.493 -18.437
  455    H    PHE  61           H        PHE  61  -6.844   8.449 -20.848
  456    HA   PHE  61           HA       PHE  61  -4.497   9.497 -21.816
  457   1HB   PHE  61          2HB       PHE  61  -5.696   7.591 -22.864
  458   2HB   PHE  61          1HB       PHE  61  -6.860   8.723 -23.555
  459    HD1  PHE  61           HD1      PHE  61  -6.485   9.432 -25.740
  460    HD2  PHE  61           HD2      PHE  61  -3.134   8.313 -23.297
  461    HE1  PHE  61           HE1      PHE  61  -4.956   9.841 -27.649
  462    HE2  PHE  61           HE2      PHE  61  -1.606   8.721 -25.206
  463    HZ   PHE  61           HZ       PHE  61  -2.516   9.486 -27.382
  464    H    LYS  62           H        LYS  62  -7.739  10.849 -22.317
  465    HA   LYS  62           HA       LYS  62  -6.931  12.953 -24.092
  466   1HB   LYS  62          2HB       LYS  62  -9.321  12.098 -23.476
  467   2HB   LYS  62          1HB       LYS  62  -9.203  13.240 -22.136
  468   1HG   LYS  62          2HG       LYS  62  -8.777  15.076 -23.695
  469   2HG   LYS  62          1HG       LYS  62  -8.797  13.953 -25.056
  470   1HD   LYS  62          2HD       LYS  62 -11.163  14.050 -23.214
  471   2HD   LYS  62          1HD       LYS  62 -10.975  15.308 -24.435
  472   1HE   LYS  62          2HE       LYS  62 -11.131  13.788 -26.214
  473   2HE   LYS  62          1HE       LYS  62 -10.705  12.411 -25.198
  474   1HZ   LYS  62          1HZ       LYS  62 -13.187  12.939 -25.901
  475   2HZ   LYS  62          2HZ       LYS  62 -13.119  13.885 -24.491
  476   3HZ   LYS  62          3HZ       LYS  62 -12.802  12.217 -24.416
  477    H    MET  63           H        MET  63  -7.386  12.866 -20.549
  478    HA   MET  63           HA       MET  63  -6.860  15.510 -19.884
  479   1HB   MET  63          2HB       MET  63  -7.212  13.388 -18.371
  480   2HB   MET  63          1HB       MET  63  -5.449  13.337 -18.361
  481   1HG   MET  63          2HG       MET  63  -5.699  14.759 -16.586
  482   2HG   MET  63          1HG       MET  63  -5.835  15.970 -17.860
  483   1HE   MET  63          1HE       MET  63  -8.556  13.147 -16.630
  484   2HE   MET  63          2HE       MET  63  -9.022  14.102 -15.226
  485   3HE   MET  63          3HE       MET  63  -7.334  13.652 -15.456
  486    H    GLY  64           H        GLY  64  -4.474  12.992 -20.687
  487   1HA   GLY  64          2HA       GLY  64  -2.614  14.183 -22.136
  488   2HA   GLY  64          1HA       GLY  64  -2.331  15.052 -20.627
  489    H    PHE  65           H        PHE  65  -3.413  11.925 -20.002
  490    HA   PHE  65           HA       PHE  65  -0.668  11.117 -19.229
  491   1HB   PHE  65          2HB       PHE  65  -3.416  10.030 -18.569
  492   2HB   PHE  65          1HB       PHE  65  -1.927   9.216 -18.089
  493    HD1  PHE  65           HD1      PHE  65  -3.284  12.723 -18.096
  494    HD2  PHE  65           HD2      PHE  65  -1.187   9.660 -15.935
  495    HE1  PHE  65           HE1      PHE  65  -3.082  14.238 -16.143
  496    HE2  PHE  65           HE2      PHE  65  -0.985  11.175 -13.981
  497    HZ   PHE  65           HZ       PHE  65  -1.933  13.465 -14.087
  498    H    GLU  66           H        GLU  66  -0.051   8.800 -19.666
  499    HA   GLU  66           HA       GLU  66  -0.953   8.035 -22.407
  500   1HB   GLU  66          2HB       GLU  66   1.633   8.238 -21.172
  501   2HB   GLU  66          1HB       GLU  66   1.352   6.555 -21.622
  502   1HG   GLU  66          2HG       GLU  66   2.322   7.595 -23.546
  503   2HG   GLU  66          1HG       GLU  66   0.602   7.427 -23.900
  504    H    VAL  67           H        VAL  67  -2.750   6.745 -21.873
  505    HA   VAL  67           HA       VAL  67  -2.831   4.838 -19.753
  506    HB   VAL  67           HB       VAL  67  -4.831   5.661 -21.002
  507   1HG1  VAL  67          1HG1      VAL  67  -3.790   5.544 -23.262
  508   2HG1  VAL  67          2HG1      VAL  67  -5.338   4.701 -23.195
  509   3HG1  VAL  67          3HG1      VAL  67  -3.833   3.783 -23.166
  510   1HG2  VAL  67          1HG2      VAL  67  -5.777   3.227 -21.375
  511   2HG2  VAL  67          2HG2      VAL  67  -5.344   3.758 -19.751
  512   3HG2  VAL  67          3HG2      VAL  67  -4.239   2.734 -20.668
  513    H    LEU  68           H        LEU  68  -2.058   2.765 -19.608
  514    HA   LEU  68           HA       LEU  68  -0.649   1.685 -22.014
  515   1HB   LEU  68          2HB       LEU  68   0.233   2.064 -19.341
  516   2HB   LEU  68          1HB       LEU  68   0.071   0.323 -19.577
  517    HG   LEU  68           HG       LEU  68   1.484   2.096 -21.578
  518   1HD1  LEU  68          1HD1      LEU  68   3.584   1.116 -20.478
  519   2HD1  LEU  68          2HD1      LEU  68   2.547   0.705 -19.113
  520   3HD1  LEU  68          3HD1      LEU  68   2.756   2.391 -19.585
  521   1HD2  LEU  68          1HD2      LEU  68   0.750  -0.692 -21.415
  522   2HD2  LEU  68          2HD2      LEU  68   2.507  -0.547 -21.443
  523   3HD2  LEU  68          3HD2      LEU  68   1.543   0.164 -22.737
  524    H    GLU  69           H        GLU  69  -1.135  -0.415 -22.676
  525    HA   GLU  69           HA       GLU  69  -3.654  -1.506 -22.319
  526   1HB   GLU  69          2HB       GLU  69  -1.039  -2.984 -22.747
  527   2HB   GLU  69          1HB       GLU  69  -2.633  -3.716 -22.940
  528   1HG   GLU  69          2HG       GLU  69  -2.050  -1.157 -24.384
  529   2HG   GLU  69          1HG       GLU  69  -1.381  -2.659 -25.023
  530    H    ALA  70           H        ALA  70  -4.414  -3.354 -21.030
  531    HA   ALA  70           HA       ALA  70  -3.246  -3.286 -18.296
  532   1HB   ALA  70          1HB       ALA  70  -5.378  -4.150 -17.537
  533   2HB   ALA  70          2HB       ALA  70  -5.891  -4.461 -19.195
  534   3HB   ALA  70          3HB       ALA  70  -5.695  -2.802 -18.629
  535    H    GLU  71           H        GLU  71  -3.650  -5.562 -17.145
  536    HA   GLU  71           HA       GLU  71  -3.000  -7.790 -18.993
  537   1HB   GLU  71          2HB       GLU  71  -0.835  -6.793 -18.243
  538   2HB   GLU  71          1HB       GLU  71  -1.305  -7.108 -16.572
  539   1HG   GLU  71          2HG       GLU  71  -0.934  -9.355 -16.751
  540   2HG   GLU  71          1HG       GLU  71  -1.514  -9.419 -18.415
  541    H    GLU  72           H        GLU  72  -4.695  -9.118 -18.483
  542    HA   GLU  72           HA       GLU  72  -6.284  -9.297 -16.275
  543   1HB   GLU  72          2HB       GLU  72  -5.068 -11.782 -17.511
  544   2HB   GLU  72          1HB       GLU  72  -6.657 -11.625 -16.763
  545   1HG   GLU  72          2HG       GLU  72  -7.077  -9.802 -18.576
  546   2HG   GLU  72          1HG       GLU  72  -5.707 -10.541 -19.408
  547    H    THR  73           H        THR  73  -5.240  -8.740 -14.320
  548    HA   THR  73           HA       THR  73  -3.192 -10.688 -13.350
  549    HB   THR  73           HB       THR  73  -2.408  -8.355 -13.434
  550    HG1  THR  73           HG1      THR  73  -2.675  -8.458 -10.760
  551   1HG2  THR  73          1HG2      THR  73  -4.257  -7.502 -11.279
  552   2HG2  THR  73          2HG2      THR  73  -4.969  -7.663 -12.885
  553   3HG2  THR  73          3HG2      THR  73  -3.600  -6.580 -12.631
  554    H    GLU  74           H        GLU  74  -3.429 -10.032 -10.605
  555    HA   GLU  74           HA       GLU  74  -6.199 -10.337  -9.751
  556   1HB   GLU  74          2HB       GLU  74  -5.817 -12.602  -8.724
  557   2HB   GLU  74          1HB       GLU  74  -5.845 -12.620 -10.488
  558   1HG   GLU  74          2HG       GLU  74  -3.307 -12.388 -10.405
  559   2HG   GLU  74          1HG       GLU  74  -3.424 -12.726  -8.677
  560    H    ASP  75           H        ASP  75  -6.384 -10.058  -7.476
  561    HA   ASP  75           HA       ASP  75  -4.196  -8.670  -6.215
  562   1HB   ASP  75          2HB       ASP  75  -6.546  -8.197  -5.640
  563   2HB   ASP  75          1HB       ASP  75  -6.724  -9.832  -5.001
  564    H    GLU  76           H        GLU  76  -3.564 -11.408  -7.088
  565    HA   GLU  76           HA       GLU  76  -2.413 -13.285  -6.281
  566   1HB   GLU  76          2HB       GLU  76  -1.299 -11.174  -5.061
  567   2HB   GLU  76          1HB       GLU  76  -1.970 -11.972  -3.638
  568   1HG   GLU  76          2HG       GLU  76  -0.876 -14.113  -4.463
  569   2HG   GLU  76          1HG       GLU  76  -0.026 -13.124  -5.651
  570    H    ASP  77           H        ASP  77  -5.249 -12.185  -4.961
  571    HA   ASP  77           HA       ASP  77  -5.437 -14.223  -2.832
  572   1HB   ASP  77          2HB       ASP  77  -6.838 -11.780  -3.538
  573   2HB   ASP  77          1HB       ASP  77  -7.977 -13.102  -3.286
  574    H    GLY  78           H        GLY  78  -6.176 -13.869  -6.185
  575   1HA   GLY  78          2HA       GLY  78  -6.657 -15.930  -7.458
  576   2HA   GLY  78          1HA       GLY  78  -7.624 -16.482  -6.088
  577    H    ASN  79           H        ASN  79  -7.539 -13.411  -7.923
  578    HA   ASN  79           HA       ASN  79 -10.453 -13.811  -8.468
  579   1HB   ASN  79          2HB       ASN  79  -9.284 -11.069  -8.074
  580   2HB   ASN  79          1HB       ASN  79 -10.953 -11.604  -7.872
  581   1HD2  ASN  79          1HD2      ASN  79 -10.898 -10.647  -5.656
  582   2HD2  ASN  79          2HD2      ASN  79 -10.128 -11.483  -4.395
  583    H    LYS  80           H        LYS  80 -10.777 -11.499 -10.044
  584    HA   LYS  80           HA       LYS  80  -8.718 -11.626 -12.161
  585   1HB   LYS  80          2HB       LYS  80 -10.195 -13.439 -12.816
  586   2HB   LYS  80          1HB       LYS  80 -11.613 -12.415 -12.595
  587   1HG   LYS  80          2HG       LYS  80  -9.728 -11.117 -14.361
  588   2HG   LYS  80          1HG       LYS  80 -10.094 -12.736 -14.956
  589   1HD   LYS  80          2HD       LYS  80 -12.560 -12.161 -14.567
  590   2HD   LYS  80          1HD       LYS  80 -12.031 -10.489 -14.372
  591   1HE   LYS  80          2HE       LYS  80 -11.961 -12.224 -16.819
  592   2HE   LYS  80          1HE       LYS  80 -12.488 -10.549 -16.655
  593   1HZ   LYS  80          1HZ       LYS  80  -9.678 -11.268 -16.157
  594   2HZ   LYS  80          2HZ       LYS  80 -10.336  -9.777 -16.636
  595   3HZ   LYS  80          3HZ       LYS  80 -10.225 -11.057 -17.747
  596    H    LEU  81           H        LEU  81  -8.416  -9.580 -12.907
  597    HA   LEU  81           HA       LEU  81 -10.664  -7.754 -13.298
  598   1HB   LEU  81          2HB       LEU  81  -9.571  -6.000 -11.771
  599   2HB   LEU  81          1HB       LEU  81 -10.439  -7.309 -10.968
  600    HG   LEU  81           HG       LEU  81  -7.660  -8.016 -11.505
  601   1HD1  LEU  81          1HD1      LEU  81  -7.143  -5.694 -11.205
  602   2HD1  LEU  81          2HD1      LEU  81  -6.795  -6.481  -9.666
  603   3HD1  LEU  81          3HD1      LEU  81  -8.278  -5.548  -9.863
  604   1HD2  LEU  81          1HD2      LEU  81  -9.047  -9.281  -9.973
  605   2HD2  LEU  81          2HD2      LEU  81  -9.414  -7.833  -9.037
  606   3HD2  LEU  81          3HD2      LEU  81  -7.781  -8.496  -9.030
  607    H    LEU  82           H        LEU  82 -10.075  -6.022 -14.667
  608    HA   LEU  82           HA       LEU  82  -7.505  -6.379 -16.054
  609   1HB   LEU  82          2HB       LEU  82  -9.879  -4.554 -16.510
  610   2HB   LEU  82          1HB       LEU  82  -8.414  -4.483 -17.490
  611    HG   LEU  82           HG       LEU  82  -8.747  -7.020 -17.841
  612   1HD1  LEU  82          1HD1      LEU  82 -11.223  -7.627 -17.702
  613   2HD1  LEU  82          2HD1      LEU  82 -11.422  -6.194 -16.696
  614   3HD1  LEU  82          3HD1      LEU  82 -10.376  -7.507 -16.161
  615   1HD2  LEU  82          1HD2      LEU  82  -9.771  -4.735 -19.185
  616   2HD2  LEU  82          2HD2      LEU  82 -11.045  -5.953 -19.221
  617   3HD2  LEU  82          3HD2      LEU  82  -9.447  -6.327 -19.870
  618    H    CYS  83           H        CYS  83  -5.754  -4.994 -15.873
  619    HA   CYS  83           HA       CYS  83  -6.125  -2.576 -14.154
  620   1HB   CYS  83          2HB       CYS  83  -4.999  -4.511 -12.961
  621   2HB   CYS  83          1HB       CYS  83  -3.673  -4.350 -14.114
  622    HG   CYS  83           HG       CYS  83  -4.180  -1.658 -12.910
  623    H    PHE  84           H        PHE  84  -5.983  -1.016 -15.761
  624    HA   PHE  84           HA       PHE  84  -3.818  -1.240 -17.769
  625   1HB   PHE  84          2HB       PHE  84  -4.867   0.929 -18.626
  626   2HB   PHE  84          1HB       PHE  84  -5.882  -0.509 -18.716
  627    HD1  PHE  84           HD1      PHE  84  -5.671   2.846 -17.557
  628    HD2  PHE  84           HD2      PHE  84  -7.426  -0.968 -16.650
  629    HE1  PHE  84           HE1      PHE  84  -7.387   3.968 -16.163
  630    HE2  PHE  84           HE2      PHE  84  -9.142   0.154 -15.253
  631    HZ   PHE  84           HZ       PHE  84  -9.122   2.624 -15.012
  632    H    ASP  85           H        ASP  85  -2.104   0.270 -17.889
  633    HA   ASP  85           HA       ASP  85  -1.691   1.810 -15.365
  634   1HB   ASP  85          2HB       ASP  85   0.114   0.326 -15.599
  635   2HB   ASP  85          1HB       ASP  85   0.184   0.540 -17.348
  636    H    ALA  86           H        ALA  86  -0.729   3.945 -15.536
  637    HA   ALA  86           HA       ALA  86  -1.141   5.244 -18.198
  638   1HB   ALA  86          1HB       ALA  86  -2.830   5.676 -16.153
  639   2HB   ALA  86          2HB       ALA  86  -2.379   6.959 -17.277
  640   3HB   ALA  86          3HB       ALA  86  -1.578   6.835 -15.710
  641    H    THR  87           H        THR  87   0.315   7.040 -18.607
  642    HA   THR  87           HA       THR  87   2.602   7.207 -16.687
  643    HB   THR  87           HB       THR  87   3.724   7.659 -19.186
  644    HG1  THR  87           HG1      THR  87   2.690   6.497 -20.578
  645   1HG2  THR  87          1HG2      THR  87   4.900   6.436 -17.533
  646   2HG2  THR  87          2HG2      THR  87   4.605   5.267 -18.820
  647   3HG2  THR  87          3HG2      THR  87   3.603   5.254 -17.369
  648    H    MET  88           H        MET  88   3.586   9.256 -16.536
  649    HA   MET  88           HA       MET  88   2.679  11.444 -18.279
  650   1HB   MET  88          2HB       MET  88   0.884  11.322 -16.574
  651   2HB   MET  88          1HB       MET  88   2.094  11.477 -15.300
  652   1HG   MET  88          2HG       MET  88   2.754  13.676 -16.158
  653   2HG   MET  88          1HG       MET  88   1.602  13.523 -17.485
  654   1HE   MET  88          1HE       MET  88   0.428  15.726 -16.977
  655   2HE   MET  88          2HE       MET  88  -1.135  15.489 -16.200
  656   3HE   MET  88          3HE       MET  88  -0.616  14.386 -17.471
  657    H    GLN  89           H        GLN  89   4.748  12.100 -18.777
  658    HA   GLN  89           HA       GLN  89   6.922  12.046 -16.869
  659   1HB   GLN  89          2HB       GLN  89   7.101  13.889 -19.191
  660   2HB   GLN  89          1HB       GLN  89   8.241  12.665 -18.635
  661   1HG   GLN  89          2HG       GLN  89   6.355  10.989 -19.403
  662   2HG   GLN  89          1HG       GLN  89   5.839  12.349 -20.402
  663   1HE2  GLN  89          1HE2      GLN  89   8.331   9.912 -19.979
  664   2HE2  GLN  89          2HE2      GLN  89   9.218  10.304 -21.371
  665    H    SER  90           H        SER  90   6.961  13.404 -15.144
  666    HA   SER  90           HA       SER  90   6.437  16.288 -15.632
  667   1HB   SER  90          2HB       SER  90   4.912  16.506 -13.842
  668   2HB   SER  90          1HB       SER  90   4.388  15.034 -14.656
  669    HG   SER  90           HG       SER  90   5.820  15.355 -12.249
  670    H    ALA  91           H        ALA  91   6.987  17.438 -13.346
  671    HA   ALA  91           HA       ALA  91   9.784  16.895 -12.890
  672   1HB   ALA  91          1HB       ALA  91   8.838  18.461 -10.750
  673   2HB   ALA  91          2HB       ALA  91   7.846  18.916 -12.136
  674   3HB   ALA  91          3HB       ALA  91   9.602  19.043 -12.230
  675    H    LEU  92           H        LEU  92  10.336  16.921 -10.280
  676    HA   LEU  92           HA       LEU  92   8.945  14.492  -9.224
  677   1HB   LEU  92          2HB       LEU  92  11.322  14.119  -9.764
  678   2HB   LEU  92          1HB       LEU  92  11.773  15.463  -8.715
  679    HG   LEU  92           HG       LEU  92  10.615  14.245  -6.821
  680   1HD1  LEU  92          1HD1      LEU  92  10.612  11.650  -7.433
  681   2HD1  LEU  92          2HD1      LEU  92  10.299  12.277  -9.051
  682   3HD1  LEU  92          3HD1      LEU  92   9.197  12.658  -7.728
  683   1HD2  LEU  92          1HD2      LEU  92  13.045  14.198  -7.016
  684   2HD2  LEU  92          2HD2      LEU  92  12.956  12.910  -8.218
  685   3HD2  LEU  92          3HD2      LEU  92  12.483  12.593  -6.548
  686    H    ASP  93           H        ASP  93   7.427  15.350  -7.826
  687    HA   ASP  93           HA       ASP  93   8.421  16.639  -5.400
  688   1HB   ASP  93          2HB       ASP  93   7.229  18.211  -7.571
  689   2HB   ASP  93          1HB       ASP  93   6.401  18.424  -6.029
  690    H    ALA  94           H        ALA  94   6.972  16.338  -3.693
  691    HA   ALA  94           HA       ALA  94   4.911  14.355  -4.058
  692   1HB   ALA  94          1HB       ALA  94   5.404  16.191  -1.693
  693   2HB   ALA  94          2HB       ALA  94   6.177  14.625  -1.938
  694   3HB   ALA  94          3HB       ALA  94   4.436  14.717  -1.676
  695    H    LYS  95           H        LYS  95   4.762  17.846  -3.264
  696    HA   LYS  95           HA       LYS  95   1.965  18.122  -3.183
  697   1HB   LYS  95          2HB       LYS  95   2.870  20.426  -4.497
  698   2HB   LYS  95          1HB       LYS  95   2.713  20.209  -2.753
  699   1HG   LYS  95          2HG       LYS  95   4.999  19.402  -2.593
  700   2HG   LYS  95          1HG       LYS  95   5.171  19.434  -4.349
  701   1HD   LYS  95          2HD       LYS  95   4.388  21.992  -3.908
  702   2HD   LYS  95          1HD       LYS  95   5.244  21.670  -2.401
  703   1HE   LYS  95          2HE       LYS  95   6.842  22.547  -3.997
  704   2HE   LYS  95          1HE       LYS  95   7.188  20.834  -3.761
  705   1HZ   LYS  95          1HZ       LYS  95   7.207  21.099  -6.052
  706   2HZ   LYS  95          2HZ       LYS  95   5.874  22.151  -6.053
  707   3HZ   LYS  95          3HZ       LYS  95   5.651  20.494  -5.753
  708    H    LEU  96           H        LEU  96   4.101  18.458  -6.038
  709    HA   LEU  96           HA       LEU  96   2.012  18.861  -7.932
  710   1HB   LEU  96          2HB       LEU  96   4.863  18.349  -7.980
  711   2HB   LEU  96          1HB       LEU  96   4.053  17.421  -9.242
  712    HG   LEU  96           HG       LEU  96   3.443  20.344  -8.808
  713   1HD1  LEU  96          1HD1      LEU  96   5.931  19.886  -9.218
  714   2HD1  LEU  96          2HD1      LEU  96   5.135  20.958 -10.371
  715   3HD1  LEU  96          3HD1      LEU  96   5.450  19.276 -10.802
  716   1HD2  LEU  96          1HD2      LEU  96   3.377  18.810 -11.396
  717   2HD2  LEU  96          2HD2      LEU  96   2.427  20.216 -10.914
  718   3HD2  LEU  96          3HD2      LEU  96   2.058  18.630 -10.238
  719    H    ILE  97           H        ILE  97   3.421  15.914  -6.575
  720    HA   ILE  97           HA       ILE  97   2.041  14.115  -8.375
  721    HB   ILE  97           HB       ILE  97   3.491  13.809  -5.755
  722   1HG1  ILE  97          2HG1      ILE  97   3.879  12.369  -8.388
  723   2HG1  ILE  97          1HG1      ILE  97   4.595  13.950  -8.075
  724   1HG2  ILE  97          1HG2      ILE  97   1.599  11.881  -7.070
  725   2HG2  ILE  97          2HG2      ILE  97   1.843  12.207  -5.354
  726   3HG2  ILE  97          3HG2      ILE  97   3.034  11.261  -6.250
  727   1HD1  ILE  97          1HD1      ILE  97   6.270  12.976  -6.933
  728   2HD1  ILE  97          2HD1      ILE  97   5.567  11.393  -7.264
  729   3HD1  ILE  97          3HD1      ILE  97   5.105  12.276  -5.809
  730    H    ASP  98           H        ASP  98   1.128  15.872  -5.535
  731    HA   ASP  98           HA       ASP  98  -1.101  14.131  -4.818
  732   1HB   ASP  98          2HB       ASP  98  -0.131  16.841  -3.963
  733   2HB   ASP  98          1HB       ASP  98  -1.773  16.344  -3.548
  734    H    GLU  99           H        GLU  99  -0.662  17.082  -6.729
  735    HA   GLU  99           HA       GLU  99  -3.473  17.549  -7.175
  736   1HB   GLU  99          2HB       GLU  99  -0.966  18.425  -8.617
  737   2HB   GLU  99          1HB       GLU  99  -2.574  18.883  -9.179
  738   1HG   GLU  99          2HG       GLU  99  -2.681  20.513  -7.634
  739   2HG   GLU  99          1HG       GLU  99  -2.421  19.337  -6.347
  740    H    GLN 100           H        GLN 100  -0.945  15.967  -9.149
  741    HA   GLN 100           HA       GLN 100  -2.662  15.223 -11.303
  742   1HB   GLN 100          2HB       GLN 100  -0.018  14.285 -10.263
  743   2HB   GLN 100          1HB       GLN 100  -0.864  13.255 -11.419
  744   1HG   GLN 100          2HG       GLN 100   0.554  14.738 -12.687
  745   2HG   GLN 100          1HG       GLN 100  -1.109  15.285 -12.908
  746   1HE2  GLN 100          1HE2      GLN 100  -1.709  16.857 -10.814
  747   2HE2  GLN 100          2HE2      GLN 100  -0.583  18.109 -10.599
  748    H    VAL 101           H        VAL 101  -1.601  13.340  -8.452
  749    HA   VAL 101           HA       VAL 101  -3.225  11.058  -8.980
  750    HB   VAL 101           HB       VAL 101  -2.203  12.202  -6.365
  751   1HG1  VAL 101          1HG1      VAL 101  -3.719   9.685  -7.020
  752   2HG1  VAL 101          2HG1      VAL 101  -3.956  10.803  -5.676
  753   3HG1  VAL 101          3HG1      VAL 101  -2.574   9.709  -5.679
  754   1HG2  VAL 101          1HG2      VAL 101  -1.203   9.714  -7.711
  755   2HG2  VAL 101          2HG2      VAL 101  -0.341  10.837  -6.659
  756   3HG2  VAL 101          3HG2      VAL 101  -0.684  11.281  -8.331
  757    H    GLU 102           H        GLU 102  -3.950  14.188  -7.595
  758    HA   GLU 102           HA       GLU 102  -6.417  13.505  -6.306
  759   1HB   GLU 102          2HB       GLU 102  -5.253  15.661  -5.939
  760   2HB   GLU 102          1HB       GLU 102  -5.603  16.126  -7.605
  761   1HG   GLU 102          2HG       GLU 102  -8.050  15.842  -7.098
  762   2HG   GLU 102          1HG       GLU 102  -7.619  15.588  -5.406
  763    H    LYS 103           H        LYS 103  -5.664  14.579  -9.617
  764    HA   LYS 103           HA       LYS 103  -8.371  14.699 -10.534
  765   1HB   LYS 103          2HB       LYS 103  -5.719  14.298 -11.920
  766   2HB   LYS 103          1HB       LYS 103  -7.234  14.252 -12.822
  767   1HG   LYS 103          2HG       LYS 103  -7.595  16.495 -12.593
  768   2HG   LYS 103          1HG       LYS 103  -6.935  16.534 -10.958
  769   1HD   LYS 103          2HD       LYS 103  -5.510  17.777 -12.582
  770   2HD   LYS 103          1HD       LYS 103  -4.657  16.425 -11.836
  771   1HE   LYS 103          2HE       LYS 103  -4.441  15.330 -13.808
  772   2HE   LYS 103          1HE       LYS 103  -6.106  15.674 -14.276
  773   1HZ   LYS 103          1HZ       LYS 103  -5.439  17.911 -14.886
  774   2HZ   LYS 103          2HZ       LYS 103  -4.531  16.762 -15.747
  775   3HZ   LYS 103          3HZ       LYS 103  -3.837  17.583 -14.433
  776    H    LEU 104           H        LEU 104  -5.957  12.073 -10.597
  777    HA   LEU 104           HA       LEU 104  -7.658  10.165 -11.907
  778   1HB   LEU 104          2HB       LEU 104  -5.364   9.679  -9.979
  779   2HB   LEU 104          1HB       LEU 104  -6.055   8.488 -11.083
  780    HG   LEU 104           HG       LEU 104  -4.937  11.117 -12.063
  781   1HD1  LEU 104          1HD1      LEU 104  -3.484   8.459 -11.915
  782   2HD1  LEU 104          2HD1      LEU 104  -3.196   9.807 -10.814
  783   3HD1  LEU 104          3HD1      LEU 104  -2.842   9.982 -12.533
  784   1HD2  LEU 104          1HD2      LEU 104  -4.682   9.660 -14.151
  785   2HD2  LEU 104          2HD2      LEU 104  -6.337  10.040 -13.677
  786   3HD2  LEU 104          3HD2      LEU 104  -5.658   8.454 -13.310
  787    H    VAL 105           H        VAL 105  -7.353  11.213  -8.576
  788    HA   VAL 105           HA       VAL 105  -8.773   8.975  -7.414
  789    HB   VAL 105           HB       VAL 105  -7.972  11.717  -6.495
  790   1HG1  VAL 105          1HG1      VAL 105  -9.085  11.138  -4.287
  791   2HG1  VAL 105          2HG1      VAL 105  -9.961   9.873  -5.149
  792   3HG1  VAL 105          3HG1      VAL 105 -10.193  11.564  -5.591
  793   1HG2  VAL 105          1HG2      VAL 105  -7.595   8.989  -5.234
  794   2HG2  VAL 105          2HG2      VAL 105  -6.714  10.472  -4.867
  795   3HG2  VAL 105          3HG2      VAL 105  -6.474   9.663  -6.415
  796    H    ASN 106           H        ASN 106  -9.790  12.362  -8.005
  797    HA   ASN 106           HA       ASN 106 -12.546  11.910  -7.426
  798   1HB   ASN 106          2HB       ASN 106 -11.442  13.956  -9.368
  799   2HB   ASN 106          1HB       ASN 106 -12.945  14.056  -8.449
  800   1HD2  ASN 106          1HD2      ASN 106 -12.238  13.409  -5.882
  801   2HD2  ASN 106          2HD2      ASN 106 -11.035  14.452  -5.295
  802    H    LEU 107           H        LEU 107 -10.880  12.066 -10.598
  803    HA   LEU 107           HA       LEU 107 -13.116  11.493 -12.218
  804   1HB   LEU 107          2HB       LEU 107 -10.905  12.144 -13.116
  805   2HB   LEU 107          1HB       LEU 107 -10.254  10.577 -12.634
  806    HG   LEU 107           HG       LEU 107 -12.584   9.987 -14.092
  807   1HD1  LEU 107          1HD1      LEU 107 -10.896  12.080 -15.498
  808   2HD1  LEU 107          2HD1      LEU 107 -12.551  12.313 -14.937
  809   3HD1  LEU 107          3HD1      LEU 107 -12.212  11.158 -16.226
  810   1HD2  LEU 107          1HD2      LEU 107 -10.379   8.770 -14.005
  811   2HD2  LEU 107          2HD2      LEU 107  -9.717   9.998 -15.083
  812   3HD2  LEU 107          3HD2      LEU 107 -11.024   8.951 -15.636
  813    H    ALA 108           H        ALA 108 -10.847   9.208 -10.674
  814    HA   ALA 108           HA       ALA 108 -12.019   6.828 -11.691
  815   1HB   ALA 108          1HB       ALA 108 -10.384   7.484  -9.259
  816   2HB   ALA 108          2HB       ALA 108  -9.960   6.482 -10.647
  817   3HB   ALA 108          3HB       ALA 108 -11.082   5.873  -9.429
  818    H    GLU 109           H        GLU 109 -12.634   8.485  -8.571
  819    HA   GLU 109           HA       GLU 109 -14.724   6.703  -7.761
  820   1HB   GLU 109          2HB       GLU 109 -14.402   9.622  -7.007
  821   2HB   GLU 109          1HB       GLU 109 -15.277   8.388  -6.099
  822   1HG   GLU 109          2HG       GLU 109 -12.464   7.722  -6.730
  823   2HG   GLU 109          1HG       GLU 109 -12.684   9.067  -5.610
  824    H    LYS 110           H        LYS 110 -14.660   9.352 -10.009
  825    HA   LYS 110           HA       LYS 110 -17.545   9.810  -9.956
  826   1HB   LYS 110          2HB       LYS 110 -15.625  11.423 -10.730
  827   2HB   LYS 110          1HB       LYS 110 -15.775  10.568 -12.266
  828   1HG   LYS 110          2HG       LYS 110 -18.290  11.033 -12.108
  829   2HG   LYS 110          1HG       LYS 110 -17.893  12.162 -10.812
  830   1HD   LYS 110          2HD       LYS 110 -16.474  12.311 -13.466
  831   2HD   LYS 110          1HD       LYS 110 -18.040  13.088 -13.237
  832   1HE   LYS 110          2HE       LYS 110 -17.038  14.200 -11.169
  833   2HE   LYS 110          1HE       LYS 110 -15.471  13.627 -11.737
  834   1HZ   LYS 110          1HZ       LYS 110 -15.867  15.851 -12.523
  835   2HZ   LYS 110          2HZ       LYS 110 -17.344  15.387 -13.222
  836   3HZ   LYS 110          3HZ       LYS 110 -15.881  14.783 -13.840
  837    H    PHE 111           H        PHE 111 -15.354   7.666 -11.600
  838    HA   PHE 111           HA       PHE 111 -17.435   6.901 -13.571
  839   1HB   PHE 111          2HB       PHE 111 -14.497   6.443 -13.278
  840   2HB   PHE 111          1HB       PHE 111 -15.432   5.218 -14.137
  841    HD1  PHE 111           HD1      PHE 111 -17.354   6.421 -15.724
  842    HD2  PHE 111           HD2      PHE 111 -13.518   8.035 -14.658
  843    HE1  PHE 111           HE1      PHE 111 -17.401   7.865 -17.739
  844    HE2  PHE 111           HE2      PHE 111 -13.565   9.479 -16.674
  845    HZ   PHE 111           HZ       PHE 111 -15.507   9.394 -18.215
  846    H    ASP 112           H        ASP 112 -15.156   4.924 -11.662
  847    HA   ASP 112           HA       ASP 112 -16.781   3.646  -9.866
  848   1HB   ASP 112          2HB       ASP 112 -17.511   2.899 -12.635
  849   2HB   ASP 112          1HB       ASP 112 -17.296   1.542 -11.529
  850    H    ILE 113           H        ILE 113 -13.987   4.106 -10.587
  851    HA   ILE 113           HA       ILE 113 -13.001   1.290 -10.380
  852    HB   ILE 113           HB       ILE 113 -10.923   2.079 -11.526
  853   1HG1  ILE 113          2HG1      ILE 113 -12.550   4.617 -11.640
  854   2HG1  ILE 113          1HG1      ILE 113 -10.868   4.408 -11.148
  855   1HG2  ILE 113          1HG2      ILE 113 -13.353   2.692 -13.217
  856   2HG2  ILE 113          2HG2      ILE 113 -12.953   1.049 -12.711
  857   3HG2  ILE 113          3HG2      ILE 113 -11.831   1.958 -13.723
  858   1HD1  ILE 113          1HD1      ILE 113 -10.764   5.365 -13.326
  859   2HD1  ILE 113          2HD1      ILE 113 -12.018   4.288 -13.941
  860   3HD1  ILE 113          3HD1      ILE 113 -10.419   3.653 -13.557
  861    H    ILE 114           H        ILE 114 -10.765   1.255  -9.282
  862    HA   ILE 114           HA       ILE 114 -10.793   3.248  -7.052
  863    HB   ILE 114           HB       ILE 114 -11.106   1.150  -6.047
  864   1HG1  ILE 114          2HG1      ILE 114  -8.083   1.319  -6.186
  865   2HG1  ILE 114          1HG1      ILE 114  -9.060   2.423  -5.218
  866   1HG2  ILE 114          1HG2      ILE 114 -10.732  -0.112  -8.187
  867   2HG2  ILE 114          2HG2      ILE 114 -10.016  -0.895  -6.778
  868   3HG2  ILE 114          3HG2      ILE 114  -8.997   0.004  -7.901
  869   1HD1  ILE 114          1HD1      ILE 114  -9.171   0.894  -3.575
  870   2HD1  ILE 114          2HD1      ILE 114  -8.191  -0.211  -4.537
  871   3HD1  ILE 114          3HD1      ILE 114  -9.948  -0.240  -4.679
  872    H    TYR 115           H        TYR 115  -8.754   4.105  -6.357
  873    HA   TYR 115           HA       TYR 115  -6.574   3.810  -8.388
  874   1HB   TYR 115          2HB       TYR 115  -7.262   6.050  -8.570
  875   2HB   TYR 115          1HB       TYR 115  -7.572   6.194  -6.839
  876    HD1  TYR 115           HD1      TYR 115  -5.840   6.799  -5.306
  877    HD2  TYR 115           HD2      TYR 115  -4.894   5.912  -9.401
  878    HE1  TYR 115           HE1      TYR 115  -3.541   7.662  -4.962
  879    HE2  TYR 115           HE2      TYR 115  -2.594   6.776  -9.057
  880    HH   TYR 115           HH       TYR 115  -1.472   7.783  -5.850
  881    H    ASP 116           H        ASP 116  -5.373   2.211  -7.309
  882    HA   ASP 116           HA       ASP 116  -3.943   3.148  -4.901
  883   1HB   ASP 116          2HB       ASP 116  -6.140   1.627  -4.462
  884   2HB   ASP 116          1HB       ASP 116  -4.940   0.357  -4.701
  885    H    GLY 117           H        GLY 117  -2.128   3.151  -6.372
  886   1HA   GLY 117          2HA       GLY 117  -0.341   1.095  -6.306
  887   2HA   GLY 117          1HA       GLY 117  -1.355   0.636  -7.674
  888    H    TRP 118           H        TRP 118   0.463   3.460  -6.435
  889    HA   TRP 118           HA       TRP 118   1.061   4.142  -9.287
  890   1HB   TRP 118          2HB       TRP 118   0.932   6.403  -8.784
  891   2HB   TRP 118          1HB       TRP 118  -0.269   5.767  -7.661
  892    HD1  TRP 118           HD1      TRP 118   0.407   5.600  -5.086
  893    HE1  TRP 118           HE1      TRP 118   2.222   6.809  -3.710
  894    HE3  TRP 118           HE3      TRP 118   3.330   7.397  -8.868
  895    HZ2  TRP 118           HZ2      TRP 118   4.600   8.337  -4.156
  896    HZ3  TRP 118           HZ3      TRP 118   5.362   8.724  -8.366
  897    HH2  TRP 118           HH2      TRP 118   6.000   9.195  -6.017
  898    H    GLY 119           H        GLY 119   3.242   5.067  -9.649
  899   1HA   GLY 119          2HA       GLY 119   5.266   4.881  -7.582
  900   2HA   GLY 119          1HA       GLY 119   5.344   3.510  -8.691
  901    H    THR 120           H        THR 120   7.513   5.161  -8.635
  902    HA   THR 120           HA       THR 120   7.309   6.518 -11.281
  903    HB   THR 120           HB       THR 120   7.205   8.297  -9.608
  904    HG1  THR 120           HG1      THR 120   8.442   9.204 -11.030
  905   1HG2  THR 120          1HG2      THR 120   9.891   7.492  -8.541
  906   2HG2  THR 120          2HG2      THR 120   8.438   6.724  -7.900
  907   3HG2  THR 120          3HG2      THR 120   8.636   8.472  -7.781
  908    H    TYR 121           H        TYR 121   9.084   6.144 -12.591
  909    HA   TYR 121           HA       TYR 121  11.063   4.198 -11.582
  910   1HB   TYR 121          2HB       TYR 121  10.065   5.070 -14.227
  911   2HB   TYR 121          1HB       TYR 121  11.780   4.665 -14.171
  912    HD1  TYR 121           HD1      TYR 121   8.402   3.380 -13.221
  913    HD2  TYR 121           HD2      TYR 121  12.482   2.415 -14.153
  914    HE1  TYR 121           HE1      TYR 121   7.832   0.967 -13.214
  915    HE2  TYR 121           HE2      TYR 121  11.913   0.001 -14.147
  916    HH   TYR 121           HH       TYR 121   9.533  -1.327 -14.584
  917    H    TYR 122           H        TYR 122  13.331   4.591 -11.618
  918    HA   TYR 122           HA       TYR 122  14.045   7.493 -11.675
  919   1HB   TYR 122          2HB       TYR 122  14.465   6.616  -9.494
  920   2HB   TYR 122          1HB       TYR 122  15.201   5.152 -10.147
  921    HD1  TYR 122           HD1      TYR 122  15.610   8.878 -10.161
  922    HD2  TYR 122           HD2      TYR 122  17.527   5.041 -10.404
  923    HE1  TYR 122           HE1      TYR 122  17.829   9.985 -10.147
  924    HE2  TYR 122           HE2      TYR 122  19.746   6.149 -10.391
  925    HH   TYR 122           HH       TYR 122  20.724   8.291  -9.633
  926    H    GLU 123           H        GLU 123  16.344   7.912 -12.405
  927    HA   GLU 123           HA       GLU 123  16.798   6.558 -14.948
  928   1HB   GLU 123          2HB       GLU 123  18.350   8.701 -13.469
  929   2HB   GLU 123          1HB       GLU 123  18.786   8.104 -15.070
  930   1HG   GLU 123          2HG       GLU 123  16.269   8.642 -15.635
  931   2HG   GLU 123          1HG       GLU 123  16.392   9.712 -14.238
  932    H    GLY 124           H        GLY 124  19.453   6.236 -15.249
  933   1HA   GLY 124          2HA       GLY 124  21.404   5.117 -14.387
  934   2HA   GLY 124          1HA       GLY 124  20.474   4.649 -12.962
  935    H    LEU 125           H        LEU 125  21.412   2.462 -13.470
  936    HA   LEU 125           HA       LEU 125  21.113   0.275 -14.272
  937   1HB   LEU 125          2HB       LEU 125  18.455   1.244 -15.345
  938   2HB   LEU 125          1HB       LEU 125  18.887  -0.388 -14.834
  939    HG   LEU 125           HG       LEU 125  18.997   1.922 -12.897
  940   1HD1  LEU 125          1HD1      LEU 125  16.610   0.262 -13.729
  941   2HD1  LEU 125          2HD1      LEU 125  16.738   2.020 -13.660
  942   3HD1  LEU 125          3HD1      LEU 125  16.694   1.081 -12.169
  943   1HD2  LEU 125          1HD2      LEU 125  19.661  -0.816 -12.798
  944   2HD2  LEU 125          2HD2      LEU 125  18.144  -0.669 -11.910
  945   3HD2  LEU 125          3HD2      LEU 125  19.542   0.294 -11.432
  946    H    GLU 126           H        GLU 126  22.777   1.487 -15.871
  947    HA   GLU 126           HA       GLU 126  23.623   1.430 -18.062
  948   1HB   GLU 126          2HB       GLU 126  21.663  -0.624 -17.974
  949   2HB   GLU 126          1HB       GLU 126  21.395   0.265 -19.474
  950   1HG   GLU 126          2HG       GLU 126  23.008  -1.465 -19.945
  951   2HG   GLU 126          1HG       GLU 126  23.876   0.071 -19.926
  952    H    HIS 127           H        HIS 127  23.195   3.799 -17.885
  953    HA   HIS 127           HA       HIS 127  21.494   4.680 -20.108
  954   1HB   HIS 127          2HB       HIS 127  20.082   4.532 -17.911
  955   2HB   HIS 127          1HB       HIS 127  20.973   5.980 -17.444
  956    HD2  HIS 127           HD2      HIS 127  19.493   8.179 -18.183
  957    HE1  HIS 127           HE1      HIS 127  17.851   6.648 -21.761
  958    HE2  HIS 127           HE2      HIS 127  17.964   8.673 -20.238
  959    H    HIS 128           H        HIS 128  23.479   5.469 -20.970
  960    HA   HIS 128           HA       HIS 128  24.743   7.688 -19.412
  961   1HB   HIS 128          2HB       HIS 128  25.942   6.204 -21.766
  962   2HB   HIS 128          1HB       HIS 128  26.771   7.272 -20.633
  963    HD2  HIS 128           HD2      HIS 128  28.420   5.164 -19.633
  964    HE1  HIS 128           HE1      HIS 128  25.259   2.917 -17.961
  965    HE2  HIS 128           HE2      HIS 128  27.782   3.156 -18.096
  966    H    HIS 129           H        HIS 129  24.445   9.717 -20.204
  967    HA   HIS 129           HA       HIS 129  23.124  10.018 -22.834
  968   1HB   HIS 129          2HB       HIS 129  22.270  11.252 -20.837
  969   2HB   HIS 129          1HB       HIS 129  23.801  12.123 -20.759
  970    HD2  HIS 129           HD2      HIS 129  20.653  11.906 -23.148
  971    HE1  HIS 129           HE1      HIS 129  22.916  15.313 -24.205
  972    HE2  HIS 129           HE2      HIS 129  20.761  14.047 -24.635
  973    H    HIS 130           H        HIS 130  23.993  12.367 -23.806
  974    HA   HIS 130           HA       HIS 130  26.486  11.759 -25.030
  975   1HB   HIS 130          2HB       HIS 130  24.537  13.624 -25.464
  976   2HB   HIS 130          1HB       HIS 130  25.819  14.630 -24.793
  977    HD2  HIS 130           HD2      HIS 130  27.875  15.189 -26.580
  978    HE1  HIS 130           HE1      HIS 130  26.802  12.400 -29.565
  979    HE2  HIS 130           HE2      HIS 130  28.380  14.299 -28.980
  980    H    HIS 131           H        HIS 131  28.495  13.158 -24.818
  981    HA   HIS 131           HA       HIS 131  29.628  12.976 -22.258
  982   1HB   HIS 131          2HB       HIS 131  30.372  14.099 -24.806
  983   2HB   HIS 131          1HB       HIS 131  30.839  15.214 -23.522
  984    HD2  HIS 131           HD2      HIS 131  33.361  14.559 -22.635
  985    HE1  HIS 131           HE1      HIS 131  33.152  10.378 -23.192
  986    HE2  HIS 131           HE2      HIS 131  34.624  12.288 -22.408
  987    H    HIS 132           HN       HIS 132  29.308  16.231 -23.608
  988    HA   HIS 132           HA       HIS 132  28.759  17.313 -20.962
  989   1HB   HIS 132          2HB       HIS 132  28.495  18.760 -23.607
  990   2HB   HIS 132          1HB       HIS 132  28.819  19.461 -22.022
  991    HD2  HIS 132           HD2      HIS 132  31.366  17.743 -21.022
  992    HE1  HIS 132           HE1      HIS 132  33.101  18.574 -24.782
  993    HE2  HIS 132           HE2      HIS 132  33.571  17.800 -22.412
  Start of MODEL   19
    1   1H    MET   1          1H        MET   1 -26.571  10.355   3.253
    2   2H    MET   1          2H        MET   1 -25.032  11.028   3.006
    3   3H    MET   1          3H        MET   1 -26.022  11.602   4.262
    4    HA   MET   1           HA       MET   1 -25.939   9.262   5.196
    5   1HB   MET   1          2HB       MET   1 -24.894   8.510   2.913
    6   2HB   MET   1          1HB       MET   1 -23.384   9.091   3.617
    7   1HG   MET   1          2HG       MET   1 -23.281   6.974   4.470
    8   2HG   MET   1          1HG       MET   1 -24.353   7.643   5.699
    9   1HE   MET   1          1HE       MET   1 -26.238   5.357   6.252
   10   2HE   MET   1          2HE       MET   1 -24.486   5.311   6.071
   11   3HE   MET   1          3HE       MET   1 -25.483   4.128   5.228
   12    H    SER   2           H        SER   2 -23.190  11.321   4.157
   13    HA   SER   2           HA       SER   2 -22.174  11.327   6.931
   14   1HB   SER   2          2HB       SER   2 -20.691  13.137   5.349
   15   2HB   SER   2          1HB       SER   2 -20.218  11.511   5.833
   16    HG   SER   2           HG       SER   2 -21.923  12.014   3.631
   17    H    HIS   3           H        HIS   3 -21.156  13.879   7.174
   18    HA   HIS   3           HA       HIS   3 -23.475  15.713   6.822
   19   1HB   HIS   3          2HB       HIS   3 -23.015  14.485   9.233
   20   2HB   HIS   3          1HB       HIS   3 -22.082  15.972   9.411
   21    HD2  HIS   3           HD2      HIS   3 -25.785  14.833   9.402
   22    HE1  HIS   3           HE1      HIS   3 -25.800  19.055   9.448
   23    HE2  HIS   3           HE2      HIS   3 -27.236  16.980   9.693
   24    H    GLN   4           H        GLN   4 -22.707  17.526   5.855
   25    HA   GLN   4           HA       GLN   4 -21.144  19.103   5.069
   26   1HB   GLN   4          2HB       GLN   4 -21.557  19.841   7.434
   27   2HB   GLN   4          1HB       GLN   4 -20.149  18.900   7.925
   28   1HG   GLN   4          2HG       GLN   4 -18.656  20.332   6.894
   29   2HG   GLN   4          1HG       GLN   4 -19.823  20.838   5.672
   30   1HE2  GLN   4          1HE2      GLN   4 -18.477  22.897   6.893
   31   2HE2  GLN   4          2HE2      GLN   4 -19.472  23.697   8.012
   32    H    ASP   5           H        ASP   5 -20.390  16.166   5.049
   33    HA   ASP   5           HA       ASP   5 -17.531  16.610   4.441
   34   1HB   ASP   5          2HB       ASP   5 -18.433  15.282   6.831
   35   2HB   ASP   5          1HB       ASP   5 -17.634  14.108   5.784
   36    H    ASP   6           H        ASP   6 -17.593  15.992   2.324
   37    HA   ASP   6           HA       ASP   6 -19.400  14.269   1.072
   38   1HB   ASP   6          2HB       ASP   6 -16.504  14.257   0.251
   39   2HB   ASP   6          1HB       ASP   6 -17.946  14.260  -0.766
   40    H    TYR   7           H        TYR   7 -19.816  12.453   2.441
   41    HA   TYR   7           HA       TYR   7 -19.336  10.377   3.487
   42   1HB   TYR   7          2HB       TYR   7 -18.035   8.932   1.638
   43   2HB   TYR   7          1HB       TYR   7 -19.738   9.359   1.460
   44    HD1  TYR   7           HD1      TYR   7 -20.425  11.223  -0.014
   45    HD2  TYR   7           HD2      TYR   7 -16.325   9.974   0.279
   46    HE1  TYR   7           HE1      TYR   7 -19.893  12.483  -2.083
   47    HE2  TYR   7           HE2      TYR   7 -15.794  11.233  -1.790
   48    HH   TYR   7           HH       TYR   7 -18.335  12.798  -3.692
   49    H    LEU   8           H        LEU   8 -17.166   8.630   3.142
   50    HA   LEU   8           HA       LEU   8 -14.806  10.250   3.979
   51   1HB   LEU   8          2HB       LEU   8 -16.307   8.236   5.554
   52   2HB   LEU   8          1HB       LEU   8 -14.551   8.078   5.591
   53    HG   LEU   8           HG       LEU   8 -15.901  10.738   6.039
   54   1HD1  LEU   8          1HD1      LEU   8 -16.827   9.252   7.723
   55   2HD1  LEU   8          2HD1      LEU   8 -15.606  10.270   8.487
   56   3HD1  LEU   8          3HD1      LEU   8 -15.228   8.597   8.077
   57   1HD2  LEU   8          1HD2      LEU   8 -13.209   9.805   5.838
   58   2HD2  LEU   8          2HD2      LEU   8 -13.483  10.289   7.511
   59   3HD2  LEU   8          3HD2      LEU   8 -13.766  11.437   6.205
   60    H    SER   9           H        SER   9 -13.584   9.789   2.153
   61    HA   SER   9           HA       SER   9 -12.393   7.152   1.978
   62   1HB   SER   9          2HB       SER   9 -13.173   6.987  -0.533
   63   2HB   SER   9          1HB       SER   9 -14.218   6.383   0.750
   64    HG   SER   9           HG       SER   9 -14.980   8.018  -0.988
   65    H    VAL  10           H        VAL  10 -12.956   9.131  -0.872
   66    HA   VAL  10           HA       VAL  10 -10.357   9.419  -1.718
   67    HB   VAL  10           HB       VAL  10 -11.030  11.317  -2.963
   68   1HG1  VAL  10          1HG1      VAL  10 -12.757   9.123  -2.682
   69   2HG1  VAL  10          2HG1      VAL  10 -12.732  10.275  -4.018
   70   3HG1  VAL  10          3HG1      VAL  10 -13.813  10.535  -2.650
   71   1HG2  VAL  10          1HG2      VAL  10 -12.929  11.821  -0.657
   72   2HG2  VAL  10          2HG2      VAL  10 -13.054  12.674  -2.195
   73   3HG2  VAL  10          3HG2      VAL  10 -11.603  12.846  -1.206
   74    H    GLU  11           H        GLU  11 -11.799  10.911   1.078
   75    HA   GLU  11           HA       GLU  11  -9.795  12.969   1.441
   76   1HB   GLU  11          2HB       GLU  11 -12.079  12.987   2.499
   77   2HB   GLU  11          1HB       GLU  11 -11.547  11.673   3.551
   78   1HG   GLU  11          2HG       GLU  11  -9.729  13.088   4.418
   79   2HG   GLU  11          1HG       GLU  11 -10.237  14.403   3.358
   80    H    GLU  12           H        GLU  12 -10.324   9.813   3.057
   81    HA   GLU  12           HA       GLU  12  -7.889   9.890   4.556
   82   1HB   GLU  12          2HB       GLU  12  -8.669   7.189   3.819
   83   2HB   GLU  12          1HB       GLU  12  -8.690   7.961   5.405
   84   1HG   GLU  12          2HG       GLU  12 -10.836   9.067   4.811
   85   2HG   GLU  12          1HG       GLU  12 -10.826   8.213   3.267
   86    H    LEU  13           H        LEU  13  -8.638   7.989   1.608
   87    HA   LEU  13           HA       LEU  13  -6.109   6.975   1.071
   88   1HB   LEU  13          2HB       LEU  13  -7.774   8.156  -1.148
   89   2HB   LEU  13          1HB       LEU  13  -6.800   6.686  -1.165
   90    HG   LEU  13           HG       LEU  13  -9.435   7.149   0.245
   91   1HD1  LEU  13          1HD1      LEU  13  -8.711   4.790  -1.460
   92   2HD1  LEU  13          2HD1      LEU  13  -9.088   6.324  -2.244
   93   3HD1  LEU  13          3HD1      LEU  13 -10.284   5.546  -1.209
   94   1HD2  LEU  13          1HD2      LEU  13  -8.123   6.002   1.873
   95   2HD2  LEU  13          2HD2      LEU  13  -7.347   4.998   0.649
   96   3HD2  LEU  13          3HD2      LEU  13  -9.045   4.743   1.052
   97    H    ILE  14           H        ILE  14  -7.328  10.201   0.135
   98    HA   ILE  14           HA       ILE  14  -5.011  11.076  -1.240
   99    HB   ILE  14           HB       ILE  14  -7.127  12.544   0.332
  100   1HG1  ILE  14          2HG1      ILE  14  -6.459  12.639  -2.619
  101   2HG1  ILE  14          1HG1      ILE  14  -7.543  11.423  -1.942
  102   1HG2  ILE  14          1HG2      ILE  14  -5.359  14.059   0.573
  103   2HG2  ILE  14          2HG2      ILE  14  -6.078  14.576  -0.951
  104   3HG2  ILE  14          3HG2      ILE  14  -4.617  13.588  -0.955
  105   1HD1  ILE  14          1HD1      ILE  14  -9.169  12.969  -2.287
  106   2HD1  ILE  14          2HD1      ILE  14  -8.010  14.291  -2.422
  107   3HD1  ILE  14          3HD1      ILE  14  -8.534  13.737  -0.833
  108    H    GLU  15           H        GLU  15  -5.867  12.146   2.070
  109    HA   GLU  15           HA       GLU  15  -3.416  13.192   2.823
  110   1HB   GLU  15          2HB       GLU  15  -5.443  11.631   4.430
  111   2HB   GLU  15          1HB       GLU  15  -4.009  12.335   5.180
  112   1HG   GLU  15          2HG       GLU  15  -5.009  14.349   5.241
  113   2HG   GLU  15          1HG       GLU  15  -5.205  14.316   3.488
  114    H    ILE  16           H        ILE  16  -4.351   9.758   2.882
  115    HA   ILE  16           HA       ILE  16  -1.976   8.769   4.106
  116    HB   ILE  16           HB       ILE  16  -3.962   7.542   2.189
  117   1HG1  ILE  16          2HG1      ILE  16  -3.375   6.624   4.983
  118   2HG1  ILE  16          1HG1      ILE  16  -4.304   8.107   4.759
  119   1HG2  ILE  16          1HG2      ILE  16  -2.198   6.165   1.648
  120   2HG2  ILE  16          2HG2      ILE  16  -2.688   5.384   3.152
  121   3HG2  ILE  16          3HG2      ILE  16  -1.332   6.512   3.144
  122   1HD1  ILE  16          1HD1      ILE  16  -5.733   6.047   4.930
  123   2HD1  ILE  16          2HD1      ILE  16  -4.989   5.465   3.440
  124   3HD1  ILE  16          3HD1      ILE  16  -5.959   6.938   3.424
  125    H    GLN  17           H        GLN  17  -2.765   9.314   0.669
  126    HA   GLN  17           HA       GLN  17  -0.193   8.354  -0.267
  127   1HB   GLN  17          2HB       GLN  17  -2.370   8.531  -1.615
  128   2HB   GLN  17          1HB       GLN  17  -2.019  10.254  -1.746
  129   1HG   GLN  17          2HG       GLN  17  -1.042   9.344  -3.691
  130   2HG   GLN  17          1HG       GLN  17   0.319   9.502  -2.580
  131   1HE2  GLN  17          1HE2      GLN  17  -2.158   7.084  -3.596
  132   2HE2  GLN  17          2HE2      GLN  17  -1.145   5.739  -3.379
  133    H    LYS  18           H        LYS  18  -1.212  11.248   1.230
  134    HA   LYS  18           HA       LYS  18   0.742  12.997  -0.057
  135   1HB   LYS  18          2HB       LYS  18  -1.379  13.247   1.945
  136   2HB   LYS  18          1HB       LYS  18   0.059  14.178   2.366
  137   1HG   LYS  18          2HG       LYS  18  -0.076  15.507   0.457
  138   2HG   LYS  18          1HG       LYS  18  -0.991  14.298  -0.444
  139   1HD   LYS  18          2HD       LYS  18  -2.889  14.693   1.223
  140   2HD   LYS  18          1HD       LYS  18  -1.985  16.108   1.765
  141   1HE   LYS  18          2HE       LYS  18  -2.105  17.123  -0.406
  142   2HE   LYS  18          1HE       LYS  18  -2.721  15.640  -1.133
  143   1HZ   LYS  18          1HZ       LYS  18  -4.495  17.233  -0.738
  144   2HZ   LYS  18          2HZ       LYS  18  -4.119  17.273   0.918
  145   3HZ   LYS  18          3HZ       LYS  18  -4.715  15.846   0.213
  146    H    GLU  19           H        GLU  19   0.527  11.236   3.035
  147    HA   GLU  19           HA       GLU  19   3.106  12.197   3.968
  148   1HB   GLU  19          2HB       GLU  19   1.365  11.419   5.540
  149   2HB   GLU  19          1HB       GLU  19   1.474   9.797   4.856
  150   1HG   GLU  19          2HG       GLU  19   3.468   9.347   5.887
  151   2HG   GLU  19          1HG       GLU  19   4.034  11.012   5.750
  152    H    GLU  20           H        GLU  20   1.961   9.181   2.448
  153    HA   GLU  20           HA       GLU  20   4.447   7.793   2.533
  154   1HB   GLU  20          2HB       GLU  20   2.377   6.635   1.967
  155   2HB   GLU  20          1HB       GLU  20   2.184   7.624   0.519
  156   1HG   GLU  20          2HG       GLU  20   3.184   5.303   0.149
  157   2HG   GLU  20          1HG       GLU  20   4.105   6.652  -0.518
  158    H    THR  21           H        THR  21   3.024   9.747  -0.112
  159    HA   THR  21           HA       THR  21   5.184   9.561  -1.915
  160    HB   THR  21           HB       THR  21   3.471  12.019  -1.457
  161    HG1  THR  21           HG1      THR  21   1.892  10.859  -2.160
  162   1HG2  THR  21          1HG2      THR  21   5.598  11.575  -3.192
  163   2HG2  THR  21          2HG2      THR  21   4.353  12.812  -3.377
  164   3HG2  THR  21          3HG2      THR  21   4.176  11.255  -4.186
  165    H    ARG  22           H        ARG  22   4.579  12.267   0.363
  166    HA   ARG  22           HA       ARG  22   6.858  13.758   0.051
  167   1HB   ARG  22          2HB       ARG  22   5.152  14.270   1.754
  168   2HB   ARG  22          1HB       ARG  22   5.703  12.903   2.724
  169   1HG   ARG  22          2HG       ARG  22   7.261  14.217   3.671
  170   2HG   ARG  22          1HG       ARG  22   7.998  14.466   2.088
  171   1HD   ARG  22          2HD       ARG  22   7.365  16.616   3.149
  172   2HD   ARG  22          1HD       ARG  22   6.476  16.343   1.651
  173    HE   ARG  22           HE       ARG  22   4.807  15.308   3.604
  174   1HH1  ARG  22          1HH2      ARG  22   6.467  18.281   3.055
  175   2HH1  ARG  22          2HH2      ARG  22   5.272  19.249   3.851
  176   1HH2  ARG  22          2HH1      ARG  22   3.236  16.557   4.646
  177   2HH2  ARG  22          1HH1      ARG  22   3.443  18.273   4.751
  178    H    ASP  23           H        ASP  23   6.676  10.814   2.080
  179    HA   ASP  23           HA       ASP  23   9.375  10.747   2.899
  180   1HB   ASP  23          2HB       ASP  23   7.273   9.155   3.385
  181   2HB   ASP  23          1HB       ASP  23   8.079   8.161   2.171
  182    H    ILE  24           H        ILE  24   7.893   9.431  -0.065
  183    HA   ILE  24           HA       ILE  24  10.298   8.258  -1.090
  184    HB   ILE  24           HB       ILE  24   7.950   9.357  -2.663
  185   1HG1  ILE  24          2HG1      ILE  24   8.384   6.569  -1.545
  186   2HG1  ILE  24          1HG1      ILE  24   7.305   7.767  -0.831
  187   1HG2  ILE  24          1HG2      ILE  24  10.392   7.897  -3.340
  188   2HG2  ILE  24          2HG2      ILE  24   9.240   8.705  -4.404
  189   3HG2  ILE  24          3HG2      ILE  24   8.936   7.052  -3.868
  190   1HD1  ILE  24          1HD1      ILE  24   5.687   7.287  -2.321
  191   2HD1  ILE  24          2HD1      ILE  24   6.682   5.946  -2.886
  192   3HD1  ILE  24          3HD1      ILE  24   6.796   7.521  -3.672
  193    H    ILE  25           H        ILE  25   8.676  11.250  -2.221
  194    HA   ILE  25           HA       ILE  25  10.638  12.267  -3.869
  195    HB   ILE  25           HB       ILE  25   9.327  14.076  -1.843
  196   1HG1  ILE  25          2HG1      ILE  25   7.538  12.604  -2.457
  197   2HG1  ILE  25          1HG1      ILE  25   7.351  14.042  -3.459
  198   1HG2  ILE  25          1HG2      ILE  25  10.640  15.311  -3.352
  199   2HG2  ILE  25          2HG2      ILE  25   9.036  15.376  -4.082
  200   3HG2  ILE  25          3HG2      ILE  25  10.243  14.254  -4.708
  201   1HD1  ILE  25          1HD1      ILE  25   7.090  12.104  -4.885
  202   2HD1  ILE  25          2HD1      ILE  25   8.590  11.401  -4.280
  203   3HD1  ILE  25          3HD1      ILE  25   8.636  12.860  -5.272
  204    H    GLN  26           H        GLN  26  10.532  12.747  -0.319
  205    HA   GLN  26           HA       GLN  26  12.955  14.201  -0.102
  206   1HB   GLN  26          2HB       GLN  26  11.687  12.248   1.843
  207   2HB   GLN  26          1HB       GLN  26  13.012  13.340   2.249
  208   1HG   GLN  26          2HG       GLN  26  10.742  14.669   0.928
  209   2HG   GLN  26          1HG       GLN  26  10.342  13.960   2.493
  210   1HE2  GLN  26          1HE2      GLN  26  10.894  16.883   1.541
  211   2HE2  GLN  26          2HE2      GLN  26  12.003  17.461   2.689
  212    H    ALA  27           H        ALA  27  12.464  10.684   0.395
  213    HA   ALA  27           HA       ALA  27  15.101   9.887   0.749
  214   1HB   ALA  27          1HB       ALA  27  14.466   7.721  -0.073
  215   2HB   ALA  27          2HB       ALA  27  13.171   8.406  -1.055
  216   3HB   ALA  27          3HB       ALA  27  13.038   8.403   0.704
  217    H    LEU  28           H        LEU  28  13.461  10.273  -2.417
  218    HA   LEU  28           HA       LEU  28  15.643   9.650  -4.072
  219   1HB   LEU  28          2HB       LEU  28  13.212  11.343  -4.345
  220   2HB   LEU  28          1HB       LEU  28  14.505  11.633  -5.510
  221    HG   LEU  28           HG       LEU  28  14.534   9.254  -6.107
  222   1HD1  LEU  28          1HD1      LEU  28  12.564   7.871  -5.173
  223   2HD1  LEU  28          2HD1      LEU  28  12.463   9.101  -3.914
  224   3HD1  LEU  28          3HD1      LEU  28  13.934   8.146  -4.099
  225   1HD2  LEU  28          1HD2      LEU  28  11.807  10.577  -6.137
  226   2HD2  LEU  28          2HD2      LEU  28  12.186   9.118  -7.051
  227   3HD2  LEU  28          3HD2      LEU  28  13.031  10.625  -7.406
  228    H    LEU  29           H        LEU  29  14.684  12.975  -3.119
  229    HA   LEU  29           HA       LEU  29  16.866  14.387  -4.058
  230   1HB   LEU  29          2HB       LEU  29  15.042  14.695  -1.749
  231   2HB   LEU  29          1HB       LEU  29  16.568  15.568  -1.611
  232    HG   LEU  29           HG       LEU  29  14.980  15.706  -4.162
  233   1HD1  LEU  29          1HD1      LEU  29  13.433  16.287  -2.310
  234   2HD1  LEU  29          2HD1      LEU  29  13.831  17.696  -3.294
  235   3HD1  LEU  29          3HD1      LEU  29  14.601  17.471  -1.723
  236   1HD2  LEU  29          1HD2      LEU  29  16.144  17.849  -4.363
  237   2HD2  LEU  29          2HD2      LEU  29  17.317  16.575  -4.033
  238   3HD2  LEU  29          3HD2      LEU  29  16.814  17.664  -2.742
  239    H    GLU  30           H        GLU  30  16.717  12.677  -0.918
  240    HA   GLU  30           HA       GLU  30  19.377  13.230  -0.100
  241   1HB   GLU  30          2HB       GLU  30  17.274  11.827   0.966
  242   2HB   GLU  30          1HB       GLU  30  18.389  10.524   0.548
  243   1HG   GLU  30          2HG       GLU  30  20.162  12.172   1.666
  244   2HG   GLU  30          1HG       GLU  30  18.726  12.752   2.512
  245    H    ASP  31           H        ASP  31  18.127  11.051  -2.507
  246    HA   ASP  31           HA       ASP  31  20.586   9.467  -2.679
  247   1HB   ASP  31          2HB       ASP  31  18.340   9.641  -4.706
  248   2HB   ASP  31          1HB       ASP  31  19.510   8.336  -4.514
  249    H    GLY  32           H        GLY  32  19.527  12.503  -3.803
  250   1HA   GLY  32          2HA       GLY  32  20.971  14.065  -4.921
  251   2HA   GLY  32          1HA       GLY  32  21.942  12.713  -5.505
  252    H    SER  33           H        SER  33  18.592  12.192  -5.844
  253    HA   SER  33           HA       SER  33  18.724  12.031  -8.692
  254   1HB   SER  33          2HB       SER  33  16.994  10.800  -7.608
  255   2HB   SER  33          1HB       SER  33  16.409  12.227  -6.758
  256    HG   SER  33           HG       SER  33  15.394  11.370  -8.887
  257    H    ASP  34           H        ASP  34  19.675  14.093  -9.316
  258    HA   ASP  34           HA       ASP  34  18.728  16.648  -8.717
  259   1HB   ASP  34          2HB       ASP  34  19.403  16.154 -11.571
  260   2HB   ASP  34          1HB       ASP  34  20.032  17.372 -10.460
  261    HA   PRO  35           HA       PRO  35  14.587  16.459 -10.399
  262   1HB   PRO  35          2HB       PRO  35  13.979  19.117 -10.180
  263   2HB   PRO  35          1HB       PRO  35  13.989  18.005  -8.798
  264   1HG   PRO  35          2HG       PRO  35  16.038  19.984  -9.649
  265   2HG   PRO  35          1HG       PRO  35  15.499  19.542  -8.019
  266   1HD   PRO  35          2HD       PRO  35  17.830  18.614  -9.132
  267   2HD   PRO  35          1HD       PRO  35  16.912  17.720  -7.901
  268    H    ASP  36           H        ASP  36  17.245  17.904 -11.869
  269    HA   ASP  36           HA       ASP  36  15.781  19.175 -14.074
  270   1HB   ASP  36          2HB       ASP  36  18.731  18.589 -13.681
  271   2HB   ASP  36          1HB       ASP  36  18.064  19.502 -15.033
  272    H    ALA  37           H        ALA  37  16.523  16.018 -13.246
  273    HA   ALA  37           HA       ALA  37  16.974  15.109 -16.026
  274   1HB   ALA  37          1HB       ALA  37  18.256  13.761 -14.659
  275   2HB   ALA  37          2HB       ALA  37  16.772  12.808 -14.683
  276   3HB   ALA  37          3HB       ALA  37  17.120  13.866 -13.315
  277    H    LEU  38           H        LEU  38  14.332  16.144 -14.494
  278    HA   LEU  38           HA       LEU  38  12.034  15.696 -14.696
  279   1HB   LEU  38          2HB       LEU  38  13.145  15.500 -17.198
  280   2HB   LEU  38          1HB       LEU  38  12.376  13.921 -17.032
  281    HG   LEU  38           HG       LEU  38  10.367  15.418 -16.100
  282   1HD1  LEU  38          1HD1      LEU  38  10.273  17.589 -16.923
  283   2HD1  LEU  38          2HD1      LEU  38  11.402  17.251 -18.235
  284   3HD1  LEU  38          3HD1      LEU  38  11.998  17.447 -16.587
  285   1HD2  LEU  38          1HD2      LEU  38  10.105  13.914 -17.963
  286   2HD2  LEU  38          2HD2      LEU  38  11.114  14.927 -18.995
  287   3HD2  LEU  38          3HD2      LEU  38   9.520  15.491 -18.493
  288    H    TYR  39           H        TYR  39  10.435  13.953 -14.416
  289    HA   TYR  39           HA       TYR  39  11.647  11.286 -13.851
  290   1HB   TYR  39          2HB       TYR  39  10.513  13.161 -11.931
  291   2HB   TYR  39          1HB       TYR  39   9.659  11.619 -11.911
  292    HD1  TYR  39           HD1      TYR  39  13.200  12.854 -12.195
  293    HD2  TYR  39           HD2      TYR  39  10.498   9.987 -10.482
  294    HE1  TYR  39           HE1      TYR  39  15.081  11.826 -10.951
  295    HE2  TYR  39           HE2      TYR  39  12.381   8.959  -9.237
  296    HH   TYR  39           HH       TYR  39  15.700   9.881  -9.837
  297    H    GLU  40           H        GLU  40  10.294   9.554 -14.332
  298    HA   GLU  40           HA       GLU  40   7.772  10.253 -15.743
  299   1HB   GLU  40          2HB       GLU  40   9.085   8.874 -17.130
  300   2HB   GLU  40          1HB       GLU  40   9.610   7.863 -15.784
  301   1HG   GLU  40          2HG       GLU  40   7.573   6.717 -15.676
  302   2HG   GLU  40          1HG       GLU  40   6.692   8.007 -16.496
  303    H    ILE  41           H        ILE  41   5.958  10.108 -14.526
  304    HA   ILE  41           HA       ILE  41   5.939   8.265 -12.190
  305    HB   ILE  41           HB       ILE  41   3.662  10.105 -12.784
  306   1HG1  ILE  41          2HG1      ILE  41   5.690  11.449 -13.307
  307   2HG1  ILE  41          1HG1      ILE  41   4.881  12.023 -11.850
  308   1HG2  ILE  41          1HG2      ILE  41   3.914  10.425 -10.277
  309   2HG2  ILE  41          2HG2      ILE  41   5.186   9.205 -10.326
  310   3HG2  ILE  41          3HG2      ILE  41   3.537   8.779 -10.783
  311   1HD1  ILE  41          1HD1      ILE  41   7.426  11.778 -11.704
  312   2HD1  ILE  41          2HD1      ILE  41   7.156  10.036 -11.750
  313   3HD1  ILE  41          3HD1      ILE  41   6.494  10.995 -10.426
  314    H    GLU  42           H        GLU  42   4.490   6.547 -12.076
  315    HA   GLU  42           HA       GLU  42   2.672   6.190 -14.422
  316   1HB   GLU  42          2HB       GLU  42   3.322   3.975 -14.708
  317   2HB   GLU  42          1HB       GLU  42   4.851   4.704 -14.220
  318   1HG   GLU  42          2HG       GLU  42   3.999   4.136 -11.789
  319   2HG   GLU  42          1HG       GLU  42   2.996   2.959 -12.637
  320    H    HIS  43           H        HIS  43   0.640   5.253 -13.941
  321    HA   HIS  43           HA       HIS  43   0.092   4.828 -11.031
  322   1HB   HIS  43          2HB       HIS  43  -1.922   5.976 -12.969
  323   2HB   HIS  43          1HB       HIS  43  -1.975   5.987 -11.207
  324    HD2  HIS  43           HD2      HIS  43   0.813   7.401 -13.705
  325    HE1  HIS  43           HE1      HIS  43  -0.095  10.329 -10.801
  326    HE2  HIS  43           HE2      HIS  43   1.348   9.794 -12.818
  327    H    HIS  44           H        HIS  44  -1.383   3.150 -10.551
  328    HA   HIS  44           HA       HIS  44  -2.034   1.375 -12.869
  329   1HB   HIS  44          2HB       HIS  44  -1.402   0.734  -9.978
  330   2HB   HIS  44          1HB       HIS  44  -2.091  -0.447 -11.092
  331    HD2  HIS  44           HD2      HIS  44  -0.341  -0.624 -13.590
  332    HE1  HIS  44           HE1      HIS  44   3.122   0.113 -11.287
  333    HE2  HIS  44           HE2      HIS  44   2.264  -0.728 -13.521
  334    H    LEU  45           H        LEU  45  -4.180   1.129 -13.273
  335    HA   LEU  45           HA       LEU  45  -6.092   1.516 -11.013
  336   1HB   LEU  45          2HB       LEU  45  -6.425   2.631 -13.816
  337   2HB   LEU  45          1HB       LEU  45  -7.587   2.779 -12.497
  338    HG   LEU  45           HG       LEU  45  -5.372   3.740 -11.270
  339   1HD1  LEU  45          1HD1      LEU  45  -5.144   4.609 -14.168
  340   2HD1  LEU  45          2HD1      LEU  45  -4.045   3.484 -13.369
  341   3HD1  LEU  45          3HD1      LEU  45  -4.138   5.160 -12.827
  342   1HD2  LEU  45          1HD2      LEU  45  -6.290   6.041 -12.305
  343   2HD2  LEU  45          2HD2      LEU  45  -7.213   5.124 -11.114
  344   3HD2  LEU  45          3HD2      LEU  45  -7.596   4.979 -12.829
  345    H    PHE  46           H        PHE  46  -7.719  -0.012 -10.976
  346    HA   PHE  46           HA       PHE  46  -7.881  -1.835 -13.342
  347   1HB   PHE  46          2HB       PHE  46  -8.809  -3.139 -10.967
  348   2HB   PHE  46          1HB       PHE  46  -7.429  -3.564 -11.979
  349    HD1  PHE  46           HD1      PHE  46  -8.439  -2.432  -8.770
  350    HD2  PHE  46           HD2      PHE  46  -5.272  -2.091 -11.652
  351    HE1  PHE  46           HE1      PHE  46  -6.895  -1.679  -6.982
  352    HE2  PHE  46           HE2      PHE  46  -3.727  -1.338  -9.864
  353    HZ   PHE  46           HZ       PHE  46  -4.538  -1.133  -7.530
  354    H    ALA  47           H        ALA  47 -10.026  -2.934 -13.543
  355    HA   ALA  47           HA       ALA  47 -12.272  -1.498 -12.240
  356   1HB   ALA  47          1HB       ALA  47 -11.492  -0.523 -14.599
  357   2HB   ALA  47          2HB       ALA  47 -13.200  -0.641 -14.176
  358   3HB   ALA  47          3HB       ALA  47 -12.458  -1.870 -15.201
  359    H    GLU  48           H        GLU  48 -14.422  -2.584 -13.255
  360    HA   GLU  48           HA       GLU  48 -13.898  -5.529 -13.362
  361   1HB   GLU  48          2HB       GLU  48 -16.397  -4.287 -12.207
  362   2HB   GLU  48          1HB       GLU  48 -15.795  -5.932 -11.995
  363   1HG   GLU  48          2HG       GLU  48 -13.802  -4.988 -10.800
  364   2HG   GLU  48          1HG       GLU  48 -14.553  -3.395 -10.897
  365    H    ASP  49           H        ASP  49 -15.763  -2.809 -14.574
  366    HA   ASP  49           HA       ASP  49 -17.107  -4.646 -16.507
  367   1HB   ASP  49          2HB       ASP  49 -18.009  -2.358 -15.011
  368   2HB   ASP  49          1HB       ASP  49 -18.144  -2.012 -16.736
  369    H    PHE  50           H        PHE  50 -15.650  -4.828 -18.186
  370    HA   PHE  50           HA       PHE  50 -13.720  -3.196 -19.170
  371   1HB   PHE  50          2HB       PHE  50 -15.697  -4.188 -21.195
  372   2HB   PHE  50          1HB       PHE  50 -13.934  -4.263 -21.225
  373    HD1  PHE  50           HD1      PHE  50 -12.738  -6.083 -20.208
  374    HD2  PHE  50           HD2      PHE  50 -16.991  -5.734 -19.723
  375    HE1  PHE  50           HE1      PHE  50 -12.818  -8.374 -19.262
  376    HE2  PHE  50           HE2      PHE  50 -17.072  -8.025 -18.776
  377    HZ   PHE  50           HZ       PHE  50 -14.985  -9.345 -18.548
  378    H    ASP  51           H        ASP  51 -17.205  -2.689 -19.731
  379    HA   ASP  51           HA       ASP  51 -17.069  -0.492 -21.479
  380   1HB   ASP  51          2HB       ASP  51 -19.202  -1.509 -20.875
  381   2HB   ASP  51          1HB       ASP  51 -19.010  -0.987 -19.201
  382    H    LYS  52           H        LYS  52 -17.823   0.021 -18.032
  383    HA   LYS  52           HA       LYS  52 -17.085   2.696 -17.871
  384   1HB   LYS  52          2HB       LYS  52 -18.099   1.282 -16.026
  385   2HB   LYS  52          1HB       LYS  52 -16.477   0.671 -15.700
  386   1HG   LYS  52          2HG       LYS  52 -16.092   2.478 -14.421
  387   2HG   LYS  52          1HG       LYS  52 -16.250   3.491 -15.855
  388   1HD   LYS  52          2HD       LYS  52 -18.646   2.530 -14.278
  389   2HD   LYS  52          1HD       LYS  52 -17.824   4.046 -13.913
  390   1HE   LYS  52          2HE       LYS  52 -19.223   4.956 -15.450
  391   2HE   LYS  52          1HE       LYS  52 -18.160   4.214 -16.644
  392   1HZ   LYS  52          1HZ       LYS  52 -20.304   3.483 -17.172
  393   2HZ   LYS  52          2HZ       LYS  52 -20.699   3.163 -15.551
  394   3HZ   LYS  52          3HZ       LYS  52 -19.591   2.169 -16.370
  395    H    LEU  53           H        LEU  53 -15.000  -0.088 -18.126
  396    HA   LEU  53           HA       LEU  53 -12.575   1.140 -17.193
  397   1HB   LEU  53          2HB       LEU  53 -13.114  -1.369 -17.719
  398   2HB   LEU  53          1HB       LEU  53 -12.614  -0.950 -19.357
  399    HG   LEU  53           HG       LEU  53 -10.947  -0.493 -16.865
  400   1HD1  LEU  53          1HD1      LEU  53  -9.589  -2.347 -17.633
  401   2HD1  LEU  53          2HD1      LEU  53 -10.559  -2.508 -19.097
  402   3HD1  LEU  53          3HD1      LEU  53 -11.259  -2.902 -17.527
  403   1HD2  LEU  53          1HD2      LEU  53 -10.262   1.126 -18.431
  404   2HD2  LEU  53          2HD2      LEU  53 -10.565   0.061 -19.803
  405   3HD2  LEU  53          3HD2      LEU  53  -9.172  -0.221 -18.759
  406    H    GLU  54           H        GLU  54 -13.726   0.560 -20.541
  407    HA   GLU  54           HA       GLU  54 -11.670   2.077 -21.800
  408   1HB   GLU  54          2HB       GLU  54 -12.913   0.679 -23.234
  409   2HB   GLU  54          1HB       GLU  54 -14.457   1.276 -22.624
  410   1HG   GLU  54          2HG       GLU  54 -14.267   3.317 -23.785
  411   2HG   GLU  54          1HG       GLU  54 -12.529   3.128 -24.015
  412    H    LYS  55           H        LYS  55 -14.712   3.038 -20.315
  413    HA   LYS  55           HA       LYS  55 -14.807   5.693 -21.421
  414   1HB   LYS  55          2HB       LYS  55 -16.111   4.245 -19.170
  415   2HB   LYS  55          1HB       LYS  55 -16.104   6.006 -19.080
  416   1HG   LYS  55          2HG       LYS  55 -16.972   4.518 -21.567
  417   2HG   LYS  55          1HG       LYS  55 -18.102   4.947 -20.282
  418   1HD   LYS  55          2HD       LYS  55 -16.904   7.341 -20.616
  419   2HD   LYS  55          1HD       LYS  55 -16.719   6.697 -22.248
  420   1HE   LYS  55          2HE       LYS  55 -19.324   6.895 -20.708
  421   2HE   LYS  55          1HE       LYS  55 -18.836   7.936 -22.046
  422   1HZ   LYS  55          1HZ       LYS  55 -19.283   5.004 -22.167
  423   2HZ   LYS  55          2HZ       LYS  55 -18.705   5.950 -23.454
  424   3HZ   LYS  55          3HZ       LYS  55 -20.272   6.202 -22.847
  425    H    ALA  56           H        ALA  56 -13.848   4.633 -18.130
  426    HA   ALA  56           HA       ALA  56 -12.733   7.146 -17.375
  427   1HB   ALA  56          1HB       ALA  56 -13.260   4.905 -16.012
  428   2HB   ALA  56          2HB       ALA  56 -12.078   6.080 -15.435
  429   3HB   ALA  56          3HB       ALA  56 -11.539   4.633 -16.288
  430    H    ALA  57           H        ALA  57 -11.308   4.331 -18.994
  431    HA   ALA  57           HA       ALA  57  -8.587   5.205 -18.876
  432   1HB   ALA  57          1HB       ALA  57  -8.126   3.471 -20.365
  433   2HB   ALA  57          2HB       ALA  57  -9.645   3.681 -21.237
  434   3HB   ALA  57          3HB       ALA  57  -9.640   2.917 -19.647
  435    H    VAL  58           H        VAL  58 -11.063   5.619 -21.427
  436    HA   VAL  58           HA       VAL  58  -9.492   7.071 -23.262
  437    HB   VAL  58           HB       VAL  58 -12.437   7.237 -22.595
  438   1HG1  VAL  58          1HG1      VAL  58 -12.561   8.415 -24.863
  439   2HG1  VAL  58          2HG1      VAL  58 -10.825   8.680 -24.708
  440   3HG1  VAL  58          3HG1      VAL  58 -11.932   9.378 -23.526
  441   1HG2  VAL  58          1HG2      VAL  58 -10.938   5.322 -23.911
  442   2HG2  VAL  58          2HG2      VAL  58 -11.527   6.325 -25.237
  443   3HG2  VAL  58          3HG2      VAL  58 -12.670   5.574 -24.123
  444    H    GLU  59           H        GLU  59 -11.492   8.347 -20.579
  445    HA   GLU  59           HA       GLU  59 -10.882  11.087 -20.973
  446   1HB   GLU  59          2HB       GLU  59 -12.380   9.665 -19.158
  447   2HB   GLU  59          1HB       GLU  59 -11.057  10.259 -18.154
  448   1HG   GLU  59          2HG       GLU  59 -12.573  12.035 -18.044
  449   2HG   GLU  59          1HG       GLU  59 -11.518  12.539 -19.365
  450    H    ALA  60           H        ALA  60  -9.389   8.941 -18.517
  451    HA   ALA  60           HA       ALA  60  -7.362  10.462 -17.546
  452   1HB   ALA  60          1HB       ALA  60  -7.595   8.069 -17.010
  453   2HB   ALA  60          2HB       ALA  60  -5.930   8.447 -17.451
  454   3HB   ALA  60          3HB       ALA  60  -6.989   7.646 -18.611
  455    H    PHE  61           H        PHE  61  -7.295   8.931 -20.767
  456    HA   PHE  61           HA       PHE  61  -4.685   9.937 -21.459
  457   1HB   PHE  61          2HB       PHE  61  -5.358   8.164 -22.822
  458   2HB   PHE  61          1HB       PHE  61  -7.000   8.785 -22.991
  459    HD1  PHE  61           HD1      PHE  61  -3.629  10.353 -23.514
  460    HD2  PHE  61           HD2      PHE  61  -7.413   9.275 -25.235
  461    HE1  PHE  61           HE1      PHE  61  -2.988  11.480 -25.628
  462    HE2  PHE  61           HE2      PHE  61  -6.773  10.402 -27.350
  463    HZ   PHE  61           HZ       PHE  61  -4.560  11.504 -27.546
  464    H    LYS  62           H        LYS  62  -7.935  10.995 -22.555
  465    HA   LYS  62           HA       LYS  62  -7.156  13.299 -23.940
  466   1HB   LYS  62          2HB       LYS  62  -9.615  12.937 -22.198
  467   2HB   LYS  62          1HB       LYS  62  -9.414  14.184 -23.430
  468   1HG   LYS  62          2HG       LYS  62  -9.170  12.462 -25.164
  469   2HG   LYS  62          1HG       LYS  62  -9.320  11.196 -23.943
  470   1HD   LYS  62          2HD       LYS  62 -11.526  11.279 -24.557
  471   2HD   LYS  62          1HD       LYS  62 -11.558  12.610 -23.400
  472   1HE   LYS  62          2HE       LYS  62 -10.888  14.103 -25.410
  473   2HE   LYS  62          1HE       LYS  62 -11.402  12.742 -26.409
  474   1HZ   LYS  62          1HZ       LYS  62 -13.349  13.176 -24.452
  475   2HZ   LYS  62          2HZ       LYS  62 -13.487  13.377 -26.133
  476   3HZ   LYS  62          3HZ       LYS  62 -12.993  14.677 -25.158
  477    H    MET  63           H        MET  63  -7.043  12.696 -20.530
  478    HA   MET  63           HA       MET  63  -7.035  15.486 -19.708
  479   1HB   MET  63          2HB       MET  63  -7.459  13.281 -18.307
  480   2HB   MET  63          1HB       MET  63  -5.709  13.334 -18.094
  481   1HG   MET  63          2HG       MET  63  -6.140  14.747 -16.376
  482   2HG   MET  63          1HG       MET  63  -6.432  15.953 -17.631
  483   1HE   MET  63          1HE       MET  63  -7.587  13.587 -15.108
  484   2HE   MET  63          2HE       MET  63  -8.584  12.747 -16.292
  485   3HE   MET  63          3HE       MET  63  -9.350  13.680 -15.009
  486    H    GLY  64           H        GLY  64  -4.458  13.016 -20.022
  487   1HA   GLY  64          2HA       GLY  64  -2.513  14.311 -21.368
  488   2HA   GLY  64          1HA       GLY  64  -2.410  15.128 -19.808
  489    H    PHE  65           H        PHE  65  -3.211  11.717 -20.299
  490    HA   PHE  65           HA       PHE  65  -0.621  11.020 -18.968
  491   1HB   PHE  65          2HB       PHE  65  -3.359   9.776 -18.570
  492   2HB   PHE  65          1HB       PHE  65  -1.863   9.117 -17.910
  493    HD1  PHE  65           HD1      PHE  65  -3.680  12.403 -18.091
  494    HD2  PHE  65           HD2      PHE  65  -1.283   9.722 -15.743
  495    HE1  PHE  65           HE1      PHE  65  -3.851  13.946 -16.156
  496    HE2  PHE  65           HE2      PHE  65  -1.451  11.264 -13.809
  497    HZ   PHE  65           HZ       PHE  65  -2.737  13.376 -14.015
  498    H    GLU  66           H        GLU  66   0.229   8.897 -19.559
  499    HA   GLU  66           HA       GLU  66  -0.510   8.165 -22.341
  500   1HB   GLU  66          2HB       GLU  66   1.891   7.618 -20.592
  501   2HB   GLU  66          1HB       GLU  66   1.617   6.715 -22.082
  502   1HG   GLU  66          2HG       GLU  66   1.792   8.646 -23.428
  503   2HG   GLU  66          1HG       GLU  66   1.552   9.729 -22.056
  504    H    VAL  67           H        VAL  67  -2.554   7.213 -21.296
  505    HA   VAL  67           HA       VAL  67  -2.686   5.070 -19.553
  506    HB   VAL  67           HB       VAL  67  -4.623   6.138 -20.781
  507   1HG1  VAL  67          1HG1      VAL  67  -5.232   5.193 -22.962
  508   2HG1  VAL  67          2HG1      VAL  67  -3.793   4.174 -22.940
  509   3HG1  VAL  67          3HG1      VAL  67  -3.632   5.927 -23.052
  510   1HG2  VAL  67          1HG2      VAL  67  -4.455   3.107 -20.792
  511   2HG2  VAL  67          2HG2      VAL  67  -5.949   4.041 -20.850
  512   3HG2  VAL  67          3HG2      VAL  67  -4.921   4.110 -19.419
  513    H    LEU  68           H        LEU  68  -2.700   2.736 -19.886
  514    HA   LEU  68           HA       LEU  68  -1.214   1.800 -22.291
  515   1HB   LEU  68          2HB       LEU  68  -0.006   2.102 -19.799
  516   2HB   LEU  68          1HB       LEU  68  -0.428   0.391 -19.853
  517    HG   LEU  68           HG       LEU  68   0.611   0.344 -22.185
  518   1HD1  LEU  68          1HD1      LEU  68   0.798   2.570 -22.863
  519   2HD1  LEU  68          2HD1      LEU  68   2.436   2.239 -22.300
  520   3HD1  LEU  68          3HD1      LEU  68   1.310   3.116 -21.266
  521   1HD2  LEU  68          1HD2      LEU  68   2.836   0.025 -21.305
  522   2HD2  LEU  68          2HD2      LEU  68   1.702  -0.476 -20.049
  523   3HD2  LEU  68          3HD2      LEU  68   2.506   1.091 -19.939
  524    H    GLU  69           H        GLU  69  -1.996  -0.141 -23.056
  525    HA   GLU  69           HA       GLU  69  -4.494  -1.134 -22.405
  526   1HB   GLU  69          2HB       GLU  69  -2.103  -2.257 -23.734
  527   2HB   GLU  69          1HB       GLU  69  -3.243  -3.453 -23.119
  528   1HG   GLU  69          2HG       GLU  69  -5.081  -2.122 -24.274
  529   2HG   GLU  69          1HG       GLU  69  -3.800  -1.208 -25.069
  530    H    ALA  70           H        ALA  70  -5.105  -3.175 -21.263
  531    HA   ALA  70           HA       ALA  70  -3.504  -3.469 -18.757
  532   1HB   ALA  70          1HB       ALA  70  -5.622  -4.252 -17.730
  533   2HB   ALA  70          2HB       ALA  70  -6.443  -4.017 -19.273
  534   3HB   ALA  70          3HB       ALA  70  -5.789  -2.630 -18.403
  535    H    GLU  71           H        GLU  71  -4.112  -5.809 -17.762
  536    HA   GLU  71           HA       GLU  71  -3.963  -7.822 -19.959
  537   1HB   GLU  71          2HB       GLU  71  -2.229  -9.031 -18.551
  538   2HB   GLU  71          1HB       GLU  71  -1.673  -7.525 -19.285
  539   1HG   GLU  71          2HG       GLU  71  -2.880  -7.477 -16.533
  540   2HG   GLU  71          1HG       GLU  71  -1.199  -7.968 -16.740
  541    H    GLU  72           H        GLU  72  -3.845 -10.120 -18.524
  542    HA   GLU  72           HA       GLU  72  -6.358  -9.994 -16.919
  543   1HB   GLU  72          2HB       GLU  72  -5.024 -12.440 -18.114
  544   2HB   GLU  72          1HB       GLU  72  -6.655 -12.332 -17.451
  545   1HG   GLU  72          2HG       GLU  72  -7.190 -10.629 -19.223
  546   2HG   GLU  72          1HG       GLU  72  -5.611 -10.954 -19.939
  547    H    THR  73           H        THR  73  -5.710  -9.646 -14.810
  548    HA   THR  73           HA       THR  73  -3.702 -11.575 -13.708
  549    HB   THR  73           HB       THR  73  -2.801  -9.279 -13.750
  550    HG1  THR  73           HG1      THR  73  -1.962  -9.861 -11.936
  551   1HG2  THR  73          1HG2      THR  73  -4.832  -8.370 -11.765
  552   2HG2  THR  73          2HG2      THR  73  -5.319  -8.420 -13.460
  553   3HG2  THR  73          3HG2      THR  73  -3.939  -7.439 -12.968
  554    H    GLU  74           H        GLU  74  -4.192 -10.640 -10.988
  555    HA   GLU  74           HA       GLU  74  -7.055 -11.142 -10.495
  556   1HB   GLU  74          2HB       GLU  74  -5.327 -13.317 -10.588
  557   2HB   GLU  74          1HB       GLU  74  -5.413 -12.938  -8.867
  558   1HG   GLU  74          2HG       GLU  74  -7.875 -12.987  -8.971
  559   2HG   GLU  74          1HG       GLU  74  -7.798 -13.355 -10.695
  560    H    ASP  75           H        ASP  75  -7.680 -10.098  -8.628
  561    HA   ASP  75           HA       ASP  75  -5.672  -8.522  -7.206
  562   1HB   ASP  75          2HB       ASP  75  -8.235  -8.013  -7.754
  563   2HB   ASP  75          1HB       ASP  75  -8.468  -8.781  -6.183
  564    H    GLU  76           H        GLU  76  -5.850  -8.539  -4.681
  565    HA   GLU  76           HA       GLU  76  -5.010 -11.117  -3.758
  566   1HB   GLU  76          2HB       GLU  76  -5.435  -8.443  -2.596
  567   2HB   GLU  76          1HB       GLU  76  -5.727  -9.761  -1.463
  568   1HG   GLU  76          2HG       GLU  76  -3.420  -9.316  -1.227
  569   2HG   GLU  76          1HG       GLU  76  -3.466 -10.717  -2.296
  570    H    ASP  77           H        ASP  77  -8.015 -10.282  -4.688
  571    HA   ASP  77           HA       ASP  77  -9.431 -11.649  -2.463
  572   1HB   ASP  77          2HB       ASP  77 -10.487  -9.614  -3.259
  573   2HB   ASP  77          1HB       ASP  77 -10.437 -10.193  -4.925
  574    H    GLY  78           H        GLY  78  -8.425 -12.127  -5.784
  575   1HA   GLY  78          2HA       GLY  78  -8.155 -14.356  -6.704
  576   2HA   GLY  78          1HA       GLY  78  -9.400 -14.931  -5.593
  577    H    ASN  79           H        ASN  79  -9.443 -12.144  -7.822
  578    HA   ASN  79           HA       ASN  79 -11.653 -13.490  -9.310
  579   1HB   ASN  79          2HB       ASN  79 -12.282 -11.634  -7.513
  580   2HB   ASN  79          1HB       ASN  79 -11.806 -10.541  -8.813
  581   1HD2  ASN  79          1HD2      ASN  79 -14.390 -10.228  -8.393
  582   2HD2  ASN  79          2HD2      ASN  79 -15.368 -11.112  -9.462
  583    H    LYS  80           H        LYS  80 -11.355 -13.367 -11.487
  584    HA   LYS  80           HA       LYS  80  -9.011 -12.097 -12.585
  585   1HB   LYS  80          2HB       LYS  80  -9.621 -13.881 -13.910
  586   2HB   LYS  80          1HB       LYS  80 -11.345 -13.623 -13.643
  587   1HG   LYS  80          2HG       LYS  80 -11.372 -11.757 -15.182
  588   2HG   LYS  80          1HG       LYS  80  -9.615 -11.798 -15.333
  589   1HD   LYS  80          2HD       LYS  80  -9.632 -13.756 -16.603
  590   2HD   LYS  80          1HD       LYS  80 -11.212 -14.254 -15.997
  591   1HE   LYS  80          2HE       LYS  80 -11.634 -13.523 -18.212
  592   2HE   LYS  80          1HE       LYS  80 -12.132 -12.168 -17.201
  593   1HZ   LYS  80          1HZ       LYS  80  -9.774 -12.438 -18.923
  594   2HZ   LYS  80          2HZ       LYS  80  -9.656 -11.469 -17.532
  595   3HZ   LYS  80          3HZ       LYS  80 -10.817 -11.115 -18.722
  596    H    LEU  81           H        LEU  81  -8.806 -10.098 -13.562
  597    HA   LEU  81           HA       LEU  81 -11.197  -8.548 -14.294
  598   1HB   LEU  81          2HB       LEU  81 -10.073  -6.603 -12.836
  599   2HB   LEU  81          1HB       LEU  81 -11.268  -7.705 -12.148
  600    HG   LEU  81           HG       LEU  81  -9.481  -9.147 -11.291
  601   1HD1  LEU  81          1HD1      LEU  81  -7.649  -7.086 -12.555
  602   2HD1  LEU  81          2HD1      LEU  81  -7.817  -8.773 -13.041
  603   3HD1  LEU  81          3HD1      LEU  81  -7.116  -8.372 -11.473
  604   1HD2  LEU  81          1HD2      LEU  81  -8.261  -7.034 -10.012
  605   2HD2  LEU  81          2HD2      LEU  81  -9.808  -7.734  -9.539
  606   3HD2  LEU  81          3HD2      LEU  81  -9.767  -6.304 -10.570
  607    H    LEU  82           H        LEU  82  -9.948  -6.040 -14.506
  608    HA   LEU  82           HA       LEU  82  -7.653  -6.620 -16.336
  609   1HB   LEU  82          2HB       LEU  82  -9.860  -4.585 -16.773
  610   2HB   LEU  82          1HB       LEU  82  -8.498  -4.886 -17.853
  611    HG   LEU  82           HG       LEU  82  -9.575  -7.416 -17.472
  612   1HD1  LEU  82          1HD1      LEU  82 -11.908  -7.307 -17.554
  613   2HD1  LEU  82          2HD1      LEU  82 -11.911  -5.635 -18.116
  614   3HD1  LEU  82          3HD1      LEU  82 -11.530  -5.999 -16.433
  615   1HD2  LEU  82          1HD2      LEU  82 -10.307  -5.479 -19.688
  616   2HD2  LEU  82          2HD2      LEU  82 -10.207  -7.236 -19.798
  617   3HD2  LEU  82          3HD2      LEU  82  -8.741  -6.282 -19.575
  618    H    CYS  83           H        CYS  83  -5.953  -5.133 -16.261
  619    HA   CYS  83           HA       CYS  83  -6.275  -2.797 -14.436
  620   1HB   CYS  83          2HB       CYS  83  -3.794  -4.518 -14.421
  621   2HB   CYS  83          1HB       CYS  83  -4.287  -3.301 -13.243
  622    HG   CYS  83           HG       CYS  83  -6.057  -5.845 -13.553
  623    H    PHE  84           H        PHE  84  -5.950  -1.096 -15.804
  624    HA   PHE  84           HA       PHE  84  -3.903  -1.360 -17.943
  625   1HB   PHE  84          2HB       PHE  84  -4.876   0.937 -18.614
  626   2HB   PHE  84          1HB       PHE  84  -5.915  -0.471 -18.825
  627    HD1  PHE  84           HD1      PHE  84  -7.390  -1.099 -16.708
  628    HD2  PHE  84           HD2      PHE  84  -5.718   2.785 -17.467
  629    HE1  PHE  84           HE1      PHE  84  -9.083  -0.077 -15.211
  630    HE2  PHE  84           HE2      PHE  84  -7.411   3.806 -15.967
  631    HZ   PHE  84           HZ       PHE  84  -9.092   2.375 -14.839
  632    H    ASP  85           H        ASP  85  -2.250   0.301 -18.165
  633    HA   ASP  85           HA       ASP  85  -1.652   1.661 -15.566
  634   1HB   ASP  85          2HB       ASP  85  -0.017  -0.077 -16.016
  635   2HB   ASP  85          1HB       ASP  85   0.233   0.531 -17.654
  636    H    ALA  86           H        ALA  86  -0.490   3.729 -15.768
  637    HA   ALA  86           HA       ALA  86  -0.790   5.054 -18.420
  638   1HB   ALA  86          1HB       ALA  86  -2.763   5.539 -16.864
  639   2HB   ALA  86          2HB       ALA  86  -1.902   6.951 -17.479
  640   3HB   ALA  86          3HB       ALA  86  -1.612   6.389 -15.832
  641    H    THR  87           H        THR  87   0.831   6.595 -18.826
  642    HA   THR  87           HA       THR  87   2.889   6.861 -16.670
  643    HB   THR  87           HB       THR  87   4.122   7.447 -19.118
  644    HG1  THR  87           HG1      THR  87   2.006   5.820 -19.464
  645   1HG2  THR  87          1HG2      THR  87   4.120   4.788 -17.671
  646   2HG2  THR  87          2HG2      THR  87   4.995   6.209 -17.098
  647   3HG2  THR  87          3HG2      THR  87   5.421   5.474 -18.644
  648    H    MET  88           H        MET  88   3.935   8.923 -16.493
  649    HA   MET  88           HA       MET  88   2.859  11.159 -18.101
  650   1HB   MET  88          2HB       MET  88   1.371  10.784 -16.044
  651   2HB   MET  88          1HB       MET  88   2.760  11.283 -15.080
  652   1HG   MET  88          2HG       MET  88   2.636  13.470 -15.781
  653   2HG   MET  88          1HG       MET  88   2.000  13.037 -17.368
  654   1HE   MET  88          1HE       MET  88  -0.968  15.088 -16.497
  655   2HE   MET  88          2HE       MET  88   0.437  14.769 -17.512
  656   3HE   MET  88          3HE       MET  88   0.651  15.532 -15.938
  657    H    GLN  89           H        GLN  89   4.380  12.819 -18.289
  658    HA   GLN  89           HA       GLN  89   6.955  12.354 -16.842
  659   1HB   GLN  89          2HB       GLN  89   7.472  14.190 -18.855
  660   2HB   GLN  89          1HB       GLN  89   7.769  12.454 -18.953
  661   1HG   GLN  89          2HG       GLN  89   5.131  13.752 -19.687
  662   2HG   GLN  89          1HG       GLN  89   6.394  13.369 -20.859
  663   1HE2  GLN  89          1HE2      GLN  89   6.890  10.940 -18.806
  664   2HE2  GLN  89          2HE2      GLN  89   5.783   9.787 -19.376
  665    H    SER  90           H        SER  90   7.240  13.716 -15.157
  666    HA   SER  90           HA       SER  90   6.690  16.594 -15.521
  667   1HB   SER  90          2HB       SER  90   4.832  16.647 -14.249
  668   2HB   SER  90          1HB       SER  90   4.880  14.891 -14.123
  669    HG   SER  90           HG       SER  90   6.622  16.416 -12.548
  670    H    ALA  91           H        ALA  91   7.800  17.889 -13.886
  671    HA   ALA  91           HA       ALA  91  10.353  16.852 -13.139
  672   1HB   ALA  91          1HB       ALA  91  10.018  19.250 -13.397
  673   2HB   ALA  91          2HB       ALA  91  10.523  18.925 -11.738
  674   3HB   ALA  91          3HB       ALA  91   8.828  19.258 -12.096
  675    H    LEU  92           H        LEU  92  11.157  16.417 -10.964
  676    HA   LEU  92           HA       LEU  92   9.321  14.806  -9.406
  677   1HB   LEU  92          2HB       LEU  92  11.828  14.428  -9.644
  678   2HB   LEU  92          1HB       LEU  92  12.052  15.791  -8.546
  679    HG   LEU  92           HG       LEU  92  10.438  14.542  -6.964
  680   1HD1  LEU  92          1HD1      LEU  92  11.102  12.417  -9.005
  681   2HD1  LEU  92          2HD1      LEU  92   9.518  12.873  -8.379
  682   3HD1  LEU  92          3HD1      LEU  92  10.654  12.003  -7.350
  683   1HD2  LEU  92          1HD2      LEU  92  12.259  13.557  -5.883
  684   2HD2  LEU  92          2HD2      LEU  92  13.072  14.703  -6.949
  685   3HD2  LEU  92          3HD2      LEU  92  12.981  12.998  -7.392
  686    H    ASP  93           H        ASP  93   7.675  16.057  -8.498
  687    HA   ASP  93           HA       ASP  93   8.531  17.892  -6.334
  688   1HB   ASP  93          2HB       ASP  93   8.078  19.209  -8.487
  689   2HB   ASP  93          1HB       ASP  93   6.391  18.734  -8.298
  690    H    ALA  94           H        ALA  94   7.346  17.450  -4.537
  691    HA   ALA  94           HA       ALA  94   5.269  15.467  -4.559
  692   1HB   ALA  94          1HB       ALA  94   4.973  16.952  -2.197
  693   2HB   ALA  94          2HB       ALA  94   6.689  17.062  -2.585
  694   3HB   ALA  94          3HB       ALA  94   5.925  15.482  -2.400
  695    H    LYS  95           H        LYS  95   5.249  18.998  -4.627
  696    HA   LYS  95           HA       LYS  95   2.503  19.435  -4.062
  697   1HB   LYS  95          2HB       LYS  95   4.461  21.134  -4.474
  698   2HB   LYS  95          1HB       LYS  95   3.939  21.046  -6.157
  699   1HG   LYS  95          2HG       LYS  95   1.719  21.783  -5.592
  700   2HG   LYS  95          1HG       LYS  95   2.049  21.633  -3.866
  701   1HD   LYS  95          2HD       LYS  95   4.045  23.326  -5.066
  702   2HD   LYS  95          1HD       LYS  95   2.443  23.915  -5.506
  703   1HE   LYS  95          2HE       LYS  95   3.234  23.219  -2.667
  704   2HE   LYS  95          1HE       LYS  95   3.341  24.849  -3.333
  705   1HZ   LYS  95          1HZ       LYS  95   1.222  24.177  -2.093
  706   2HZ   LYS  95          2HZ       LYS  95   0.829  23.312  -3.502
  707   3HZ   LYS  95          3HZ       LYS  95   1.058  24.994  -3.569
  708    H    LEU  96           H        LEU  96   4.107  18.977  -7.231
  709    HA   LEU  96           HA       LEU  96   1.676  18.968  -8.749
  710   1HB   LEU  96          2HB       LEU  96   4.148  19.141  -9.560
  711   2HB   LEU  96          1HB       LEU  96   4.111  17.378  -9.540
  712    HG   LEU  96           HG       LEU  96   1.909  17.630 -10.898
  713   1HD1  LEU  96          1HD1      LEU  96   2.157  19.758 -12.379
  714   2HD1  LEU  96          2HD1      LEU  96   3.116  20.387 -11.040
  715   3HD1  LEU  96          3HD1      LEU  96   1.433  19.930 -10.781
  716   1HD2  LEU  96          1HD2      LEU  96   4.674  18.229 -11.971
  717   2HD2  LEU  96          2HD2      LEU  96   3.288  17.946 -13.025
  718   3HD2  LEU  96          3HD2      LEU  96   3.841  16.676 -11.934
  719    H    ILE  97           H        ILE  97   3.771  16.132  -8.111
  720    HA   ILE  97           HA       ILE  97   2.115  14.069  -8.776
  721    HB   ILE  97           HB       ILE  97   3.687  14.259  -6.188
  722   1HG1  ILE  97          2HG1      ILE  97   4.487  12.980  -8.813
  723   2HG1  ILE  97          1HG1      ILE  97   4.897  14.646  -8.406
  724   1HG2  ILE  97          1HG2      ILE  97   3.767  11.662  -6.786
  725   2HG2  ILE  97          2HG2      ILE  97   2.230  12.039  -7.565
  726   3HG2  ILE  97          3HG2      ILE  97   2.441  12.341  -5.841
  727   1HD1  ILE  97          1HD1      ILE  97   6.713  13.827  -7.347
  728   2HD1  ILE  97          2HD1      ILE  97   6.117  12.172  -7.473
  729   3HD1  ILE  97          3HD1      ILE  97   5.607  13.194  -6.129
  730    H    ASP  98           H        ASP  98   1.705  16.207  -6.008
  731    HA   ASP  98           HA       ASP  98  -0.372  14.698  -4.714
  732   1HB   ASP  98          2HB       ASP  98   0.863  17.329  -4.444
  733   2HB   ASP  98          1HB       ASP  98  -0.875  17.382  -4.145
  734    H    GLU  99           H        GLU  99  -0.584  17.611  -6.797
  735    HA   GLU  99           HA       GLU  99  -3.433  17.505  -7.057
  736   1HB   GLU  99          2HB       GLU  99  -1.294  18.722  -8.825
  737   2HB   GLU  99          1HB       GLU  99  -3.022  18.947  -9.095
  738   1HG   GLU  99          2HG       GLU  99  -3.008  19.643  -6.543
  739   2HG   GLU  99          1HG       GLU  99  -1.305  19.972  -6.864
  740    H    GLN 100           H        GLN 100  -0.796  16.069  -8.932
  741    HA   GLN 100           HA       GLN 100  -2.313  15.109 -11.131
  742   1HB   GLN 100          2HB       GLN 100   0.298  15.002 -10.507
  743   2HB   GLN 100          1HB       GLN 100  -0.158  13.368 -10.026
  744   1HG   GLN 100          2HG       GLN 100   0.424  13.139 -12.303
  745   2HG   GLN 100          1HG       GLN 100  -1.337  13.237 -12.327
  746   1HE2  GLN 100          1HE2      GLN 100   1.437  15.564 -12.340
  747   2HE2  GLN 100          2HE2      GLN 100   0.764  16.576 -13.526
  748    H    VAL 101           H        VAL 101  -1.437  13.410  -8.100
  749    HA   VAL 101           HA       VAL 101  -3.091  11.123  -8.638
  750    HB   VAL 101           HB       VAL 101  -1.868  12.267  -6.124
  751   1HG1  VAL 101          1HG1      VAL 101  -2.631   9.753  -5.405
  752   2HG1  VAL 101          2HG1      VAL 101  -3.991  10.221  -6.425
  753   3HG1  VAL 101          3HG1      VAL 101  -3.563  11.201  -5.023
  754   1HG2  VAL 101          1HG2      VAL 101  -0.535  10.179  -6.271
  755   2HG2  VAL 101          2HG2      VAL 101  -0.374  11.152  -7.733
  756   3HG2  VAL 101          3HG2      VAL 101  -1.419   9.730  -7.731
  757    H    GLU 102           H        GLU 102  -3.604  13.808  -6.315
  758    HA   GLU 102           HA       GLU 102  -6.154  13.301  -5.444
  759   1HB   GLU 102          2HB       GLU 102  -4.732  15.376  -4.993
  760   2HB   GLU 102          1HB       GLU 102  -5.393  16.037  -6.488
  761   1HG   GLU 102          2HG       GLU 102  -7.575  16.130  -5.635
  762   2HG   GLU 102          1HG       GLU 102  -7.236  14.940  -4.377
  763    H    LYS 103           H        LYS 103  -5.235  14.347  -8.680
  764    HA   LYS 103           HA       LYS 103  -7.975  14.788  -9.563
  765   1HB   LYS 103          2HB       LYS 103  -5.341  14.485 -11.023
  766   2HB   LYS 103          1HB       LYS 103  -6.871  14.726 -11.867
  767   1HG   LYS 103          2HG       LYS 103  -6.449  16.607  -9.649
  768   2HG   LYS 103          1HG       LYS 103  -5.251  16.753 -10.935
  769   1HD   LYS 103          2HD       LYS 103  -6.950  17.095 -12.597
  770   2HD   LYS 103          1HD       LYS 103  -8.230  16.663 -11.463
  771   1HE   LYS 103          2HE       LYS 103  -8.373  18.798 -10.776
  772   2HE   LYS 103          1HE       LYS 103  -6.670  18.782 -10.317
  773   1HZ   LYS 103          1HZ       LYS 103  -7.895  19.606 -12.864
  774   2HZ   LYS 103          2HZ       LYS 103  -6.283  19.068 -12.834
  775   3HZ   LYS 103          3HZ       LYS 103  -6.749  20.419 -11.915
  776    H    LEU 104           H        LEU 104  -5.550  12.308 -10.476
  777    HA   LEU 104           HA       LEU 104  -7.269  10.569 -11.843
  778   1HB   LEU 104          2HB       LEU 104  -4.814  10.092 -10.159
  779   2HB   LEU 104          1HB       LEU 104  -5.679   8.736 -10.886
  780    HG   LEU 104           HG       LEU 104  -4.785  11.140 -12.491
  781   1HD1  LEU 104          1HD1      LEU 104  -3.337   8.536 -11.937
  782   2HD1  LEU 104          2HD1      LEU 104  -2.771  10.167 -11.576
  783   3HD1  LEU 104          3HD1      LEU 104  -2.910   9.632 -13.251
  784   1HD2  LEU 104          1HD2      LEU 104  -6.138  10.081 -13.976
  785   2HD2  LEU 104          2HD2      LEU 104  -6.196   8.609 -13.006
  786   3HD2  LEU 104          3HD2      LEU 104  -4.841   8.892 -14.100
  787    H    VAL 105           H        VAL 105  -7.086  11.230  -8.434
  788    HA   VAL 105           HA       VAL 105  -8.481   8.821  -7.585
  789    HB   VAL 105           HB       VAL 105  -8.031  11.485  -6.206
  790   1HG1  VAL 105          1HG1      VAL 105  -9.268   8.892  -5.260
  791   2HG1  VAL 105          2HG1      VAL 105  -9.950  10.516  -5.171
  792   3HG1  VAL 105          3HG1      VAL 105  -8.589  10.073  -4.140
  793   1HG2  VAL 105          1HG2      VAL 105  -6.109   9.784  -6.823
  794   2HG2  VAL 105          2HG2      VAL 105  -6.762   8.863  -5.468
  795   3HG2  VAL 105          3HG2      VAL 105  -6.161  10.502  -5.212
  796    H    ASN 106           H        ASN 106  -9.519  12.259  -7.616
  797    HA   ASN 106           HA       ASN 106 -12.246  11.843  -7.150
  798   1HB   ASN 106          2HB       ASN 106 -11.105  13.866  -9.100
  799   2HB   ASN 106          1HB       ASN 106 -12.640  13.981  -8.239
  800   1HD2  ASN 106          1HD2      ASN 106 -10.377  15.883  -8.035
  801   2HD2  ASN 106          2HD2      ASN 106  -9.886  15.868  -6.410
  802    H    LEU 107           H        LEU 107 -10.564  11.858 -10.301
  803    HA   LEU 107           HA       LEU 107 -12.820  11.340 -11.931
  804   1HB   LEU 107          2HB       LEU 107 -10.621  11.938 -12.854
  805   2HB   LEU 107          1HB       LEU 107  -9.957  10.403 -12.294
  806    HG   LEU 107           HG       LEU 107 -12.223   9.663 -13.742
  807   1HD1  LEU 107          1HD1      LEU 107 -12.496  11.837 -14.730
  808   2HD1  LEU 107          2HD1      LEU 107 -11.757  10.809 -15.958
  809   3HD1  LEU 107          3HD1      LEU 107 -10.770  11.966 -15.066
  810   1HD2  LEU 107          1HD2      LEU 107 -10.175   8.413 -13.804
  811   2HD2  LEU 107          2HD2      LEU 107  -9.280   9.791 -14.445
  812   3HD2  LEU 107          3HD2      LEU 107 -10.467   8.964 -15.455
  813    H    ALA 108           H        ALA 108 -10.457   8.942 -10.681
  814    HA   ALA 108           HA       ALA 108 -11.612   6.586 -11.509
  815   1HB   ALA 108          1HB       ALA 108 -11.001   5.795  -9.030
  816   2HB   ALA 108          2HB       ALA 108 -10.207   7.369  -8.993
  817   3HB   ALA 108          3HB       ALA 108  -9.747   6.178 -10.210
  818    H    GLU 109           H        GLU 109 -12.458   8.062  -8.353
  819    HA   GLU 109           HA       GLU 109 -14.706   6.436  -7.835
  820   1HB   GLU 109          2HB       GLU 109 -13.809   9.142  -6.945
  821   2HB   GLU 109          1HB       GLU 109 -15.483   8.690  -6.618
  822   1HG   GLU 109          2HG       GLU 109 -13.077   7.001  -5.871
  823   2HG   GLU 109          1HG       GLU 109 -13.929   8.070  -4.758
  824    H    LYS 110           H        LYS 110 -14.465   9.440  -9.715
  825    HA   LYS 110           HA       LYS 110 -17.173  10.020 -10.109
  826   1HB   LYS 110          2HB       LYS 110 -14.992  11.154 -11.063
  827   2HB   LYS 110          1HB       LYS 110 -15.305  10.120 -12.459
  828   1HG   LYS 110          2HG       LYS 110 -17.652  11.025 -12.516
  829   2HG   LYS 110          1HG       LYS 110 -17.187  12.167 -11.254
  830   1HD   LYS 110          2HD       LYS 110 -15.277  12.875 -12.817
  831   2HD   LYS 110          1HD       LYS 110 -16.128  11.981 -14.078
  832   1HE   LYS 110          2HE       LYS 110 -17.059  14.087 -14.364
  833   2HE   LYS 110          1HE       LYS 110 -18.205  13.384 -13.222
  834   1HZ   LYS 110          1HZ       LYS 110 -16.037  15.318 -12.711
  835   2HZ   LYS 110          2HZ       LYS 110 -16.646  14.349 -11.454
  836   3HZ   LYS 110          3HZ       LYS 110 -17.675  15.417 -12.282
  837    H    PHE 111           H        PHE 111 -15.215   7.502 -11.643
  838    HA   PHE 111           HA       PHE 111 -17.553   6.666 -13.269
  839   1HB   PHE 111          2HB       PHE 111 -14.645   5.832 -13.238
  840   2HB   PHE 111          1HB       PHE 111 -15.864   4.995 -14.199
  841    HD1  PHE 111           HD1      PHE 111 -17.070   6.184 -16.017
  842    HD2  PHE 111           HD2      PHE 111 -13.858   8.029 -13.842
  843    HE1  PHE 111           HE1      PHE 111 -16.880   7.924 -17.774
  844    HE2  PHE 111           HE2      PHE 111 -13.667   9.769 -15.598
  845    HZ   PHE 111           HZ       PHE 111 -15.178   9.717 -17.565
  846    H    ASP 112           H        ASP 112 -15.103   4.658 -11.636
  847    HA   ASP 112           HA       ASP 112 -16.576   3.603  -9.529
  848   1HB   ASP 112          2HB       ASP 112 -17.563   2.684 -12.153
  849   2HB   ASP 112          1HB       ASP 112 -17.219   1.384 -11.011
  850    H    ILE 113           H        ILE 113 -13.846   3.965 -10.573
  851    HA   ILE 113           HA       ILE 113 -12.867   1.147 -10.346
  852    HB   ILE 113           HB       ILE 113 -10.836   1.927 -11.533
  853   1HG1  ILE 113          2HG1      ILE 113 -12.374   4.537 -11.729
  854   2HG1  ILE 113          1HG1      ILE 113 -10.904   4.276 -10.789
  855   1HG2  ILE 113          1HG2      ILE 113 -12.864   2.943 -13.390
  856   2HG2  ILE 113          2HG2      ILE 113 -13.343   1.437 -12.607
  857   3HG2  ILE 113          3HG2      ILE 113 -11.837   1.516 -13.521
  858   1HD1  ILE 113          1HD1      ILE 113 -11.249   4.409 -13.768
  859   2HD1  ILE 113          2HD1      ILE 113  -9.932   3.447 -13.095
  860   3HD1  ILE 113          3HD1      ILE 113 -10.027   5.175 -12.752
  861    H    ILE 114           H        ILE 114 -10.491   1.197  -9.400
  862    HA   ILE 114           HA       ILE 114 -10.519   3.074  -7.066
  863    HB   ILE 114           HB       ILE 114 -10.811   0.987  -6.065
  864   1HG1  ILE 114          2HG1      ILE 114  -7.817   0.828  -6.321
  865   2HG1  ILE 114          1HG1      ILE 114  -8.548   2.213  -5.511
  866   1HG2  ILE 114          1HG2      ILE 114 -10.773  -0.686  -7.616
  867   2HG2  ILE 114          2HG2      ILE 114  -9.111  -0.900  -7.065
  868   3HG2  ILE 114          3HG2      ILE 114  -9.445   0.047  -8.515
  869   1HD1  ILE 114          1HD1      ILE 114  -9.324   0.952  -3.748
  870   2HD1  ILE 114          2HD1      ILE 114  -7.916  -0.019  -4.178
  871   3HD1  ILE 114          3HD1      ILE 114  -9.520  -0.497  -4.733
  872    H    TYR 115           H        TYR 115  -8.540   4.022  -6.481
  873    HA   TYR 115           HA       TYR 115  -6.334   3.666  -8.472
  874   1HB   TYR 115          2HB       TYR 115  -6.890   5.893  -8.766
  875   2HB   TYR 115          1HB       TYR 115  -7.484   6.071  -7.115
  876    HD1  TYR 115           HD1      TYR 115  -6.006   6.665  -5.302
  877    HD2  TYR 115           HD2      TYR 115  -4.452   5.932  -9.239
  878    HE1  TYR 115           HE1      TYR 115  -3.825   7.627  -4.620
  879    HE2  TYR 115           HE2      TYR 115  -2.270   6.894  -8.557
  880    HH   TYR 115           HH       TYR 115  -1.204   8.081  -6.962
  881    H    ASP 116           H        ASP 116  -5.034   2.180  -7.398
  882    HA   ASP 116           HA       ASP 116  -3.741   3.143  -4.924
  883   1HB   ASP 116          2HB       ASP 116  -5.561   0.785  -5.077
  884   2HB   ASP 116          1HB       ASP 116  -4.092   0.613  -4.115
  885    H    GLY 117           H        GLY 117  -1.937   3.285  -6.468
  886   1HA   GLY 117          2HA       GLY 117  -0.025   1.309  -6.321
  887   2HA   GLY 117          1HA       GLY 117  -0.962   0.844  -7.741
  888    H    TRP 118           H        TRP 118   0.755   3.652  -6.350
  889    HA   TRP 118           HA       TRP 118   1.388   4.474  -9.156
  890   1HB   TRP 118          2HB       TRP 118   1.113   6.697  -8.596
  891   2HB   TRP 118          1HB       TRP 118  -0.037   5.982  -7.468
  892    HD1  TRP 118           HD1      TRP 118   0.571   5.974  -4.913
  893    HE1  TRP 118           HE1      TRP 118   2.393   7.174  -3.538
  894    HE3  TRP 118           HE3      TRP 118   3.616   7.567  -8.689
  895    HZ2  TRP 118           HZ2      TRP 118   4.821   8.620  -3.983
  896    HZ3  TRP 118           HZ3      TRP 118   5.675   8.852  -8.186
  897    HH2  TRP 118           HH2      TRP 118   6.280   9.381  -5.841
  898    H    GLY 119           H        GLY 119   3.559   5.360  -9.477
  899   1HA   GLY 119          2HA       GLY 119   5.584   5.584  -7.550
  900   2HA   GLY 119          1HA       GLY 119   5.588   3.891  -8.044
  901    H    THR 120           H        THR 120   7.717   5.790  -8.537
  902    HA   THR 120           HA       THR 120   7.563   6.025 -11.516
  903    HB   THR 120           HB       THR 120   7.877   8.191 -10.415
  904    HG1  THR 120           HG1      THR 120   9.166   7.449 -12.336
  905   1HG2  THR 120          1HG2      THR 120  10.543   7.699  -9.360
  906   2HG2  THR 120          2HG2      THR 120   9.335   6.693  -8.561
  907   3HG2  THR 120          3HG2      THR 120   9.151   8.446  -8.575
  908    H    TYR 121           H        TYR 121   9.960   5.954 -12.438
  909    HA   TYR 121           HA       TYR 121  11.188   3.475 -11.315
  910   1HB   TYR 121          2HB       TYR 121  10.722   4.494 -14.027
  911   2HB   TYR 121          1HB       TYR 121  12.368   3.914 -13.778
  912    HD1  TYR 121           HD1      TYR 121   9.238   2.905 -14.843
  913    HD2  TYR 121           HD2      TYR 121  12.383   1.661 -12.195
  914    HE1  TYR 121           HE1      TYR 121   8.437   0.564 -14.995
  915    HE2  TYR 121           HE2      TYR 121  11.582  -0.683 -12.346
  916    HH   TYR 121           HH       TYR 121  10.282  -2.087 -13.815
  917    H    TYR 122           H        TYR 122  13.072   3.740 -10.234
  918    HA   TYR 122           HA       TYR 122  14.412   6.032  -9.609
  919   1HB   TYR 122          2HB       TYR 122  15.015   3.638  -8.935
  920   2HB   TYR 122          1HB       TYR 122  15.956   3.562 -10.425
  921    HD1  TYR 122           HD1      TYR 122  15.870   4.718  -7.010
  922    HD2  TYR 122           HD2      TYR 122  17.758   5.327 -10.819
  923    HE1  TYR 122           HE1      TYR 122  17.733   5.915  -5.895
  924    HE2  TYR 122           HE2      TYR 122  19.622   6.524  -9.704
  925    HH   TYR 122           HH       TYR 122  19.829   7.872  -7.416
  926    H    GLU 123           H        GLU 123  15.902   7.428 -10.576
  927    HA   GLU 123           HA       GLU 123  16.014   7.308 -13.523
  928   1HB   GLU 123          2HB       GLU 123  16.172   9.375 -11.492
  929   2HB   GLU 123          1HB       GLU 123  17.521   9.504 -12.621
  930   1HG   GLU 123          2HG       GLU 123  14.703   9.106 -13.616
  931   2HG   GLU 123          1HG       GLU 123  15.314  10.717 -13.236
  932    H    GLY 124           H        GLY 124  17.766   6.548 -14.609
  933   1HA   GLY 124          2HA       GLY 124  20.021   6.019 -15.060
  934   2HA   GLY 124          1HA       GLY 124  20.468   6.822 -13.554
  935    H    LEU 125           H        LEU 125  18.784   3.867 -14.672
  936    HA   LEU 125           HA       LEU 125  19.148   2.448 -12.200
  937   1HB   LEU 125          2HB       LEU 125  18.874   1.233 -14.963
  938   2HB   LEU 125          1HB       LEU 125  18.445   0.490 -13.422
  939    HG   LEU 125           HG       LEU 125  17.088   2.799 -14.820
  940   1HD1  LEU 125          1HD1      LEU 125  16.371   0.480 -15.353
  941   2HD1  LEU 125          2HD1      LEU 125  15.103   1.386 -14.526
  942   3HD1  LEU 125          3HD1      LEU 125  16.061   0.200 -13.639
  943   1HD2  LEU 125          1HD2      LEU 125  15.667   2.862 -12.691
  944   2HD2  LEU 125          2HD2      LEU 125  17.282   3.558 -12.560
  945   3HD2  LEU 125          3HD2      LEU 125  16.961   1.947 -11.919
  946    H    GLU 126           H        GLU 126  21.472   3.060 -11.863
  947    HA   GLU 126           HA       GLU 126  23.391   1.580 -13.575
  948   1HB   GLU 126          2HB       GLU 126  23.971   3.401 -11.222
  949   2HB   GLU 126          1HB       GLU 126  25.113   2.851 -12.449
  950   1HG   GLU 126          2HG       GLU 126  24.299   4.293 -14.054
  951   2HG   GLU 126          1HG       GLU 126  22.665   4.275 -13.392
  952    H    HIS 127           H        HIS 127  25.365   0.876 -11.843
  953    HA   HIS 127           HA       HIS 127  23.993  -1.117 -10.089
  954   1HB   HIS 127          2HB       HIS 127  26.880  -1.407 -10.761
  955   2HB   HIS 127          1HB       HIS 127  25.631  -2.642 -10.615
  956    HD2  HIS 127           HD2      HIS 127  27.609  -2.121 -13.410
  957    HE1  HIS 127           HE1      HIS 127  23.849  -1.307 -15.153
  958    HE2  HIS 127           HE2      HIS 127  26.274  -1.871 -15.637
  959    H    HIS 128           H        HIS 128  27.050   0.761 -10.196
  960    HA   HIS 128           HA       HIS 128  27.018   0.780  -7.217
  961   1HB   HIS 128          2HB       HIS 128  29.246   1.684  -9.060
  962   2HB   HIS 128          1HB       HIS 128  29.358   1.349  -7.332
  963    HD2  HIS 128           HD2      HIS 128  30.140  -1.249  -6.800
  964    HE1  HIS 128           HE1      HIS 128  29.142  -2.951 -10.536
  965    HE2  HIS 128           HE2      HIS 128  30.189  -3.404  -8.269
  966    H    HIS 129           H        HIS 129  28.614   3.112  -6.900
  967    HA   HIS 129           HA       HIS 129  26.970   5.291  -8.086
  968   1HB   HIS 129          2HB       HIS 129  25.945   4.773  -5.903
  969   2HB   HIS 129          1HB       HIS 129  27.513   4.957  -5.118
  970    HD2  HIS 129           HD2      HIS 129  27.055   7.664  -7.781
  971    HE1  HIS 129           HE1      HIS 129  25.863   9.418  -4.129
  972    HE2  HIS 129           HE2      HIS 129  26.433   9.881  -6.557
  973    H    HIS 130           H        HIS 130  29.766   4.464  -6.029
  974    HA   HIS 130           HA       HIS 130  31.098   6.990  -6.771
  975   1HB   HIS 130          2HB       HIS 130  32.609   4.871  -5.343
  976   2HB   HIS 130          1HB       HIS 130  32.494   6.598  -5.000
  977    HD2  HIS 130           HD2      HIS 130  31.799   4.081  -2.735
  978    HE1  HIS 130           HE1      HIS 130  27.953   5.815  -2.914
  979    HE2  HIS 130           HE2      HIS 130  29.474   4.288  -1.575
  980    H    HIS 131           H        HIS 131  32.337   7.122  -8.578
  981    HA   HIS 131           HA       HIS 131  33.277   4.577  -9.816
  982   1HB   HIS 131          2HB       HIS 131  33.650   6.068 -11.841
  983   2HB   HIS 131          1HB       HIS 131  31.967   5.886 -11.347
  984    HD2  HIS 131           HD2      HIS 131  33.994   8.733 -12.462
  985    HE1  HIS 131           HE1      HIS 131  31.693  10.396  -9.336
  986    HE2  HIS 131           HE2      HIS 131  33.173  10.932 -11.324
  987    H    HIS 132           HN       HIS 132  35.246   4.179  -8.810
  988    HA   HIS 132           HA       HIS 132  37.199   6.410  -8.628
  989   1HB   HIS 132          2HB       HIS 132  36.617   4.186  -6.981
  990   2HB   HIS 132          1HB       HIS 132  38.203   3.867  -7.681
  991    HD2  HIS 132           HD2      HIS 132  40.254   5.652  -6.856
  992    HE1  HIS 132           HE1      HIS 132  37.877   7.841  -4.137
  993    HE2  HIS 132           HE2      HIS 132  40.241   7.448  -4.965
  Start of MODEL   20
    1   1H    MET   1          1H        MET   1  -9.585  -7.011   8.331
    2   2H    MET   1          2H        MET   1  -9.655  -7.684   6.772
    3   3H    MET   1          3H        MET   1 -10.709  -8.234   7.986
    4    HA   MET   1           HA       MET   1 -10.744  -5.401   7.189
    5   1HB   MET   1          2HB       MET   1 -11.916  -7.764   5.725
    6   2HB   MET   1          1HB       MET   1 -12.688  -6.179   5.652
    7   1HG   MET   1          2HG       MET   1  -9.857  -5.870   5.231
    8   2HG   MET   1          1HG       MET   1 -10.479  -7.095   4.125
    9   1HE   MET   1          1HE       MET   1 -13.386  -6.288   3.148
   10   2HE   MET   1          2HE       MET   1 -11.906  -6.939   2.447
   11   3HE   MET   1          3HE       MET   1 -12.669  -5.526   1.722
   12    H    SER   2           H        SER   2 -13.483  -5.226   7.022
   13    HA   SER   2           HA       SER   2 -14.676  -6.583   9.349
   14   1HB   SER   2          2HB       SER   2 -13.920  -3.680   9.310
   15   2HB   SER   2          1HB       SER   2 -15.396  -4.165  10.141
   16    HG   SER   2           HG       SER   2 -13.845  -5.868  11.050
   17    H    HIS   3           H        HIS   3 -16.907  -6.733   9.102
   18    HA   HIS   3           HA       HIS   3 -18.906  -6.724   7.848
   19   1HB   HIS   3          2HB       HIS   3 -18.049  -3.853   8.080
   20   2HB   HIS   3          1HB       HIS   3 -19.471  -4.258   7.118
   21    HD2  HIS   3           HD2      HIS   3 -19.359  -6.709   9.994
   22    HE1  HIS   3           HE1      HIS   3 -21.702  -3.486  11.390
   23    HE2  HIS   3           HE2      HIS   3 -21.000  -5.881  11.843
   24    H    GLN   4           H        GLN   4 -19.761  -5.434   5.612
   25    HA   GLN   4           HA       GLN   4 -17.767  -6.330   3.590
   26   1HB   GLN   4          2HB       GLN   4 -20.757  -5.885   3.466
   27   2HB   GLN   4          1HB       GLN   4 -19.777  -6.183   2.030
   28   1HG   GLN   4          2HG       GLN   4 -18.886  -8.240   3.391
   29   2HG   GLN   4          1HG       GLN   4 -20.364  -8.026   4.331
   30   1HE2  GLN   4          1HE2      GLN   4 -22.426  -8.381   3.238
   31   2HE2  GLN   4          2HE2      GLN   4 -22.506  -9.162   1.733
   32    H    ASP   5           H        ASP   5 -19.969  -3.604   4.290
   33    HA   ASP   5           HA       ASP   5 -18.523  -1.978   2.268
   34   1HB   ASP   5          2HB       ASP   5 -20.885  -1.724   2.091
   35   2HB   ASP   5          1HB       ASP   5 -21.073  -1.561   3.837
   36    H    ASP   6           H        ASP   6 -16.652  -1.152   3.114
   37    HA   ASP   6           HA       ASP   6 -16.524  -0.363   5.948
   38   1HB   ASP   6          2HB       ASP   6 -14.375   0.145   3.893
   39   2HB   ASP   6          1HB       ASP   6 -14.198  -0.137   5.624
   40    H    TYR   7           H        TYR   7 -14.983   1.896   5.942
   41    HA   TYR   7           HA       TYR   7 -16.752   3.886   4.576
   42   1HB   TYR   7          2HB       TYR   7 -15.837   3.639   7.332
   43   2HB   TYR   7          1HB       TYR   7 -15.415   5.209   6.647
   44    HD1  TYR   7           HD1      TYR   7 -18.068   3.140   7.950
   45    HD2  TYR   7           HD2      TYR   7 -17.245   6.566   5.494
   46    HE1  TYR   7           HE1      TYR   7 -20.424   3.878   8.190
   47    HE2  TYR   7           HE2      TYR   7 -19.599   7.306   5.735
   48    HH   TYR   7           HH       TYR   7 -22.041   5.295   6.945
   49    H    LEU   8           H        LEU   8 -15.712   4.880   2.927
   50    HA   LEU   8           HA       LEU   8 -12.741   5.127   3.075
   51   1HB   LEU   8          2HB       LEU   8 -13.609   5.905   0.517
   52   2HB   LEU   8          1HB       LEU   8 -12.860   4.368   0.954
   53    HG   LEU   8           HG       LEU   8 -15.831   4.910   1.194
   54   1HD1  LEU   8          1HD1      LEU   8 -15.173   5.019  -1.164
   55   2HD1  LEU   8          2HD1      LEU   8 -16.033   3.511  -0.854
   56   3HD1  LEU   8          3HD1      LEU   8 -14.275   3.509  -1.003
   57   1HD2  LEU   8          1HD2      LEU   8 -14.122   2.864   2.184
   58   2HD2  LEU   8          2HD2      LEU   8 -15.051   2.156   0.864
   59   3HD2  LEU   8          3HD2      LEU   8 -15.885   2.906   2.225
   60    H    SER   9           H        SER   9 -11.929   7.217   1.943
   61    HA   SER   9           HA       SER   9 -13.686   9.525   1.966
   62   1HB   SER   9          2HB       SER   9 -11.559   9.696   4.068
   63   2HB   SER   9          1HB       SER   9 -13.076  10.580   3.943
   64    HG   SER   9           HG       SER   9 -12.698   7.850   4.630
   65    H    VAL  10           H        VAL  10 -12.753   9.990  -0.057
   66    HA   VAL  10           HA       VAL  10 -10.159   9.859  -0.938
   67    HB   VAL  10           HB       VAL  10 -10.590  11.881  -2.298
   68   1HG1  VAL  10          1HG1      VAL  10 -12.895   9.955  -1.910
   69   2HG1  VAL  10          2HG1      VAL  10 -11.608   9.867  -3.113
   70   3HG1  VAL  10          3HG1      VAL  10 -12.838  11.125  -3.228
   71   1HG2  VAL  10          1HG2      VAL  10 -12.929  12.931  -1.882
   72   2HG2  VAL  10          2HG2      VAL  10 -11.613  13.400  -0.805
   73   3HG2  VAL  10          3HG2      VAL  10 -12.805  12.214  -0.275
   74    H    GLU  11           H        GLU  11 -11.396  11.977   1.549
   75    HA   GLU  11           HA       GLU  11  -9.121  13.769   1.607
   76   1HB   GLU  11          2HB       GLU  11 -11.170  14.538   2.600
   77   2HB   GLU  11          1HB       GLU  11 -11.275  13.112   3.632
   78   1HG   GLU  11          2HG       GLU  11  -8.740  14.535   3.950
   79   2HG   GLU  11          1HG       GLU  11 -10.134  15.541   4.346
   80    H    GLU  12           H        GLU  12 -10.115  11.179   3.890
   81    HA   GLU  12           HA       GLU  12  -7.662  11.124   5.320
   82   1HB   GLU  12          2HB       GLU  12  -8.488   9.231   6.375
   83   2HB   GLU  12          1HB       GLU  12  -9.986   9.896   5.725
   84   1HG   GLU  12          2HG       GLU  12  -9.620   8.455   3.675
   85   2HG   GLU  12          1HG       GLU  12  -8.301   7.674   4.546
   86    H    LEU  13           H        LEU  13  -8.585   9.698   2.249
   87    HA   LEU  13           HA       LEU  13  -6.299   7.917   2.065
   88   1HB   LEU  13          2HB       LEU  13  -8.040   9.083  -0.133
   89   2HB   LEU  13          1HB       LEU  13  -6.926   7.727  -0.312
   90    HG   LEU  13           HG       LEU  13  -9.250   7.755   1.632
   91   1HD1  LEU  13          1HD1      LEU  13 -10.085   5.994  -0.126
   92   2HD1  LEU  13          2HD1      LEU  13  -9.005   6.853  -1.226
   93   3HD1  LEU  13          3HD1      LEU  13 -10.331   7.712  -0.442
   94   1HD2  LEU  13          1HD2      LEU  13  -7.229   5.698   0.728
   95   2HD2  LEU  13          2HD2      LEU  13  -8.767   5.222   1.448
   96   3HD2  LEU  13          3HD2      LEU  13  -7.623   6.193   2.374
   97    H    ILE  14           H        ILE  14  -7.078  10.915   0.265
   98    HA   ILE  14           HA       ILE  14  -4.644  11.385  -0.958
   99    HB   ILE  14           HB       ILE  14  -6.624  13.275   0.302
  100   1HG1  ILE  14          2HG1      ILE  14  -5.804  13.195  -2.582
  101   2HG1  ILE  14          1HG1      ILE  14  -6.826  11.900  -1.958
  102   1HG2  ILE  14          1HG2      ILE  14  -3.925  13.882  -0.877
  103   2HG2  ILE  14          2HG2      ILE  14  -4.708  14.599   0.533
  104   3HG2  ILE  14          3HG2      ILE  14  -5.253  15.024  -1.090
  105   1HD1  ILE  14          1HD1      ILE  14  -7.798  14.263  -2.898
  106   2HD1  ILE  14          2HD1      ILE  14  -7.645  14.637  -1.181
  107   3HD1  ILE  14          3HD1      ILE  14  -8.632  13.271  -1.702
  108    H    GLU  15           H        GLU  15  -5.492  12.162   2.417
  109    HA   GLU  15           HA       GLU  15  -3.072  13.430   3.155
  110   1HB   GLU  15          2HB       GLU  15  -5.303  12.960   4.503
  111   2HB   GLU  15          1HB       GLU  15  -4.413  11.544   5.064
  112   1HG   GLU  15          2HG       GLU  15  -3.848  13.173   6.659
  113   2HG   GLU  15          1HG       GLU  15  -2.487  13.237   5.539
  114    H    ILE  16           H        ILE  16  -3.930   9.982   3.639
  115    HA   ILE  16           HA       ILE  16  -1.422   9.066   4.492
  116    HB   ILE  16           HB       ILE  16  -3.556   7.736   2.810
  117   1HG1  ILE  16          2HG1      ILE  16  -2.765   6.870   5.554
  118   2HG1  ILE  16          1HG1      ILE  16  -3.623   8.404   5.414
  119   1HG2  ILE  16          1HG2      ILE  16  -1.849   6.335   2.193
  120   2HG2  ILE  16          2HG2      ILE  16  -2.141   5.654   3.794
  121   3HG2  ILE  16          3HG2      ILE  16  -0.829   6.808   3.552
  122   1HD1  ILE  16          1HD1      ILE  16  -5.363   7.214   4.029
  123   2HD1  ILE  16          2HD1      ILE  16  -5.277   6.663   5.702
  124   3HD1  ILE  16          3HD1      ILE  16  -4.551   5.697   4.416
  125    H    GLN  17           H        GLN  17  -2.623   9.226   1.121
  126    HA   GLN  17           HA       GLN  17  -0.312   8.301  -0.178
  127   1HB   GLN  17          2HB       GLN  17  -2.689   9.212  -1.056
  128   2HB   GLN  17          1HB       GLN  17  -1.708  10.636  -1.398
  129   1HG   GLN  17          2HG       GLN  17  -1.177   9.566  -3.327
  130   2HG   GLN  17          1HG       GLN  17  -0.096   8.602  -2.321
  131   1HE2  GLN  17          1HE2      GLN  17  -0.952   6.485  -1.524
  132   2HE2  GLN  17          2HE2      GLN  17  -2.200   5.710  -2.374
  133    H    LYS  18           H        LYS  18  -1.107  11.659   0.762
  134    HA   LYS  18           HA       LYS  18   1.221  12.913  -0.214
  135   1HB   LYS  18          2HB       LYS  18  -0.930  13.587   1.542
  136   2HB   LYS  18          1HB       LYS  18   0.576  14.050   2.336
  137   1HG   LYS  18          2HG       LYS  18   1.245  15.129   0.112
  138   2HG   LYS  18          1HG       LYS  18  -0.436  14.920  -0.376
  139   1HD   LYS  18          2HD       LYS  18   0.176  16.215   2.262
  140   2HD   LYS  18          1HD       LYS  18   0.315  17.163   0.781
  141   1HE   LYS  18          2HE       LYS  18  -1.943  17.137   0.391
  142   2HE   LYS  18          1HE       LYS  18  -2.145  15.521   1.064
  143   1HZ   LYS  18          1HZ       LYS  18  -2.117  18.112   2.423
  144   2HZ   LYS  18          2HZ       LYS  18  -1.499  16.769   3.260
  145   3HZ   LYS  18          3HZ       LYS  18  -3.102  16.758   2.696
  146    H    GLU  19           H        GLU  19   0.683  11.396   2.977
  147    HA   GLU  19           HA       GLU  19   3.246  11.898   4.068
  148   1HB   GLU  19          2HB       GLU  19   1.102   9.883   4.529
  149   2HB   GLU  19          1HB       GLU  19   2.702   9.504   5.170
  150   1HG   GLU  19          2HG       GLU  19   1.435  12.201   5.635
  151   2HG   GLU  19          1HG       GLU  19   1.090  10.833   6.694
  152    H    GLU  20           H        GLU  20   2.241   8.719   2.752
  153    HA   GLU  20           HA       GLU  20   4.733   7.547   2.499
  154   1HB   GLU  20          2HB       GLU  20   2.283   7.397   0.752
  155   2HB   GLU  20          1HB       GLU  20   3.741   6.507   0.314
  156   1HG   GLU  20          2HG       GLU  20   3.737   5.476   2.595
  157   2HG   GLU  20          1HG       GLU  20   2.199   6.275   2.913
  158    H    THR  21           H        THR  21   3.177   9.292  -0.219
  159    HA   THR  21           HA       THR  21   5.244   9.453  -2.008
  160    HB   THR  21           HB       THR  21   3.693  11.935  -1.242
  161    HG1  THR  21           HG1      THR  21   2.230  10.248  -1.374
  162   1HG2  THR  21          1HG2      THR  21   3.698  11.979  -3.869
  163   2HG2  THR  21          2HG2      THR  21   5.065  10.878  -3.692
  164   3HG2  THR  21          3HG2      THR  21   5.135  12.493  -2.984
  165    H    ARG  22           H        ARG  22   4.789  12.083   0.382
  166    HA   ARG  22           HA       ARG  22   7.164  13.422   0.138
  167   1HB   ARG  22          2HB       ARG  22   5.328  13.808   1.875
  168   2HB   ARG  22          1HB       ARG  22   6.142  12.596   2.864
  169   1HG   ARG  22          2HG       ARG  22   7.595  14.155   3.577
  170   2HG   ARG  22          1HG       ARG  22   8.130  14.411   1.917
  171   1HD   ARG  22          2HD       ARG  22   7.356  16.536   2.702
  172   2HD   ARG  22          1HD       ARG  22   6.100  15.923   1.626
  173    HE   ARG  22           HE       ARG  22   5.318  15.026   4.126
  174   1HH1  ARG  22          1HH2      ARG  22   6.208  18.045   2.719
  175   2HH1  ARG  22          2HH2      ARG  22   5.186  18.982   3.755
  176   1HH2  ARG  22          2HH1      ARG  22   3.977  16.233   5.488
  177   2HH2  ARG  22          1HH1      ARG  22   3.922  17.956   5.324
  178    H    ASP  23           H        ASP  23   6.743  10.440   2.066
  179    HA   ASP  23           HA       ASP  23   9.419  10.162   2.929
  180   1HB   ASP  23          2HB       ASP  23   7.199   8.714   3.340
  181   2HB   ASP  23          1HB       ASP  23   7.946   7.701   2.104
  182    H    ILE  24           H        ILE  24   7.894   8.679   0.040
  183    HA   ILE  24           HA       ILE  24  10.272   7.565  -1.031
  184    HB   ILE  24           HB       ILE  24   7.840   8.640  -2.495
  185   1HG1  ILE  24          2HG1      ILE  24   8.541   5.829  -1.588
  186   2HG1  ILE  24          1HG1      ILE  24   7.380   6.885  -0.780
  187   1HG2  ILE  24          1HG2      ILE  24   9.226   6.404  -3.725
  188   2HG2  ILE  24          2HG2      ILE  24  10.310   7.783  -3.531
  189   3HG2  ILE  24          3HG2      ILE  24   8.798   7.967  -4.422
  190   1HD1  ILE  24          1HD1      ILE  24   6.259   7.056  -3.126
  191   2HD1  ILE  24          2HD1      ILE  24   6.013   5.586  -2.184
  192   3HD1  ILE  24          3HD1      ILE  24   7.187   5.604  -3.499
  193    H    ILE  25           H        ILE  25   8.660  10.546  -2.198
  194    HA   ILE  25           HA       ILE  25  10.611  11.556  -3.854
  195    HB   ILE  25           HB       ILE  25   9.216  13.273  -1.785
  196   1HG1  ILE  25          2HG1      ILE  25   7.497  11.896  -2.722
  197   2HG1  ILE  25          1HG1      ILE  25   7.425  13.423  -3.604
  198   1HG2  ILE  25          1HG2      ILE  25   9.286  14.369  -4.424
  199   2HG2  ILE  25          2HG2      ILE  25  10.912  13.814  -4.026
  200   3HG2  ILE  25          3HG2      ILE  25  10.092  14.969  -2.975
  201   1HD1  ILE  25          1HD1      ILE  25   9.055  12.281  -5.276
  202   2HD1  ILE  25          2HD1      ILE  25   7.356  11.811  -5.319
  203   3HD1  ILE  25          3HD1      ILE  25   8.536  10.775  -4.518
  204    H    GLN  26           H        GLN  26  10.567  11.904  -0.298
  205    HA   GLN  26           HA       GLN  26  12.948  13.420  -0.049
  206   1HB   GLN  26          2HB       GLN  26  11.720  11.356   1.799
  207   2HB   GLN  26          1HB       GLN  26  13.078  12.386   2.252
  208   1HG   GLN  26          2HG       GLN  26  10.596  13.642   1.124
  209   2HG   GLN  26          1HG       GLN  26  10.622  13.147   2.817
  210   1HE2  GLN  26          1HE2      GLN  26  10.570  15.465   3.449
  211   2HE2  GLN  26          2HE2      GLN  26  11.978  16.407   3.344
  212    H    ALA  27           H        ALA  27  12.494   9.885  -0.178
  213    HA   ALA  27           HA       ALA  27  15.232   9.196   0.246
  214   1HB   ALA  27          1HB       ALA  27  13.478   7.572  -1.569
  215   2HB   ALA  27          2HB       ALA  27  13.063   7.704   0.139
  216   3HB   ALA  27          3HB       ALA  27  14.619   7.025  -0.340
  217    H    LEU  28           H        LEU  28  13.405   9.813  -2.755
  218    HA   LEU  28           HA       LEU  28  15.520   9.215  -4.565
  219   1HB   LEU  28          2HB       LEU  28  13.175  11.119  -4.779
  220   2HB   LEU  28          1HB       LEU  28  14.268  10.783  -6.121
  221    HG   LEU  28           HG       LEU  28  13.077   8.462  -4.658
  222   1HD1  LEU  28          1HD1      LEU  28  11.608  10.381  -6.446
  223   2HD1  LEU  28          2HD1      LEU  28  11.048   9.580  -4.978
  224   3HD1  LEU  28          3HD1      LEU  28  11.198   8.666  -6.479
  225   1HD2  LEU  28          1HD2      LEU  28  13.502   7.335  -6.657
  226   2HD2  LEU  28          2HD2      LEU  28  14.797   8.531  -6.662
  227   3HD2  LEU  28          3HD2      LEU  28  13.349   8.797  -7.631
  228    H    LEU  29           H        LEU  29  14.524  12.387  -3.216
  229    HA   LEU  29           HA       LEU  29  16.587  13.920  -4.403
  230   1HB   LEU  29          2HB       LEU  29  14.723  14.231  -2.148
  231   2HB   LEU  29          1HB       LEU  29  16.235  15.116  -1.941
  232    HG   LEU  29           HG       LEU  29  14.426  15.273  -4.371
  233   1HD1  LEU  29          1HD1      LEU  29  15.002  17.296  -2.183
  234   2HD1  LEU  29          2HD1      LEU  29  13.504  16.382  -2.351
  235   3HD1  LEU  29          3HD1      LEU  29  13.963  17.556  -3.585
  236   1HD2  LEU  29          1HD2      LEU  29  16.194  17.420  -4.365
  237   2HD2  LEU  29          2HD2      LEU  29  16.324  15.986  -5.382
  238   3HD2  LEU  29          3HD2      LEU  29  17.197  16.064  -3.852
  239    H    GLU  30           H        GLU  30  16.543  12.506  -1.105
  240    HA   GLU  30           HA       GLU  30  19.147  13.155  -0.329
  241   1HB   GLU  30          2HB       GLU  30  17.499  11.995   1.126
  242   2HB   GLU  30          1HB       GLU  30  17.737  10.519   0.189
  243   1HG   GLU  30          2HG       GLU  30  19.930  10.227   0.957
  244   2HG   GLU  30          1HG       GLU  30  20.101  11.925   1.405
  245    H    ASP  31           H        ASP  31  18.092  10.755  -2.654
  246    HA   ASP  31           HA       ASP  31  20.623   9.348  -2.798
  247   1HB   ASP  31          2HB       ASP  31  18.331   8.503  -3.582
  248   2HB   ASP  31          1HB       ASP  31  18.561   9.525  -5.001
  249    H    GLY  32           H        GLY  32  19.467  12.354  -4.016
  250   1HA   GLY  32          2HA       GLY  32  20.711  14.019  -5.149
  251   2HA   GLY  32          1HA       GLY  32  22.053  12.880  -5.275
  252    H    SER  33           H        SER  33  18.727  12.315  -6.350
  253    HA   SER  33           HA       SER  33  19.518  11.250  -8.871
  254   1HB   SER  33          2HB       SER  33  17.263  10.981  -9.267
  255   2HB   SER  33          1HB       SER  33  17.198  11.248  -7.527
  256    HG   SER  33           HG       SER  33  16.802  13.448  -7.956
  257    H    ASP  34           H        ASP  34  17.491  12.944 -10.397
  258    HA   ASP  34           HA       ASP  34  19.004  15.483 -10.669
  259   1HB   ASP  34          2HB       ASP  34  18.348  13.981 -13.179
  260   2HB   ASP  34          1HB       ASP  34  19.622  15.165 -12.886
  261    HA   PRO  35           HA       PRO  35  14.301  15.748 -10.819
  262   1HB   PRO  35          2HB       PRO  35  15.010  18.259  -9.391
  263   2HB   PRO  35          1HB       PRO  35  13.757  17.062  -9.016
  264   1HG   PRO  35          2HG       PRO  35  16.009  17.257  -7.588
  265   2HG   PRO  35          1HG       PRO  35  15.199  15.708  -7.873
  266   1HD   PRO  35          2HD       PRO  35  17.706  16.774  -9.096
  267   2HD   PRO  35          1HD       PRO  35  17.239  15.092  -8.757
  268    H    ASP  36           H        ASP  36  16.969  17.463 -12.044
  269    HA   ASP  36           HA       ASP  36  15.414  19.624 -13.282
  270   1HB   ASP  36          2HB       ASP  36  17.829  19.865 -12.574
  271   2HB   ASP  36          1HB       ASP  36  18.258  18.776 -13.894
  272    H    ALA  37           H        ALA  37  16.470  16.405 -14.104
  273    HA   ALA  37           HA       ALA  37  15.968  16.807 -16.980
  274   1HB   ALA  37          1HB       ALA  37  17.724  15.274 -16.560
  275   2HB   ALA  37          2HB       ALA  37  16.350  14.252 -16.987
  276   3HB   ALA  37          3HB       ALA  37  16.811  14.447 -15.296
  277    H    LEU  38           H        LEU  38  13.780  17.175 -14.974
  278    HA   LEU  38           HA       LEU  38  11.514  16.597 -14.748
  279   1HB   LEU  38          2HB       LEU  38  12.244  16.340 -17.525
  280   2HB   LEU  38          1HB       LEU  38  11.056  15.103 -17.118
  281    HG   LEU  38           HG       LEU  38  10.636  17.945 -16.216
  282   1HD1  LEU  38          1HD1      LEU  38   9.405  18.390 -18.288
  283   2HD1  LEU  38          2HD1      LEU  38   9.838  16.796 -18.907
  284   3HD1  LEU  38          3HD1      LEU  38  11.088  18.014 -18.657
  285   1HD2  LEU  38          1HD2      LEU  38   8.368  17.277 -16.061
  286   2HD2  LEU  38          2HD2      LEU  38   9.264  15.873 -15.482
  287   3HD2  LEU  38          3HD2      LEU  38   8.617  15.891 -17.122
  288    H    TYR  39           H        TYR  39  10.040  14.689 -14.503
  289    HA   TYR  39           HA       TYR  39  11.549  12.121 -14.272
  290   1HB   TYR  39          2HB       TYR  39  10.503  13.716 -12.132
  291   2HB   TYR  39          1HB       TYR  39   9.558  12.230 -12.227
  292    HD1  TYR  39           HD1      TYR  39  10.359  10.378 -11.073
  293    HD2  TYR  39           HD2      TYR  39  13.143  13.328 -12.483
  294    HE1  TYR  39           HE1      TYR  39  12.221   9.125 -10.018
  295    HE2  TYR  39           HE2      TYR  39  15.006  12.076 -11.428
  296    HH   TYR  39           HH       TYR  39  14.682   9.906  -9.116
  297    H    GLU  40           H        GLU  40   9.966  10.236 -14.028
  298    HA   GLU  40           HA       GLU  40   7.472  10.796 -15.586
  299   1HB   GLU  40          2HB       GLU  40   8.769   9.598 -17.124
  300   2HB   GLU  40          1HB       GLU  40   9.522   8.613 -15.868
  301   1HG   GLU  40          2HG       GLU  40   7.697   7.195 -15.689
  302   2HG   GLU  40          1HG       GLU  40   6.558   8.419 -16.248
  303    H    ILE  41           H        ILE  41   5.658  10.234 -14.483
  304    HA   ILE  41           HA       ILE  41   5.962   8.386 -12.159
  305    HB   ILE  41           HB       ILE  41   4.013  10.588 -12.820
  306   1HG1  ILE  41          2HG1      ILE  41   4.586  11.120 -10.381
  307   2HG1  ILE  41          1HG1      ILE  41   5.825   9.870 -10.504
  308   1HG2  ILE  41          1HG2      ILE  41   2.734   9.807 -10.777
  309   2HG2  ILE  41          2HG2      ILE  41   3.645   8.299 -10.869
  310   3HG2  ILE  41          3HG2      ILE  41   2.571   8.763 -12.189
  311   1HD1  ILE  41          1HD1      ILE  41   5.960  11.635 -12.792
  312   2HD1  ILE  41          2HD1      ILE  41   7.208  11.265 -11.602
  313   3HD1  ILE  41          3HD1      ILE  41   6.055  12.564 -11.297
  314    H    GLU  42           H        GLU  42   4.351   6.703 -11.879
  315    HA   GLU  42           HA       GLU  42   2.795   6.061 -14.345
  316   1HB   GLU  42          2HB       GLU  42   4.989   4.751 -14.125
  317   2HB   GLU  42          1HB       GLU  42   4.256   3.966 -12.728
  318   1HG   GLU  42          2HG       GLU  42   2.591   2.934 -14.017
  319   2HG   GLU  42          1HG       GLU  42   2.780   4.077 -15.347
  320    H    HIS  43           H        HIS  43   0.691   5.916 -13.769
  321    HA   HIS  43           HA       HIS  43   0.033   5.172 -10.961
  322   1HB   HIS  43          2HB       HIS  43  -1.897   6.240 -13.026
  323   2HB   HIS  43          1HB       HIS  43  -2.045   6.282 -11.269
  324    HD2  HIS  43           HD2      HIS  43   0.317   7.986 -13.994
  325    HE1  HIS  43           HE1      HIS  43   0.109  10.466 -10.581
  326    HE2  HIS  43           HE2      HIS  43   1.031  10.261 -12.936
  327    H    HIS  44           H        HIS  44  -1.588   3.546 -10.576
  328    HA   HIS  44           HA       HIS  44  -2.060   1.735 -12.911
  329   1HB   HIS  44          2HB       HIS  44  -0.522   1.145 -10.693
  330   2HB   HIS  44          1HB       HIS  44  -2.090   0.462 -10.263
  331    HD2  HIS  44           HD2      HIS  44  -3.039  -0.750 -13.139
  332    HE1  HIS  44           HE1      HIS  44   0.713  -2.686 -13.230
  333    HE2  HIS  44           HE2      HIS  44  -1.622  -2.654 -14.221
  334    H    LEU  45           H        LEU  45  -4.185   1.280 -13.272
  335    HA   LEU  45           HA       LEU  45  -6.106   1.530 -11.016
  336   1HB   LEU  45          2HB       LEU  45  -6.356   2.938 -13.691
  337   2HB   LEU  45          1HB       LEU  45  -7.662   2.805 -12.512
  338    HG   LEU  45           HG       LEU  45  -5.840   3.784 -10.860
  339   1HD1  LEU  45          1HD1      LEU  45  -4.948   5.362 -13.198
  340   2HD1  LEU  45          2HD1      LEU  45  -4.321   3.716 -13.129
  341   3HD1  LEU  45          3HD1      LEU  45  -4.035   4.826 -11.788
  342   1HD2  LEU  45          1HD2      LEU  45  -7.849   4.992 -11.212
  343   2HD2  LEU  45          2HD2      LEU  45  -7.489   5.260 -12.917
  344   3HD2  LEU  45          3HD2      LEU  45  -6.581   6.125 -11.678
  345    H    PHE  46           H        PHE  46  -7.743   0.008 -11.135
  346    HA   PHE  46           HA       PHE  46  -7.893  -1.590 -13.656
  347   1HB   PHE  46          2HB       PHE  46  -8.681  -3.294 -11.584
  348   2HB   PHE  46          1HB       PHE  46  -7.149  -3.349 -12.453
  349    HD1  PHE  46           HD1      PHE  46  -5.399  -1.461 -11.628
  350    HD2  PHE  46           HD2      PHE  46  -8.573  -3.137  -9.266
  351    HE1  PHE  46           HE1      PHE  46  -4.197  -0.818  -9.556
  352    HE2  PHE  46           HE2      PHE  46  -7.370  -2.492  -7.195
  353    HZ   PHE  46           HZ       PHE  46  -5.183  -1.334  -7.340
  354    H    ALA  47           H        ALA  47 -10.019  -2.916 -13.660
  355    HA   ALA  47           HA       ALA  47 -12.241  -1.662 -12.195
  356   1HB   ALA  47          1HB       ALA  47 -13.320  -0.658 -13.991
  357   2HB   ALA  47          2HB       ALA  47 -12.513  -1.681 -15.181
  358   3HB   ALA  47          3HB       ALA  47 -11.637  -0.352 -14.421
  359    H    GLU  48           H        GLU  48 -14.376  -2.761 -12.986
  360    HA   GLU  48           HA       GLU  48 -13.748  -5.635 -13.529
  361   1HB   GLU  48          2HB       GLU  48 -16.290  -4.644 -12.242
  362   2HB   GLU  48          1HB       GLU  48 -15.565  -6.250 -12.154
  363   1HG   GLU  48          2HG       GLU  48 -14.778  -5.521 -10.143
  364   2HG   GLU  48          1HG       GLU  48 -13.551  -4.722 -11.127
  365    H    ASP  49           H        ASP  49 -15.551  -2.846 -14.551
  366    HA   ASP  49           HA       ASP  49 -17.088  -4.501 -16.496
  367   1HB   ASP  49          2HB       ASP  49 -17.666  -2.107 -15.007
  368   2HB   ASP  49          1HB       ASP  49 -17.762  -1.748 -16.730
  369    H    PHE  50           H        PHE  50 -15.410  -4.903 -18.013
  370    HA   PHE  50           HA       PHE  50 -13.434  -3.313 -19.021
  371   1HB   PHE  50          2HB       PHE  50 -13.430  -4.650 -20.904
  372   2HB   PHE  50          1HB       PHE  50 -14.478  -5.624 -19.874
  373    HD1  PHE  50           HD1      PHE  50 -17.054  -4.883 -19.938
  374    HD2  PHE  50           HD2      PHE  50 -14.183  -4.146 -23.047
  375    HE1  PHE  50           HE1      PHE  50 -18.895  -4.639 -21.582
  376    HE2  PHE  50           HE2      PHE  50 -16.024  -3.902 -24.690
  377    HZ   PHE  50           HZ       PHE  50 -18.380  -4.148 -23.957
  378    H    ASP  51           H        ASP  51 -16.882  -3.010 -19.865
  379    HA   ASP  51           HA       ASP  51 -16.664  -0.972 -21.807
  380   1HB   ASP  51          2HB       ASP  51 -18.772  -2.203 -21.092
  381   2HB   ASP  51          1HB       ASP  51 -18.839  -1.115 -19.706
  382    H    LYS  52           H        LYS  52 -17.562  -0.390 -18.386
  383    HA   LYS  52           HA       LYS  52 -17.130   2.381 -18.383
  384   1HB   LYS  52          2HB       LYS  52 -18.151   1.187 -16.488
  385   2HB   LYS  52          1HB       LYS  52 -16.603   0.422 -16.126
  386   1HG   LYS  52          2HG       LYS  52 -15.983   2.209 -14.912
  387   2HG   LYS  52          1HG       LYS  52 -16.185   3.251 -16.321
  388   1HD   LYS  52          2HD       LYS  52 -18.482   2.378 -14.549
  389   2HD   LYS  52          1HD       LYS  52 -17.609   3.896 -14.333
  390   1HE   LYS  52          2HE       LYS  52 -18.225   3.813 -17.066
  391   2HE   LYS  52          1HE       LYS  52 -19.681   3.230 -16.259
  392   1HZ   LYS  52          1HZ       LYS  52 -18.920   5.837 -16.524
  393   2HZ   LYS  52          2HZ       LYS  52 -18.520   5.466 -14.915
  394   3HZ   LYS  52          3HZ       LYS  52 -20.110   5.246 -15.469
  395    H    LEU  53           H        LEU  53 -14.789  -0.244 -18.132
  396    HA   LEU  53           HA       LEU  53 -12.538   1.250 -17.257
  397   1HB   LEU  53          2HB       LEU  53 -12.806  -1.313 -17.658
  398   2HB   LEU  53          1HB       LEU  53 -12.308  -0.945 -19.310
  399    HG   LEU  53           HG       LEU  53 -10.742  -0.088 -16.862
  400   1HD1  LEU  53          1HD1      LEU  53 -11.058  -2.686 -17.654
  401   2HD1  LEU  53          2HD1      LEU  53  -9.605  -2.063 -16.870
  402   3HD1  LEU  53          3HD1      LEU  53  -9.669  -2.203 -18.626
  403   1HD2  LEU  53          1HD2      LEU  53 -10.043   1.291 -18.606
  404   2HD2  LEU  53          2HD2      LEU  53 -10.386   0.077 -19.839
  405   3HD2  LEU  53          3HD2      LEU  53  -8.957  -0.082 -18.818
  406    H    GLU  54           H        GLU  54 -13.571   0.487 -20.601
  407    HA   GLU  54           HA       GLU  54 -11.571   1.984 -21.932
  408   1HB   GLU  54          2HB       GLU  54 -14.450   1.565 -22.797
  409   2HB   GLU  54          1HB       GLU  54 -13.103   2.001 -23.851
  410   1HG   GLU  54          2HG       GLU  54 -11.968  -0.111 -23.296
  411   2HG   GLU  54          1HG       GLU  54 -13.294  -0.548 -22.218
  412    H    LYS  55           H        LYS  55 -14.640   3.014 -20.505
  413    HA   LYS  55           HA       LYS  55 -14.702   5.642 -21.621
  414   1HB   LYS  55          2HB       LYS  55 -15.879   4.376 -19.160
  415   2HB   LYS  55          1HB       LYS  55 -16.016   6.118 -19.406
  416   1HG   LYS  55          2HG       LYS  55 -16.730   4.255 -21.651
  417   2HG   LYS  55          1HG       LYS  55 -17.886   4.522 -20.346
  418   1HD   LYS  55          2HD       LYS  55 -18.360   6.627 -21.041
  419   2HD   LYS  55          1HD       LYS  55 -16.663   6.997 -21.355
  420   1HE   LYS  55          2HE       LYS  55 -16.740   5.886 -23.493
  421   2HE   LYS  55          1HE       LYS  55 -18.349   5.244 -23.161
  422   1HZ   LYS  55          1HZ       LYS  55 -19.244   7.096 -23.939
  423   2HZ   LYS  55          2HZ       LYS  55 -17.698   7.667 -24.354
  424   3HZ   LYS  55          3HZ       LYS  55 -18.365   8.041 -22.838
  425    H    ALA  56           H        ALA  56 -13.869   4.869 -18.223
  426    HA   ALA  56           HA       ALA  56 -12.626   7.346 -17.674
  427   1HB   ALA  56          1HB       ALA  56 -12.269   6.439 -15.633
  428   2HB   ALA  56          2HB       ALA  56 -11.366   5.081 -16.305
  429   3HB   ALA  56          3HB       ALA  56 -13.128   5.028 -16.251
  430    H    ALA  57           H        ALA  57 -11.431   4.636 -19.496
  431    HA   ALA  57           HA       ALA  57  -8.616   5.354 -19.211
  432   1HB   ALA  57          1HB       ALA  57  -9.696   3.050 -19.880
  433   2HB   ALA  57          2HB       ALA  57  -8.167   3.541 -20.607
  434   3HB   ALA  57          3HB       ALA  57  -9.672   3.732 -21.507
  435    H    VAL  58           H        VAL  58 -10.994   5.626 -21.875
  436    HA   VAL  58           HA       VAL  58  -9.304   7.040 -23.666
  437    HB   VAL  58           HB       VAL  58 -12.276   6.816 -23.317
  438   1HG1  VAL  58          1HG1      VAL  58 -12.442   8.210 -25.453
  439   2HG1  VAL  58          2HG1      VAL  58 -10.800   8.755 -25.110
  440   3HG1  VAL  58          3HG1      VAL  58 -12.101   9.108 -23.973
  441   1HG2  VAL  58          1HG2      VAL  58 -10.783   6.377 -25.867
  442   2HG2  VAL  58          2HG2      VAL  58 -12.137   5.472 -25.191
  443   3HG2  VAL  58          3HG2      VAL  58 -10.509   5.229 -24.557
  444    H    GLU  59           H        GLU  59 -11.076   8.129 -20.845
  445    HA   GLU  59           HA       GLU  59 -10.911  10.957 -21.499
  446   1HB   GLU  59          2HB       GLU  59 -12.500   9.748 -19.815
  447   2HB   GLU  59          1HB       GLU  59 -11.148   9.896 -18.691
  448   1HG   GLU  59          2HG       GLU  59 -12.134  11.920 -18.254
  449   2HG   GLU  59          1HG       GLU  59 -11.185  12.414 -19.656
  450    H    ALA  60           H        ALA  60  -9.131   8.869 -19.192
  451    HA   ALA  60           HA       ALA  60  -7.272  10.830 -18.339
  452   1HB   ALA  60          1HB       ALA  60  -5.758   8.795 -17.927
  453   2HB   ALA  60          2HB       ALA  60  -7.075   7.823 -18.584
  454   3HB   ALA  60          3HB       ALA  60  -7.329   8.782 -17.125
  455    H    PHE  61           H        PHE  61  -7.142   8.593 -21.106
  456    HA   PHE  61           HA       PHE  61  -4.516   9.354 -21.977
  457   1HB   PHE  61          2HB       PHE  61  -5.603   7.313 -22.797
  458   2HB   PHE  61          1HB       PHE  61  -6.864   8.275 -23.570
  459    HD1  PHE  61           HD1      PHE  61  -6.499   9.347 -25.678
  460    HD2  PHE  61           HD2      PHE  61  -3.226   7.509 -23.588
  461    HE1  PHE  61           HE1      PHE  61  -5.070   9.605 -27.687
  462    HE2  PHE  61           HE2      PHE  61  -1.798   7.767 -25.598
  463    HZ   PHE  61           HZ       PHE  61  -2.719   8.816 -27.648
  464    H    LYS  62           H        LYS  62  -7.747  10.641 -22.650
  465    HA   LYS  62           HA       LYS  62  -6.824  12.515 -24.671
  466   1HB   LYS  62          2HB       LYS  62  -9.113  11.981 -24.834
  467   2HB   LYS  62          1HB       LYS  62  -9.372  12.168 -23.099
  468   1HG   LYS  62          2HG       LYS  62  -9.164  14.557 -23.240
  469   2HG   LYS  62          1HG       LYS  62  -8.592  14.469 -24.906
  470   1HD   LYS  62          2HD       LYS  62 -10.791  13.475 -25.562
  471   2HD   LYS  62          1HD       LYS  62 -11.356  13.721 -23.910
  472   1HE   LYS  62          2HE       LYS  62 -11.818  15.882 -24.336
  473   2HE   LYS  62          1HE       LYS  62 -10.175  16.159 -24.915
  474   1HZ   LYS  62          1HZ       LYS  62 -12.119  16.475 -26.537
  475   2HZ   LYS  62          2HZ       LYS  62 -12.153  14.777 -26.611
  476   3HZ   LYS  62          3HZ       LYS  62 -10.754  15.623 -27.073
  477    H    MET  63           H        MET  63  -6.792  12.445 -21.235
  478    HA   MET  63           HA       MET  63  -6.802  15.331 -20.835
  479   1HB   MET  63          2HB       MET  63  -7.108  13.147 -19.182
  480   2HB   MET  63          1HB       MET  63  -5.477  13.689 -18.782
  481   1HG   MET  63          2HG       MET  63  -6.590  16.073 -18.728
  482   2HG   MET  63          1HG       MET  63  -8.081  15.157 -18.499
  483   1HE   MET  63          1HE       MET  63  -8.420  13.360 -16.826
  484   2HE   MET  63          2HE       MET  63  -7.470  13.062 -15.374
  485   3HE   MET  63          3HE       MET  63  -6.857  12.538 -16.940
  486    H    GLY  64           H        GLY  64  -4.256  12.817 -20.697
  487   1HA   GLY  64          2HA       GLY  64  -2.265  14.019 -22.147
  488   2HA   GLY  64          1HA       GLY  64  -2.149  14.846 -20.592
  489    H    PHE  65           H        PHE  65  -3.336  11.836 -19.940
  490    HA   PHE  65           HA       PHE  65  -0.731  10.930 -18.928
  491   1HB   PHE  65          2HB       PHE  65  -3.561   9.902 -18.713
  492   2HB   PHE  65          1HB       PHE  65  -2.192   8.937 -18.160
  493    HD1  PHE  65           HD1      PHE  65  -4.151  12.009 -17.608
  494    HD2  PHE  65           HD2      PHE  65  -0.851   9.622 -16.241
  495    HE1  PHE  65           HE1      PHE  65  -4.087  13.307 -15.496
  496    HE2  PHE  65           HE2      PHE  65  -0.788  10.921 -14.128
  497    HZ   PHE  65           HZ       PHE  65  -2.406  12.763 -13.757
  498    H    GLU  66           H        GLU  66  -0.155   8.541 -19.324
  499    HA   GLU  66           HA       GLU  66  -0.661   7.896 -22.204
  500   1HB   GLU  66          2HB       GLU  66   1.684   8.503 -21.769
  501   2HB   GLU  66          1HB       GLU  66   1.773   7.286 -20.497
  502   1HG   GLU  66          2HG       GLU  66   2.445   5.838 -22.093
  503   2HG   GLU  66          1HG       GLU  66   0.790   5.887 -22.702
  504    H    VAL  67           H        VAL  67  -2.564   6.677 -21.478
  505    HA   VAL  67           HA       VAL  67  -2.551   4.597 -19.571
  506    HB   VAL  67           HB       VAL  67  -4.568   5.518 -20.782
  507   1HG1  VAL  67          1HG1      VAL  67  -3.735   3.559 -22.938
  508   2HG1  VAL  67          2HG1      VAL  67  -3.491   5.302 -23.061
  509   3HG1  VAL  67          3HG1      VAL  67  -5.125   4.645 -22.960
  510   1HG2  VAL  67          1HG2      VAL  67  -5.744   3.630 -20.237
  511   2HG2  VAL  67          2HG2      VAL  67  -4.188   3.103 -19.595
  512   3HG2  VAL  67          3HG2      VAL  67  -4.702   2.583 -21.200
  513    H    LEU  68           H        LEU  68  -1.924   2.460 -19.627
  514    HA   LEU  68           HA       LEU  68  -0.547   1.538 -22.118
  515   1HB   LEU  68          2HB       LEU  68   0.402   1.733 -19.402
  516   2HB   LEU  68          1HB       LEU  68   0.379   0.039 -19.892
  517    HG   LEU  68           HG       LEU  68   1.598   2.243 -21.574
  518   1HD1  LEU  68          1HD1      LEU  68   3.765   1.038 -20.766
  519   2HD1  LEU  68          2HD1      LEU  68   2.761   0.473 -19.431
  520   3HD1  LEU  68          3HD1      LEU  68   2.998   2.202 -19.685
  521   1HD2  LEU  68          1HD2      LEU  68   0.834  -0.356 -22.203
  522   2HD2  LEU  68          2HD2      LEU  68   2.555  -0.511 -21.852
  523   3HD2  LEU  68          3HD2      LEU  68   2.006   0.613 -23.095
  524    H    GLU  69           H        GLU  69  -1.107  -0.521 -22.852
  525    HA   GLU  69           HA       GLU  69  -3.588  -1.624 -22.382
  526   1HB   GLU  69          2HB       GLU  69  -0.979  -2.870 -23.193
  527   2HB   GLU  69          1HB       GLU  69  -2.382  -3.903 -22.915
  528   1HG   GLU  69          2HG       GLU  69  -3.645  -2.836 -24.617
  529   2HG   GLU  69          1HG       GLU  69  -2.539  -1.463 -24.687
  530    H    ALA  70           H        ALA  70  -4.427  -3.260 -20.996
  531    HA   ALA  70           HA       ALA  70  -3.038  -3.388 -18.380
  532   1HB   ALA  70          1HB       ALA  70  -5.856  -3.974 -19.290
  533   2HB   ALA  70          2HB       ALA  70  -5.311  -2.759 -18.134
  534   3HB   ALA  70          3HB       ALA  70  -5.278  -4.468 -17.698
  535    H    GLU  71           H        GLU  71  -3.451  -5.618 -17.222
  536    HA   GLU  71           HA       GLU  71  -2.956  -7.837 -19.159
  537   1HB   GLU  71          2HB       GLU  71  -1.417  -8.621 -17.082
  538   2HB   GLU  71          1HB       GLU  71  -0.787  -7.664 -18.425
  539   1HG   GLU  71          2HG       GLU  71  -2.031  -6.283 -16.062
  540   2HG   GLU  71          1HG       GLU  71  -0.363  -6.849 -15.970
  541    H    GLU  72           H        GLU  72  -4.971  -8.804 -18.858
  542    HA   GLU  72           HA       GLU  72  -6.613  -9.018 -16.692
  543   1HB   GLU  72          2HB       GLU  72  -5.779 -11.245 -18.567
  544   2HB   GLU  72          1HB       GLU  72  -7.116 -11.392 -17.426
  545   1HG   GLU  72          2HG       GLU  72  -7.907  -9.126 -18.516
  546   2HG   GLU  72          1HG       GLU  72  -6.887  -9.647 -19.857
  547    H    THR  73           H        THR  73  -5.968  -9.231 -14.593
  548    HA   THR  73           HA       THR  73  -4.375 -11.644 -13.893
  549    HB   THR  73           HB       THR  73  -2.812  -9.708 -14.005
  550    HG1  THR  73           HG1      THR  73  -2.139  -9.906 -11.760
  551   1HG2  THR  73          1HG2      THR  73  -4.055  -8.469 -11.611
  552   2HG2  THR  73          2HG2      THR  73  -4.894  -8.216 -13.140
  553   3HG2  THR  73          3HG2      THR  73  -3.213  -7.711 -12.963
  554    H    GLU  74           H        GLU  74  -4.221 -10.683 -11.089
  555    HA   GLU  74           HA       GLU  74  -7.085 -10.519 -10.326
  556   1HB   GLU  74          2HB       GLU  74  -7.085 -12.468  -9.027
  557   2HB   GLU  74          1HB       GLU  74  -6.158 -12.969 -10.440
  558   1HG   GLU  74          2HG       GLU  74  -4.122 -12.038  -9.008
  559   2HG   GLU  74          1HG       GLU  74  -5.212 -12.379  -7.663
  560    H    ASP  75           H        ASP  75  -7.362  -9.817  -8.090
  561    HA   ASP  75           HA       ASP  75  -5.050  -8.203  -7.165
  562   1HB   ASP  75          2HB       ASP  75  -7.484  -7.324  -7.457
  563   2HB   ASP  75          1HB       ASP  75  -7.802  -8.162  -5.938
  564    H    GLU  76           H        GLU  76  -5.995  -8.086  -4.409
  565    HA   GLU  76           HA       GLU  76  -4.740 -10.567  -3.456
  566   1HB   GLU  76          2HB       GLU  76  -4.345  -8.198  -2.508
  567   2HB   GLU  76          1HB       GLU  76  -5.914  -8.388  -1.725
  568   1HG   GLU  76          2HG       GLU  76  -4.102  -9.083  -0.209
  569   2HG   GLU  76          1HG       GLU  76  -5.115 -10.462  -0.638
  570    H    ASP  77           H        ASP  77  -7.448 -10.632  -4.719
  571    HA   ASP  77           HA       ASP  77  -8.872 -11.923  -2.432
  572   1HB   ASP  77          2HB       ASP  77 -10.058  -9.866  -2.811
  573   2HB   ASP  77          1HB       ASP  77 -10.028 -10.104  -4.559
  574    H    GLY  78           H        GLY  78  -7.921 -11.953  -5.770
  575   1HA   GLY  78          2HA       GLY  78  -7.685 -14.030  -6.995
  576   2HA   GLY  78          1HA       GLY  78  -8.940 -14.738  -5.975
  577    H    ASN  79           H        ASN  79  -9.646 -11.575  -7.055
  578    HA   ASN  79           HA       ASN  79 -11.762 -12.653  -8.814
  579   1HB   ASN  79          2HB       ASN  79 -11.728 -10.570  -7.035
  580   2HB   ASN  79          1HB       ASN  79 -11.466  -9.726  -8.562
  581   1HD2  ASN  79          1HD2      ASN  79 -13.937 -10.417  -6.589
  582   2HD2  ASN  79          2HD2      ASN  79 -15.176 -10.716  -7.712
  583    H    LYS  80           H        LYS  80 -11.510 -12.730 -10.998
  584    HA   LYS  80           HA       LYS  80  -9.090 -11.736 -12.250
  585   1HB   LYS  80          2HB       LYS  80 -10.189 -12.492 -14.364
  586   2HB   LYS  80          1HB       LYS  80 -10.181 -13.740 -13.119
  587   1HG   LYS  80          2HG       LYS  80 -12.510 -12.868 -12.464
  588   2HG   LYS  80          1HG       LYS  80 -12.488 -12.004 -14.002
  589   1HD   LYS  80          2HD       LYS  80 -11.956 -14.223 -15.115
  590   2HD   LYS  80          1HD       LYS  80 -12.304 -14.993 -13.568
  591   1HE   LYS  80          2HE       LYS  80 -14.402 -15.102 -14.533
  592   2HE   LYS  80          1HE       LYS  80 -14.522 -13.531 -13.740
  593   1HZ   LYS  80          1HZ       LYS  80 -14.363 -14.172 -16.556
  594   2HZ   LYS  80          2HZ       LYS  80 -13.388 -12.870 -16.069
  595   3HZ   LYS  80          3HZ       LYS  80 -15.063 -12.834 -15.785
  596    H    LEU  81           H        LEU  81  -8.777  -9.776 -13.229
  597    HA   LEU  81           HA       LEU  81 -11.071  -8.185 -14.155
  598   1HB   LEU  81          2HB       LEU  81 -10.313  -6.198 -12.761
  599   2HB   LEU  81          1HB       LEU  81 -11.089  -7.497 -11.856
  600    HG   LEU  81           HG       LEU  81  -8.445  -8.280 -11.840
  601   1HD1  LEU  81          1HD1      LEU  81  -7.018  -6.476 -11.625
  602   2HD1  LEU  81          2HD1      LEU  81  -8.299  -5.395 -11.080
  603   3HD1  LEU  81          3HD1      LEU  81  -8.159  -5.805 -12.790
  604   1HD2  LEU  81          1HD2      LEU  81  -9.735  -8.435  -9.866
  605   2HD2  LEU  81          2HD2      LEU  81 -10.153  -6.722  -9.903
  606   3HD2  LEU  81          3HD2      LEU  81  -8.517  -7.221  -9.474
  607    H    LEU  82           H        LEU  82  -9.852  -5.766 -14.558
  608    HA   LEU  82           HA       LEU  82  -7.426  -6.476 -16.163
  609   1HB   LEU  82          2HB       LEU  82  -9.537  -4.404 -16.837
  610   2HB   LEU  82          1HB       LEU  82  -8.139  -4.829 -17.825
  611    HG   LEU  82           HG       LEU  82  -9.161  -7.277 -17.579
  612   1HD1  LEU  82          1HD1      LEU  82 -11.762  -5.895 -17.825
  613   2HD1  LEU  82          2HD1      LEU  82 -11.064  -5.873 -16.205
  614   3HD1  LEU  82          3HD1      LEU  82 -11.364  -7.410 -17.016
  615   1HD2  LEU  82          1HD2      LEU  82 -10.264  -5.157 -19.452
  616   2HD2  LEU  82          2HD2      LEU  82 -10.325  -6.899 -19.726
  617   3HD2  LEU  82          3HD2      LEU  82  -8.772  -6.065 -19.698
  618    H    CYS  83           H        CYS  83  -5.693  -5.028 -16.035
  619    HA   CYS  83           HA       CYS  83  -6.095  -2.610 -14.334
  620   1HB   CYS  83          2HB       CYS  83  -3.490  -3.506 -13.812
  621   2HB   CYS  83          1HB       CYS  83  -4.868  -3.580 -12.712
  622    HG   CYS  83           HG       CYS  83  -4.856  -5.933 -14.642
  623    H    PHE  84           H        PHE  84  -5.778  -1.021 -15.857
  624    HA   PHE  84           HA       PHE  84  -3.582  -1.345 -17.822
  625   1HB   PHE  84          2HB       PHE  84  -4.529   0.920 -18.644
  626   2HB   PHE  84          1HB       PHE  84  -5.524  -0.516 -18.879
  627    HD1  PHE  84           HD1      PHE  84  -7.151  -1.098 -16.867
  628    HD2  PHE  84           HD2      PHE  84  -5.477   2.787 -17.618
  629    HE1  PHE  84           HE1      PHE  84  -8.967  -0.057 -15.538
  630    HE2  PHE  84           HE2      PHE  84  -7.292   3.827 -16.287
  631    HZ   PHE  84           HZ       PHE  84  -9.037   2.405 -15.247
  632    H    ASP  85           H        ASP  85  -1.950   0.348 -18.046
  633    HA   ASP  85           HA       ASP  85  -1.433   1.722 -15.438
  634   1HB   ASP  85          2HB       ASP  85   0.373   0.495 -17.503
  635   2HB   ASP  85          1HB       ASP  85   0.983   1.786 -16.467
  636    H    ALA  86           H        ALA  86  -0.775   3.915 -15.481
  637    HA   ALA  86           HA       ALA  86  -1.023   5.270 -18.136
  638   1HB   ALA  86          1HB       ALA  86  -2.455   5.758 -15.592
  639   2HB   ALA  86          2HB       ALA  86  -2.938   6.135 -17.246
  640   3HB   ALA  86          3HB       ALA  86  -1.826   7.202 -16.386
  641    H    THR  87           H        THR  87   0.829   6.337 -18.626
  642    HA   THR  87           HA       THR  87   2.670   7.037 -16.386
  643    HB   THR  87           HB       THR  87   4.026   7.431 -18.797
  644    HG1  THR  87           HG1      THR  87   2.216   5.270 -18.903
  645   1HG2  THR  87          1HG2      THR  87   3.983   4.872 -17.189
  646   2HG2  THR  87          2HG2      THR  87   4.756   6.350 -16.616
  647   3HG2  THR  87          3HG2      THR  87   5.338   5.562 -18.082
  648    H    MET  88           H        MET  88   3.777   9.135 -16.517
  649    HA   MET  88           HA       MET  88   2.732  11.165 -18.349
  650   1HB   MET  88          2HB       MET  88   0.945  11.040 -16.626
  651   2HB   MET  88          1HB       MET  88   2.146  11.384 -15.380
  652   1HG   MET  88          2HG       MET  88   2.693  13.465 -16.907
  653   2HG   MET  88          1HG       MET  88   1.060  13.191 -17.515
  654   1HE   MET  88          1HE       MET  88  -0.259  15.000 -16.853
  655   2HE   MET  88          2HE       MET  88  -1.020  15.059 -15.265
  656   3HE   MET  88          3HE       MET  88  -1.110  13.583 -16.224
  657    H    GLN  89           H        GLN  89   4.146  12.926 -18.466
  658    HA   GLN  89           HA       GLN  89   6.671  12.617 -16.951
  659   1HB   GLN  89          2HB       GLN  89   6.355  14.843 -18.890
  660   2HB   GLN  89          1HB       GLN  89   7.690  13.706 -18.689
  661   1HG   GLN  89          2HG       GLN  89   5.016  13.109 -19.990
  662   2HG   GLN  89          1HG       GLN  89   6.562  13.284 -20.821
  663   1HE2  GLN  89          1HE2      GLN  89   4.561  11.081 -18.994
  664   2HE2  GLN  89          2HE2      GLN  89   5.635   9.766 -19.023
  665    H    SER  90           H        SER  90   6.963  13.773 -15.115
  666    HA   SER  90           HA       SER  90   5.944  16.543 -14.962
  667   1HB   SER  90          2HB       SER  90   4.108  15.841 -13.813
  668   2HB   SER  90          1HB       SER  90   4.803  14.255 -13.491
  669    HG   SER  90           HG       SER  90   5.120  15.015 -11.561
  670    H    ALA  91           H        ALA  91   7.007  17.761 -13.266
  671    HA   ALA  91           HA       ALA  91   9.730  16.913 -12.789
  672   1HB   ALA  91          1HB       ALA  91   9.491  19.242 -12.942
  673   2HB   ALA  91          2HB       ALA  91   9.640  18.990 -11.203
  674   3HB   ALA  91          3HB       ALA  91   8.052  19.257 -11.923
  675    H    LEU  92           H        LEU  92  10.692  16.441 -10.719
  676    HA   LEU  92           HA       LEU  92   9.056  14.761  -9.032
  677   1HB   LEU  92          2HB       LEU  92  11.686  14.811  -9.506
  678   2HB   LEU  92          1HB       LEU  92  11.676  15.809  -8.052
  679    HG   LEU  92           HG       LEU  92  10.134  13.907  -7.097
  680   1HD1  LEU  92          1HD1      LEU  92  11.579  12.558  -9.394
  681   2HD1  LEU  92          2HD1      LEU  92   9.837  12.638  -9.132
  682   3HD1  LEU  92          3HD1      LEU  92  10.849  11.680  -8.050
  683   1HD2  LEU  92          1HD2      LEU  92  12.065  12.883  -6.127
  684   2HD2  LEU  92          2HD2      LEU  92  12.524  14.556  -6.445
  685   3HD2  LEU  92          3HD2      LEU  92  13.061  13.272  -7.529
  686    H    ASP  93           H        ASP  93   7.665  15.510  -7.519
  687    HA   ASP  93           HA       ASP  93   8.439  17.436  -5.526
  688   1HB   ASP  93          2HB       ASP  93   6.940  18.392  -7.921
  689   2HB   ASP  93          1HB       ASP  93   6.415  18.997  -6.350
  690    H    ALA  94           H        ALA  94   7.126  17.136  -3.758
  691    HA   ALA  94           HA       ALA  94   5.147  15.059  -3.798
  692   1HB   ALA  94          1HB       ALA  94   5.105  15.319  -1.524
  693   2HB   ALA  94          2HB       ALA  94   5.017  17.077  -1.624
  694   3HB   ALA  94          3HB       ALA  94   6.566  16.259  -1.826
  695    H    LYS  95           H        LYS  95   4.589  18.487  -2.920
  696    HA   LYS  95           HA       LYS  95   1.867  18.636  -3.052
  697   1HB   LYS  95          2HB       LYS  95   3.183  20.748  -4.667
  698   2HB   LYS  95          1HB       LYS  95   2.122  20.899  -3.265
  699   1HG   LYS  95          2HG       LYS  95   4.028  20.069  -1.834
  700   2HG   LYS  95          1HG       LYS  95   5.065  20.179  -3.258
  701   1HD   LYS  95          2HD       LYS  95   3.734  22.640  -3.172
  702   2HD   LYS  95          1HD       LYS  95   4.141  22.298  -1.489
  703   1HE   LYS  95          2HE       LYS  95   6.072  22.271  -3.828
  704   2HE   LYS  95          1HE       LYS  95   5.987  23.500  -2.566
  705   1HZ   LYS  95          1HZ       LYS  95   6.337  21.570  -0.970
  706   2HZ   LYS  95          2HZ       LYS  95   7.678  22.072  -1.887
  707   3HZ   LYS  95          3HZ       LYS  95   6.818  20.674  -2.328
  708    H    LEU  96           H        LEU  96   4.027  18.471  -5.868
  709    HA   LEU  96           HA       LEU  96   2.044  18.826  -7.881
  710   1HB   LEU  96          2HB       LEU  96   4.804  17.874  -7.733
  711   2HB   LEU  96          1HB       LEU  96   3.866  17.019  -8.956
  712    HG   LEU  96           HG       LEU  96   3.150  19.178  -9.918
  713   1HD1  LEU  96          1HD1      LEU  96   4.685  21.154  -9.003
  714   2HD1  LEU  96          2HD1      LEU  96   4.633  20.191  -7.526
  715   3HD1  LEU  96          3HD1      LEU  96   3.135  20.780  -8.249
  716   1HD2  LEU  96          1HD2      LEU  96   5.565  17.959 -10.228
  717   2HD2  LEU  96          2HD2      LEU  96   6.085  19.569  -9.733
  718   3HD2  LEU  96          3HD2      LEU  96   5.064  19.372 -11.157
  719    H    ILE  97           H        ILE  97   3.482  15.728  -6.784
  720    HA   ILE  97           HA       ILE  97   1.639  14.036  -8.087
  721    HB   ILE  97           HB       ILE  97   3.170  13.672  -5.501
  722   1HG1  ILE  97          2HG1      ILE  97   3.680  12.181  -8.043
  723   2HG1  ILE  97          1HG1      ILE  97   4.175  13.872  -7.965
  724   1HG2  ILE  97          1HG2      ILE  97   1.309  12.162  -5.362
  725   2HG2  ILE  97          2HG2      ILE  97   2.687  11.210  -5.913
  726   3HG2  ILE  97          3HG2      ILE  97   1.455  11.728  -7.065
  727   1HD1  ILE  97          1HD1      ILE  97   4.881  12.002  -5.719
  728   2HD1  ILE  97          2HD1      ILE  97   5.689  13.486  -6.223
  729   3HD1  ILE  97          3HD1      ILE  97   5.856  12.020  -7.188
  730    H    ASP  98           H        ASP  98   1.300  15.888  -5.128
  731    HA   ASP  98           HA       ASP  98  -0.972  14.506  -4.059
  732   1HB   ASP  98          2HB       ASP  98   0.244  16.082  -2.674
  733   2HB   ASP  98          1HB       ASP  98  -0.094  17.397  -3.801
  734    H    GLU  99           H        GLU  99  -0.819  17.509  -6.016
  735    HA   GLU  99           HA       GLU  99  -3.637  17.739  -6.379
  736   1HB   GLU  99          2HB       GLU  99  -1.232  18.778  -7.848
  737   2HB   GLU  99          1HB       GLU  99  -2.835  18.986  -8.555
  738   1HG   GLU  99          2HG       GLU  99  -3.610  20.239  -6.680
  739   2HG   GLU  99          1HG       GLU  99  -2.218  19.772  -5.702
  740    H    GLN 100           H        GLN 100  -1.144  16.185  -8.409
  741    HA   GLN 100           HA       GLN 100  -2.824  15.366 -10.531
  742   1HB   GLN 100          2HB       GLN 100  -0.315  14.202  -9.329
  743   2HB   GLN 100          1HB       GLN 100  -1.139  13.389 -10.660
  744   1HG   GLN 100          2HG       GLN 100  -0.643  15.058 -12.173
  745   2HG   GLN 100          1HG       GLN 100  -0.630  16.317 -10.937
  746   1HE2  GLN 100          1HE2      GLN 100   1.522  16.868 -12.099
  747   2HE2  GLN 100          2HE2      GLN 100   2.915  16.058 -11.568
  748    H    VAL 101           H        VAL 101  -1.822  13.375  -7.718
  749    HA   VAL 101           HA       VAL 101  -3.510  11.188  -8.164
  750    HB   VAL 101           HB       VAL 101  -2.758  12.455  -5.512
  751   1HG1  VAL 101          1HG1      VAL 101  -3.066   9.794  -5.030
  752   2HG1  VAL 101          2HG1      VAL 101  -4.319  10.046  -6.245
  753   3HG1  VAL 101          3HG1      VAL 101  -4.334  10.987  -4.754
  754   1HG2  VAL 101          1HG2      VAL 101  -0.883  10.991  -5.525
  755   2HG2  VAL 101          2HG2      VAL 101  -0.934  11.664  -7.155
  756   3HG2  VAL 101          3HG2      VAL 101  -1.539  10.036  -6.855
  757    H    GLU 102           H        GLU 102  -4.278  14.082  -6.193
  758    HA   GLU 102           HA       GLU 102  -6.869  13.549  -5.432
  759   1HB   GLU 102          2HB       GLU 102  -6.011  15.665  -4.808
  760   2HB   GLU 102          1HB       GLU 102  -5.642  16.101  -6.477
  761   1HG   GLU 102          2HG       GLU 102  -7.999  16.279  -7.015
  762   2HG   GLU 102          1HG       GLU 102  -8.450  15.662  -5.425
  763    H    LYS 103           H        LYS 103  -5.842  14.656  -8.661
  764    HA   LYS 103           HA       LYS 103  -8.495  14.736  -9.769
  765   1HB   LYS 103          2HB       LYS 103  -5.726  14.580 -10.947
  766   2HB   LYS 103          1HB       LYS 103  -7.150  14.455 -11.982
  767   1HG   LYS 103          2HG       LYS 103  -7.983  16.606 -11.021
  768   2HG   LYS 103          1HG       LYS 103  -6.478  16.746 -10.113
  769   1HD   LYS 103          2HD       LYS 103  -5.350  16.414 -12.461
  770   2HD   LYS 103          1HD       LYS 103  -6.919  16.931 -13.079
  771   1HE   LYS 103          2HE       LYS 103  -6.785  18.979 -11.702
  772   2HE   LYS 103          1HE       LYS 103  -5.208  18.466 -11.099
  773   1HZ   LYS 103          1HZ       LYS 103  -4.851  18.273 -13.738
  774   2HZ   LYS 103          2HZ       LYS 103  -4.462  19.655 -12.830
  775   3HZ   LYS 103          3HZ       LYS 103  -5.934  19.577 -13.674
  776    H    LEU 104           H        LEU 104  -5.888  12.314 -10.241
  777    HA   LEU 104           HA       LEU 104  -7.391  10.387 -11.612
  778   1HB   LEU 104          2HB       LEU 104  -5.305   9.827  -9.481
  779   2HB   LEU 104          1HB       LEU 104  -5.796   8.733 -10.774
  780    HG   LEU 104           HG       LEU 104  -4.683  11.487 -11.331
  781   1HD1  LEU 104          1HD1      LEU 104  -3.295   8.923 -10.674
  782   2HD1  LEU 104          2HD1      LEU 104  -2.801  10.582 -10.339
  783   3HD1  LEU 104          3HD1      LEU 104  -2.618   9.918 -11.962
  784   1HD2  LEU 104          1HD2      LEU 104  -5.866  10.521 -13.196
  785   2HD2  LEU 104          2HD2      LEU 104  -5.093   8.956 -12.947
  786   3HD2  LEU 104          3HD2      LEU 104  -4.144  10.326 -13.524
  787    H    VAL 105           H        VAL 105  -7.702  11.448  -8.357
  788    HA   VAL 105           HA       VAL 105  -9.105   9.030  -7.444
  789    HB   VAL 105           HB       VAL 105  -8.720  11.753  -6.158
  790   1HG1  VAL 105          1HG1      VAL 105 -10.713  10.777  -5.236
  791   2HG1  VAL 105          2HG1      VAL 105  -9.421  10.466  -4.077
  792   3HG1  VAL 105          3HG1      VAL 105  -9.967   9.181  -5.153
  793   1HG2  VAL 105          1HG2      VAL 105  -6.889   9.714  -6.570
  794   2HG2  VAL 105          2HG2      VAL 105  -7.495   9.376  -4.947
  795   3HG2  VAL 105          3HG2      VAL 105  -6.778  10.946  -5.313
  796    H    ASN 106           H        ASN 106 -10.121  12.466  -7.442
  797    HA   ASN 106           HA       ASN 106 -12.876  12.049  -7.318
  798   1HB   ASN 106          2HB       ASN 106 -11.195  14.181  -8.610
  799   2HB   ASN 106          1HB       ASN 106 -12.945  14.200  -8.838
  800   1HD2  ASN 106          1HD2      ASN 106 -10.790  13.498  -6.018
  801   2HD2  ASN 106          2HD2      ASN 106 -11.610  14.533  -4.953
  802    H    LEU 107           H        LEU 107 -10.737  11.779 -10.111
  803    HA   LEU 107           HA       LEU 107 -12.855  11.485 -12.060
  804   1HB   LEU 107          2HB       LEU 107 -10.663  12.128 -12.837
  805   2HB   LEU 107          1HB       LEU 107  -9.924  10.713 -12.087
  806    HG   LEU 107           HG       LEU 107 -12.076   9.908 -13.852
  807   1HD1  LEU 107          1HD1      LEU 107 -11.485  12.046 -14.997
  808   2HD1  LEU 107          2HD1      LEU 107 -11.113  10.626 -15.973
  809   3HD1  LEU 107          3HD1      LEU 107  -9.821  11.480 -15.131
  810   1HD2  LEU 107          1HD2      LEU 107 -10.135   8.545 -12.992
  811   2HD2  LEU 107          2HD2      LEU 107  -9.080   9.473 -14.058
  812   3HD2  LEU 107          3HD2      LEU 107 -10.349   8.455 -14.740
  813    H    ALA 108           H        ALA 108 -10.687   9.125 -10.459
  814    HA   ALA 108           HA       ALA 108 -11.801   6.776 -11.547
  815   1HB   ALA 108          1HB       ALA 108 -11.087   5.730  -9.309
  816   2HB   ALA 108          2HB       ALA 108 -10.562   7.350  -8.848
  817   3HB   ALA 108          3HB       ALA 108  -9.827   6.545 -10.234
  818    H    GLU 109           H        GLU 109 -12.681   8.368  -8.460
  819    HA   GLU 109           HA       GLU 109 -14.900   6.698  -7.867
  820   1HB   GLU 109          2HB       GLU 109 -14.399   9.611  -7.186
  821   2HB   GLU 109          1HB       GLU 109 -15.690   8.638  -6.479
  822   1HG   GLU 109          2HG       GLU 109 -12.970   7.450  -6.396
  823   2HG   GLU 109          1HG       GLU 109 -13.234   8.856  -5.362
  824    H    LYS 110           H        LYS 110 -14.568   9.438 -10.038
  825    HA   LYS 110           HA       LYS 110 -17.368   9.951 -10.424
  826   1HB   LYS 110          2HB       LYS 110 -14.904  10.936 -11.460
  827   2HB   LYS 110          1HB       LYS 110 -15.889  10.448 -12.839
  828   1HG   LYS 110          2HG       LYS 110 -17.777  11.782 -11.953
  829   2HG   LYS 110          1HG       LYS 110 -16.771  12.291 -10.596
  830   1HD   LYS 110          2HD       LYS 110 -15.331  12.755 -13.039
  831   2HD   LYS 110          1HD       LYS 110 -16.935  13.475 -13.178
  832   1HE   LYS 110          2HE       LYS 110 -16.540  14.511 -10.887
  833   2HE   LYS 110          1HE       LYS 110 -14.862  13.990 -11.034
  834   1HZ   LYS 110          1HZ       LYS 110 -14.449  15.737 -12.302
  835   2HZ   LYS 110          2HZ       LYS 110 -16.051  16.267 -12.114
  836   3HZ   LYS 110          3HZ       LYS 110 -15.634  15.258 -13.416
  837    H    PHE 111           H        PHE 111 -15.149   7.577 -11.750
  838    HA   PHE 111           HA       PHE 111 -17.251   6.649 -13.643
  839   1HB   PHE 111          2HB       PHE 111 -14.299   6.048 -13.376
  840   2HB   PHE 111          1HB       PHE 111 -15.360   5.116 -14.433
  841    HD1  PHE 111           HD1      PHE 111 -13.353   8.057 -14.140
  842    HD2  PHE 111           HD2      PHE 111 -16.814   6.459 -16.121
  843    HE1  PHE 111           HE1      PHE 111 -13.172   9.817 -15.877
  844    HE2  PHE 111           HE2      PHE 111 -16.631   8.219 -17.858
  845    HZ   PHE 111           HZ       PHE 111 -14.810   9.899 -17.736
  846    H    ASP 112           H        ASP 112 -14.801   4.787 -11.840
  847    HA   ASP 112           HA       ASP 112 -16.241   3.597  -9.838
  848   1HB   ASP 112          2HB       ASP 112 -17.257   2.744 -12.482
  849   2HB   ASP 112          1HB       ASP 112 -16.935   1.431 -11.349
  850    H    ILE 113           H        ILE 113 -13.521   3.985 -10.782
  851    HA   ILE 113           HA       ILE 113 -12.573   1.149 -10.797
  852    HB   ILE 113           HB       ILE 113 -10.431   2.148 -11.735
  853   1HG1  ILE 113          2HG1      ILE 113 -12.268   4.552 -11.982
  854   2HG1  ILE 113          1HG1      ILE 113 -10.759   4.467 -11.073
  855   1HG2  ILE 113          1HG2      ILE 113 -12.647   2.831 -13.618
  856   2HG2  ILE 113          2HG2      ILE 113 -12.580   1.180 -13.000
  857   3HG2  ILE 113          3HG2      ILE 113 -11.208   1.846 -13.887
  858   1HD1  ILE 113          1HD1      ILE 113  -9.918   5.391 -13.000
  859   2HD1  ILE 113          2HD1      ILE 113 -11.188   4.700 -14.009
  860   3HD1  ILE 113          3HD1      ILE 113  -9.838   3.696 -13.479
  861    H    ILE 114           H        ILE 114 -10.661   0.703  -9.483
  862    HA   ILE 114           HA       ILE 114 -10.605   2.421  -7.061
  863    HB   ILE 114           HB       ILE 114 -10.974   0.146  -6.500
  864   1HG1  ILE 114          2HG1      ILE 114  -8.974  -0.473  -5.245
  865   2HG1  ILE 114          1HG1      ILE 114  -7.978   0.575  -6.257
  866   1HG2  ILE 114          1HG2      ILE 114  -9.595  -1.690  -7.395
  867   2HG2  ILE 114          2HG2      ILE 114  -8.660  -0.534  -8.341
  868   3HG2  ILE 114          3HG2      ILE 114 -10.365  -0.792  -8.703
  869   1HD1  ILE 114          1HD1      ILE 114 -10.338   1.749  -4.823
  870   2HD1  ILE 114          2HD1      ILE 114  -8.834   2.526  -5.316
  871   3HD1  ILE 114          3HD1      ILE 114  -8.852   1.443  -3.923
  872    H    TYR 115           H        TYR 115  -9.116   4.039  -7.291
  873    HA   TYR 115           HA       TYR 115  -6.611   3.561  -8.761
  874   1HB   TYR 115          2HB       TYR 115  -7.274   5.740  -9.160
  875   2HB   TYR 115          1HB       TYR 115  -7.994   5.925  -7.561
  876    HD1  TYR 115           HD1      TYR 115  -6.836   7.092  -5.895
  877    HD2  TYR 115           HD2      TYR 115  -4.668   5.472  -9.232
  878    HE1  TYR 115           HE1      TYR 115  -4.767   8.193  -5.084
  879    HE2  TYR 115           HE2      TYR 115  -2.598   6.573  -8.420
  880    HH   TYR 115           HH       TYR 115  -1.810   7.382  -5.916
  881    H    ASP 116           H        ASP 116  -5.090   2.399  -7.663
  882    HA   ASP 116           HA       ASP 116  -4.027   3.438  -5.162
  883   1HB   ASP 116          2HB       ASP 116  -5.951   2.180  -4.283
  884   2HB   ASP 116          1HB       ASP 116  -5.417   0.741  -5.152
  885    H    GLY 117           H        GLY 117  -2.148   3.469  -6.579
  886   1HA   GLY 117          2HA       GLY 117  -0.260   1.497  -6.247
  887   2HA   GLY 117          1HA       GLY 117  -1.138   0.956  -7.677
  888    H    TRP 118           H        TRP 118   0.521   3.842  -6.373
  889    HA   TRP 118           HA       TRP 118   1.292   4.492  -9.189
  890   1HB   TRP 118          2HB       TRP 118   1.042   6.757  -8.759
  891   2HB   TRP 118          1HB       TRP 118  -0.218   6.105  -7.712
  892    HD1  TRP 118           HD1      TRP 118   0.113   6.282  -5.127
  893    HE1  TRP 118           HE1      TRP 118   1.838   7.493  -3.641
  894    HE3  TRP 118           HE3      TRP 118   3.616   7.483  -8.642
  895    HZ2  TRP 118           HZ2      TRP 118   4.368   8.797  -3.910
  896    HZ3  TRP 118           HZ3      TRP 118   5.672   8.708  -8.001
  897    HH2  TRP 118           HH2      TRP 118   6.053   9.366  -5.641
  898    H    GLY 119           H        GLY 119   3.485   4.959  -9.568
  899   1HA   GLY 119          2HA       GLY 119   5.392   5.357  -7.431
  900   2HA   GLY 119          1HA       GLY 119   5.459   3.702  -8.040
  901    H    THR 120           H        THR 120   7.724   5.066  -8.421
  902    HA   THR 120           HA       THR 120   7.724   5.530 -11.353
  903    HB   THR 120           HB       THR 120   7.553   7.781 -10.498
  904    HG1  THR 120           HG1      THR 120   9.048   8.088 -11.936
  905   1HG2  THR 120          1HG2      THR 120   8.162   8.147  -8.362
  906   2HG2  THR 120          2HG2      THR 120   9.841   8.135  -8.903
  907   3HG2  THR 120          3HG2      THR 120   9.091   6.648  -8.319
  908    H    TYR 121           H        TYR 121  10.105   5.700 -12.114
  909    HA   TYR 121           HA       TYR 121  11.896   4.090 -10.354
  910   1HB   TYR 121          2HB       TYR 121  12.406   2.543 -12.050
  911   2HB   TYR 121          1HB       TYR 121  10.664   2.757 -12.225
  912    HD1  TYR 121           HD1      TYR 121  13.962   3.451 -13.684
  913    HD2  TYR 121           HD2      TYR 121   9.731   4.089 -14.071
  914    HE1  TYR 121           HE1      TYR 121  14.292   4.231 -16.015
  915    HE2  TYR 121           HE2      TYR 121  10.062   4.868 -16.402
  916    HH   TYR 121           HH       TYR 121  11.564   4.887 -18.136
  917    H    TYR 122           H        TYR 122  14.091   4.627 -10.554
  918    HA   TYR 122           HA       TYR 122  14.967   7.144 -11.056
  919   1HB   TYR 122          2HB       TYR 122  16.233   4.656 -10.791
  920   2HB   TYR 122          1HB       TYR 122  16.870   5.324 -12.293
  921    HD1  TYR 122           HD1      TYR 122  16.018   6.456  -8.815
  922    HD2  TYR 122           HD2      TYR 122  18.707   6.749 -12.153
  923    HE1  TYR 122           HE1      TYR 122  17.461   7.998  -7.517
  924    HE2  TYR 122           HE2      TYR 122  20.150   8.292 -10.855
  925    HH   TYR 122           HH       TYR 122  19.900   8.687  -7.537
  926    H    GLU 123           H        GLU 123  14.804   8.510 -12.753
  927    HA   GLU 123           HA       GLU 123  14.270   7.397 -15.446
  928   1HB   GLU 123          2HB       GLU 123  13.096   9.454 -14.187
  929   2HB   GLU 123          1HB       GLU 123  14.413  10.337 -14.961
  930   1HG   GLU 123          2HG       GLU 123  13.733   9.126 -17.124
  931   2HG   GLU 123          1HG       GLU 123  12.252   8.684 -16.274
  932    H    GLY 124           H        GLY 124  16.840   6.818 -14.779
  933   1HA   GLY 124          2HA       GLY 124  18.347   8.474 -16.693
  934   2HA   GLY 124          1HA       GLY 124  18.965   8.482 -15.040
  935    H    LEU 125           H        LEU 125  17.406   5.590 -16.097
  936    HA   LEU 125           HA       LEU 125  20.033   4.341 -16.746
  937   1HB   LEU 125          2HB       LEU 125  18.064   3.475 -14.625
  938   2HB   LEU 125          1HB       LEU 125  19.210   2.342 -15.343
  939    HG   LEU 125           HG       LEU 125  20.335   4.934 -14.428
  940   1HD1  LEU 125          1HD1      LEU 125  19.202   2.836 -12.568
  941   2HD1  LEU 125          2HD1      LEU 125  18.935   4.580 -12.533
  942   3HD1  LEU 125          3HD1      LEU 125  20.504   3.918 -12.076
  943   1HD2  LEU 125          1HD2      LEU 125  21.759   3.191 -15.383
  944   2HD2  LEU 125          2HD2      LEU 125  21.155   2.018 -14.213
  945   3HD2  LEU 125          3HD2      LEU 125  22.141   3.378 -13.671
  946    H    GLU 126           H        GLU 126  19.587   3.837 -18.871
  947    HA   GLU 126           HA       GLU 126  17.401   1.896 -19.339
  948   1HB   GLU 126          2HB       GLU 126  16.762   3.211 -21.435
  949   2HB   GLU 126          1HB       GLU 126  16.257   3.920 -19.901
  950   1HG   GLU 126          2HG       GLU 126  18.260   5.377 -19.925
  951   2HG   GLU 126          1HG       GLU 126  18.730   4.688 -21.480
  952    H    HIS 127           H        HIS 127  20.217   3.650 -20.605
  953    HA   HIS 127           HA       HIS 127  20.603   1.718 -22.772
  954   1HB   HIS 127          2HB       HIS 127  21.333   3.963 -23.209
  955   2HB   HIS 127          1HB       HIS 127  22.279   4.009 -21.721
  956    HD2  HIS 127           HD2      HIS 127  24.880   3.046 -21.990
  957    HE1  HIS 127           HE1      HIS 127  24.466   1.400 -25.856
  958    HE2  HIS 127           HE2      HIS 127  26.108   1.914 -23.992
  959    H    HIS 128           H        HIS 128  20.733  -0.246 -21.460
  960    HA   HIS 128           HA       HIS 128  22.936  -0.512 -19.546
  961   1HB   HIS 128          2HB       HIS 128  22.203  -2.856 -19.383
  962   2HB   HIS 128          1HB       HIS 128  20.819  -1.770 -19.251
  963    HD2  HIS 128           HD2      HIS 128  19.410  -4.174 -20.355
  964    HE1  HIS 128           HE1      HIS 128  20.661  -3.302 -24.293
  965    HE2  HIS 128           HE2      HIS 128  19.055  -4.675 -22.890
  966    H    HIS 129           H        HIS 129  23.933  -3.053 -20.191
  967    HA   HIS 129           HA       HIS 129  25.181  -2.612 -22.873
  968   1HB   HIS 129          2HB       HIS 129  26.632  -2.059 -20.785
  969   2HB   HIS 129          1HB       HIS 129  26.702  -3.806 -20.560
  970    HD2  HIS 129           HD2      HIS 129  29.385  -2.012 -21.627
  971    HE1  HIS 129           HE1      HIS 129  28.722  -4.134 -25.218
  972    HE2  HIS 129           HE2      HIS 129  30.403  -2.758 -23.909
  973    H    HIS 130           H        HIS 130  26.776  -5.151 -21.824
  974    HA   HIS 130           HA       HIS 130  24.702  -7.066 -22.801
  975   1HB   HIS 130          2HB       HIS 130  26.916  -6.787 -24.063
  976   2HB   HIS 130          1HB       HIS 130  27.682  -7.562 -22.676
  977    HD2  HIS 130           HD2      HIS 130  27.766 -10.297 -22.995
  978    HE1  HIS 130           HE1      HIS 130  24.408 -10.727 -25.521
  979    HE2  HIS 130           HE2      HIS 130  26.293 -11.964 -24.359
  980    H    HIS 131           H        HIS 131  23.705  -7.650 -20.857
  981    HA   HIS 131           HA       HIS 131  25.305  -9.380 -19.091
  982   1HB   HIS 131          2HB       HIS 131  23.753  -7.058 -17.916
  983   2HB   HIS 131          1HB       HIS 131  24.777  -8.204 -17.051
  984    HD2  HIS 131           HD2      HIS 131  25.299  -5.325 -19.755
  985    HE1  HIS 131           HE1      HIS 131  28.904  -5.900 -17.629
  986    HE2  HIS 131           HE2      HIS 131  27.743  -4.490 -19.390
  987    H    HIS 132           HN       HIS 132  23.861 -10.580 -17.567
  988    HA   HIS 132           HA       HIS 132  21.453 -11.447 -18.903
  989   1HB   HIS 132          2HB       HIS 132  22.620 -12.003 -16.167
  990   2HB   HIS 132          1HB       HIS 132  21.094 -12.708 -16.701
  991    HD2  HIS 132           HD2      HIS 132  23.058 -15.089 -16.457
  992    HE1  HIS 132           HE1      HIS 132  24.278 -14.472 -20.453
  993    HE2  HIS 132           HE2      HIS 132  24.277 -16.117 -18.521