*HEADER    RETINOIC-ACID TRANSPORT                 28-JUL-98   1BM5      
*TITLE     THE SOLUTION STRUCTURE OF A SITE-DIRECTED MUTANT (R111M) OF   
*TITLE    2 HUMAN CELLULAR RETIONIC ACID BINDING PROTEIN-TYPE II,        
*TITLE    3 NMR, 31 STRUCTURES                                           
*COMPND    MOL_ID: 1;                                                    
*COMPND   2 MOLECULE: CELLULAR RETINOIC ACID BINDING PROTEIN-TYPE II;    
*COMPND   3 CHAIN: NULL;                                                 
*COMPND   4 ENGINEERED: YES;                                             
*COMPND   5 MUTATION: R111M                                              
*SOURCE    MOL_ID: 1;                                                    
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                           
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                      
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                         
*SOURCE   5 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3) PLYSS;                  
*SOURCE   6 EXPRESSION_SYSTEM_CELLULAR_LOCATION: CYTOPLASM;              
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                      
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: PLASMID;                           
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET-17B                           
*KEYWDS    RETINOIC-ACID TRANSPORT, CRABPII                              
*EXPDTA    NMR, 31 STRUCTURES                                            
*AUTHOR    H.WANG,H.YAN                                                  
*REVDAT   1   12-OCT-04 1BM5    0   

set message=off echo=off end
!long range CaH(i)-CaH(j)
assign (resid  112 and  name HA   )(resid   92 and  name HA   ) 2.5 0.7 0.2
assign (resid  122 and  name HA   )(resid  131 and  name HA   ) 2.5 0.7 0.2
assign (resid  109 and  name HA   )(resid  123 and  name HA   ) 2.5 0.7 0.2
assign (resid   64 and  name HA   )(resid   51 and  name HA   ) 2.5 0.7 0.2
assign (resid  121 and  name HA   )(resid  111 and  name HA   ) 2.5 0.7 0.2
assign (resid  134 and  name HA   )(resid    9 and  name HA   ) 2.5 0.7 0.2
assign (resid  124 and  name HA   )(resid  129 and  name HA   ) 2.5 0.7 0.2
assign (resid   42 and  name HA   )(resid    6 and  name HA   ) 2.5 0.7 0.2
assign (resid  107 and  name HA   )(resid  125 and  name HA   ) 2.5 0.7 0.2
assign (resid   74 and  name HA   )(resid   80 and  name HA   ) 2.5 0.7 0.2 
assign (resid  135 and  name HA   )(resid  118 and  name HA   ) 4.0 2.2 1.0
assign (resid   55 and  name HA   )(resid   60 and  name HA   ) 2.5 0.7 0.4
assign (resid   43 and  name HA   )(resid   52 and  name HA   ) 2.5 0.7 0.2
assign (resid   66 and  name HA   )(resid   49 and  name HA   ) 2.5 0.7 0.2
assign (resid  113 and  name HA   )(resid  119 and  name HA   ) 2.5 0.7 0.2
assign (resid   12 and  name HA   )(resid  132 and  name HA   ) 2.3 0.7 0.2
assign (resid    8 and  name HA   )(resid   40 and  name HA   ) 4.0 2.2 1.0
assign (resid  130 and  name HA   )(resid   14 and  name HA   ) 4.0 2.2 1.0
assign (resid   53 and  name HA   )(resid   62 and  name HA   ) 2.5 0.7 0.2 
assign (resid   93 and  name HA   )(resid   87 and  name HA   ) 3.0 1.2 0.3
assign (resid  110 and  name HA   )(resid   94 and  name HA   ) 2.5 0.7 0.2
assign (resid   54 and  name HA   )(resid   41 and  name HA   ) 3.0 1.2 0.3
assign (resid    7 and  name HA   )(resid  136 and  name HA   ) 3.0 1.2 0.3
assign (resid   81 and  name HA   )(resid   99 and  name HA   ) 3.0 1.2 0.3
assign (resid   72 and  name HA   )(resid   82 and  name HA   ) 2.5 0.7 0.2
assign (resid   83 and  name HA   )(resid   97 and  name HA   ) 2.5 0.7 0.2
assign (resid  133 and  name HA   )(resid  120 and  name HA   ) 3.0 1.2 0.3
assign (resid   70 and  name HA   )(resid   84 and  name HA   ) 3.0 1.2 0.3
assign (resid  108 and  name HA   )(resid   96 and  name HA   ) 3.0 1.2 0.3
assign (resid   50 and  name HA   )(resid   45 and  name HA   ) 4.0 2.2 1.0
assign (resid    4 and  name HA   )(resid   44 and  name HA   ) 3.0 1.2 0.3
assign (resid   85 and  name HA   )(resid   95 and  name HA   ) 3.0 1.2 0.3
assign (resid   56 and  name HA   )(resid   39 and  name HA   ) 4.0 2.2 1.0 
!sequential and short range CaH(i)-CaH(j)
assign (resid  112 and  name HA   )(resid  113 and  name HA   ) 4.5 1.0 0.5
assign (resid  112 and  name HA   )(resid  111 and  name HA   ) 4.5 1.0 0.5
assign (resid   12 and  name HA   )(resid   13 and  name HA   ) 4.5 1.0 0.5
assign (resid   14 and  name HA   )(resid   13 and  name HA   ) 4.5 1.0 0.5
assign (resid   81 and  name HA   )(resid   82 and  name HA   ) 4.5 1.0 0.5
assign (resid   64 and  name HA   )(resid   63 and  name HA   ) 4.5 1.0 0.5
assign (resid  122 and  name HA   )(resid  121 and  name HA   ) 4.5 1.0 0.5
assign (resid  134 and  name HA   )(resid  135 and  name HA   ) 4.5 1.0 0.5
assign (resid  124 and  name HA   )(resid  125 and  name HA   ) 4.5 1.0 0.5
assign (resid  109 and  name HA   )(resid  110 and  name HA   ) 4.5 1.0 0.5
assign (resid  111 and  name HA   )(resid  110 and  name HA   ) 4.5 1.0 0.5
assign (resid   42 and  name HA   )(resid   41 and  name HA   ) 4.5 1.0 0.5
assign (resid  130 and  name HA   )(resid  129 and  name HA   ) 4.5 1.0 0.5
assign (resid   93 and  name HA   )(resid   94 and  name HA   ) 4.5 1.0 0.5
assign (resid   87 and  name HA   )(resid   88 and  name HA   ) 4.5 1.0 0.5
assign (resid  116 and  name HA   )(resid  117 and  name HA#  ) 4.5 1.0 1.5
assign (resid   76 and  name HA   )(resid   77 and  name HA   ) 4.5 1.0 0.5
assign (resid  126 and  name HA   )(resid  127 and  name HA   ) 4.5 1.0 0.5
assign (resid  127 and  name HA   )(resid  128 and  name HA   ) 4.0 2.0 1.0
assign (resid  105 and  name HA   )(resid  104 and  name HA#  ) 4.5 2.0 0.5
assign (resid  106 and  name HA   )(resid  107 and  name HA   ) 4.5 2.0 0.5
assign (resid   49 and  name HA   )(resid   50 and  name HA   ) 4.5 2.0 0.5
assign (resid   75 and  name HA   )(resid   76 and  name HA   ) 4.5 2.0 0.5
assign (resid   89 and  name HA   )(resid   90 and  name HA   ) 4.5 2.0 0.5
!sequential and short range HN(i)-HN(j)
assign (resid    3 and  name HN   )(resid    4 and  name HN   ) 2.5 0.7 0.4
assign (resid    4 and  name HN   )(resid    5 and  name HN   ) 4.0 2.0 1.0
assign (resid    5 and  name HN   )(resid    6 and  name HN   ) 4.0 2.0 1.0
assign (resid    5 and  name HN   )(resid   43 and  name HN   ) 3.0 1.2 0.5
assign (resid    6 and  name HN   )(resid    7 and  name HN   ) 4.0 2.2 1.0
assign (resid    7 and  name HN   )(resid    8 and  name HN   ) 4.0 2.2 1.0
assign (resid    7 and  name HN   )(resid   41 and  name HN   ) 4.0 2.2 1.0
assign (resid    8 and  name HN   )(resid    9 and  name HN   ) 4.0 2.0 1.0
assign (resid    8 and  name HN   )(resid  137 and  name HN   ) 3.0 1.2 0.5
assign (resid    8 and  name HN   )(resid  135 and  name HN   ) 3.0 1.2 0.3
assign (resid    9 and  name HN   )(resid   10 and  name HN   ) 4.0 2.2 1.0
assign (resid   10 and  name HN   )(resid   11 and  name HN   ) 2.5 0.7 0.2
assign (resid   10 and  name HN   )(resid  133 and  name HN   ) 4.0 2.2 1.0
assign (resid   11 and  name HN   )(resid  133 and  name HN   ) 3.0 1.2 0.5
assign (resid   12 and  name HN   )(resid   11 and  name HN   ) 4.0 2.0 1.0
assign (resid   12 and  name HN   )(resid   13 and  name HN   ) 4.0 2.0 1.0
assign (resid   13 and  name HN   )(resid  131 and  name HN   ) 3.0 1.2 0.5
assign (resid   14 and  name HN   )(resid   15 and  name HN   ) 3.0 1.2 0.5
assign (resid   14 and  name HN   )(resid   13 and  name HN   ) 4.0 2.2 1.0
assign (resid   14 and  name HN   )(resid   16 and  name HN   ) 4.0 2.2 1.0
assign (resid   14 and  name HN   )(resid   17 and  name HN   ) 4.0 2.2 1.2
assign (resid   15 and  name HN   )(resid   16 and  name HN   ) 2.5 0.7 0.4
assign (resid   15 and  name HN   )(resid   17 and  name HN   ) 4.0 2.2 1.0
assign (resid   16 and  name HN   )(resid   17 and  name HN   ) 2.5 0.7 0.2
assign (resid   16 and  name HN   )(resid   18 and  name HN   ) 4.0 2.0 1.0
assign (resid   17 and  name HN   )(resid   20 and  name HN   ) 4.0 2.0 1.0
assign (resid   17 and  name HN   )(resid   18 and  name HN   ) 2.5 0.7 0.4
assign (resid   17 and  name HN   )(resid   19 and  name HN   ) 4.0 2.0 1.0
assign (resid   18 and  name HN   )(resid   19 and  name HN   ) 2.5 0.7 0.4
assign (resid   19 and  name HN   )(resid   20 and  name HN   ) 2.5 0.7 0.4
assign (resid   19 and  name HN   )(resid   21 and  name HN   ) 4.0 2.0 1.0
assign (resid   19 and  name HN   )(resid   22 and  name HN   ) 4.0 2.0 1.0
assign (resid   20 and  name HN   )(resid   18 and  name HN   ) 3.0 1.2 1.0
assign (resid   20 and  name HN   )(resid   22 and  name HN   ) 4.0 2.0 1.0
assign (resid   20 and  name HN   )(resid   21 and  name HN   ) 2.5 0.7 0.4
assign (resid   21 and  name HN   )(resid   22 and  name HN   ) 2.5 0.7 0.4
assign (resid   21 and  name HN   )(resid   23 and  name HN   ) 3.0 1.2 0.9
assign (resid   22 and  name HN   )(resid   23 and  name HN   ) 2.5 0.7 0.4
!assign (resid   24 and  name HN   )(resid   22 and  name HN   ) 4.0 2.2 1.0
assign (resid   27 and  name HN   )(resid   26 and  name HN   ) 3.0 1.2 0.5
assign (resid   27 and  name HN   )(resid   29 and  name HN   ) 4.0 2.0 1.0
assign (resid   27 and  name HN   )(resid   28 and  name HN   ) 2.5 0.7 0.2
assign (resid   28 and  name HN   )(resid   26 and  name HN   ) 4.0 2.0 1.0
assign (resid   28 and  name HN   )(resid   29 and  name HN   ) 3.0 1.2 0.3
assign (resid   30 and  name HN   )(resid   31 and  name HN   ) 4.0 2.2 1.0
assign (resid   30 and  name HN   )(resid   32 and  name HN   ) 4.0 2.2 1.0
assign (resid   31 and  name HN   )(resid   32 and  name HN   ) 2.5 0.7 0.2
assign (resid   32 and  name HN   )(resid   33 and  name HN   ) 2.5 0.7 0.2
assign (resid   33 and  name HN   )(resid   31 and  name HN   ) 4.0 2.0 1.0
assign (resid   33 and  name HN   )(resid   35 and  name HN   ) 4.0 2.0 1.0
assign (resid   34 and  name HN   )(resid   35 and  name HN   ) 2.5 0.7 0.4
assign (resid   34 and  name HN   )(resid   33 and  name HN   ) 3.0 1.2 0.3
assign (resid   35 and  name HN   )(resid   36 and  name HN   ) 2.5 0.7 0.4
assign (resid   36 and  name HN   )(resid   37 and  name HN   ) 4.0 2.0 1.0
assign (resid   37 and  name HN   )(resid   38 and  name HN   ) 2.5 0.7 0.4
assign (resid   40 and  name HN   )(resid   55 and  name HN   ) 3.0 1.2 0.5
assign (resid   40 and  name HN   )(resid   41 and  name HN   ) 4.5 2.0 0.5
assign (resid   42 and  name HN   )(resid   53 and  name HN   ) 3.0 1.2 0.5
assign (resid   44 and  name HN   )(resid   53 and  name HN   ) 4.5 2.0 1.0
assign (resid   44 and  name HN   )(resid   43 and  name HN   ) 4.5 2.0 0.7
assign (resid   44 and  name HN   )(resid   51 and  name HN   ) 4.0 2.0 1.0
assign (resid   48 and  name HN   )(resid   49 and  name HN   ) 2.5 0.7 0.4
assign (resid   47 and  name HN   )(resid   46 and  name HN   ) 4.0 2.0 1.0
assign (resid   48 and  name HN   )(resid   47 and  name HN   ) 4.5 2.0 0.7
assign (resid   49 and  name HN   )(resid   50 and  name HN   ) 4.0 2.0 1.0
assign (resid   50 and  name HN   )(resid   65 and  name HN   ) 3.0 1.2 0.5
assign (resid   51 and  name HN   )(resid   50 and  name HN   ) 4.0 2.2 1.0
assign (resid   53 and  name HN   )(resid   54 and  name HN   ) 4.5 2.0 0.5
assign (resid   54 and  name HN   )(resid   63 and  name HN   ) 4.5 2.0 0.7
assign (resid   54 and  name HN   )(resid   61 and  name HN   ) 3.0 1.2 0.5
assign (resid   54 and  name HN   )(resid   55 and  name HN   ) 4.5 2.0 0.7
assign (resid   55 and  name HN   )(resid   56 and  name HN   ) 4.0 2.0 1.0
assign (resid   56 and  name HN   )(resid   61 and  name HN   ) 4.0 2.0 1.0
assign (resid   56 and  name HN   )(resid   59 and  name HN   ) 3.0 1.2 0.5
assign (resid   61 and  name HN   )(resid   60 and  name HN   ) 4.0 2.2 1.0
assign (resid   62 and  name HN   )(resid   63 and  name HN   ) 4.0 2.2 1.0
assign (resid   62 and  name HN   )(resid   61 and  name HN   ) 4.0 2.2 1.0
assign (resid   63 and  name HN   )(resid   52 and  name HN   ) 3.0 1.2 0.5
assign (resid   63 and  name HN   )(resid   64 and  name HN   ) 4.0 2.2 1.0
assign (resid   64 and  name HN   )(resid   65 and  name HN   ) 4.0 2.2 1.0
assign (resid   66 and  name HN   )(resid   67 and  name HN   ) 4.0 2.2 1.0
assign (resid   68 and  name HN   )(resid   69 and  name HN   ) 3.0 1.2 0.5
!assign (resid   68 and  name HN   )(resid   70 and  name HN   ) 4.5 2.0 0.7
assign (resid   69 and  name HN   )(resid   70 and  name HN   ) 4.0 2.2 1.0
assign (resid   70 and  name HN   )(resid   71 and  name HN   ) 4.5 2.5 0.5
!assign (resid   70 and  name HN   )(resid   67 and  name HN   ) 4.0 2.2 1.0
assign (resid   71 and  name HN   )(resid   72 and  name HN   ) 4.0 2.2 1.0
assign (resid   71 and  name HN   )(resid   83 and  name HN   ) 3.0 1.2 0.5
assign (resid   72 and  name HN   )(resid   73 and  name HN   ) 4.0 2.2 1.0
assign (resid   73 and  name HN   )(resid   81 and  name HN   ) 4.0 2.2 1.0
assign (resid   74 and  name HN   )(resid   73 and  name HN   ) 4.0 2.0 1.0
assign (resid   74 and  name HN   )(resid   75 and  name HN   ) 4.0 2.0 1.0
assign (resid   75 and  name HN   )(resid   79 and  name HN   ) 3.0 1.2 0.5
assign (resid   75 and  name HN   )(resid   81 and  name HN   ) 4.0 2.0 1.0
assign (resid   76 and  name HN   )(resid   77 and  name HN   ) 3.0 1.2 0.5
assign (resid   76 and  name HN   )(resid   78 and  name HN   ) 4.0 2.2 1.0
assign (resid   77 and  name HN   )(resid   78 and  name HN   ) 2.5 0.7 0.4
assign (resid   78 and  name HN   )(resid   75 and  name HN   ) 4.0 2.0 1.0
assign (resid   79 and  name HN   )(resid   78 and  name HN   ) 3.0 1.2 0.5
assign (resid   79 and  name HN   )(resid   77 and  name HN   ) 4.0 2.2 1.0
assign (resid   82 and  name HN   )(resid   98 and  name HN   ) 3.0 1.2 0.5
assign (resid   83 and  name HN   )(resid   84 and  name HN   ) 4.0 2.2 1.0
assign (resid   83 and  name HN   )(resid   73 and  name HN   ) 4.0 2.2 1.0
assign (resid   84 and  name HN   )(resid   96 and  name HN   ) 3.0 1.2 0.3
assign (resid   84 and  name HN   )(resid   85 and  name HN   ) 4.0 2.0 1.0
assign (resid   85 and  name HN   )(resid   86 and  name HN   ) 4.5 2.0 0.5
assign (resid   85 and  name HN   )(resid   68 and  name HN   ) 4.5 2.0 0.5
assign (resid   86 and  name HN   )(resid   94 and  name HN   ) 3.0 1.2 0.5
assign (resid   86 and  name HN   )(resid   96 and  name HN   ) 4.0 2.0 1.0
assign (resid   86 and  name HN   )(resid   87 and  name HN   ) 4.0 2.0 1.0
assign (resid   87 and  name HN   )(resid   88 and  name HN   ) 4.0 2.0 1.0
assign (resid   88 and  name HN   )(resid   89 and  name HN   ) 2.5 0.7 0.2
assign (resid   89 and  name HN   )(resid   92 and  name HN   ) 3.0 1.2 0.5
assign (resid   89 and  name HN   )(resid   91 and  name HN   ) 4.0 2.0 1.0
assign (resid   90 and  name HN   )(resid   91 and  name HN   ) 3.0 1.2 0.3
assign (resid   90 and  name HN   )(resid   92 and  name HN   ) 4.0 2.0 1.0
assign (resid   91 and  name HN   )(resid   92 and  name HN   ) 2.5 0.7 0.2
assign (resid   92 and  name HN   )(resid   88 and  name HN   ) 3.0 1.2 0.5
assign (resid   93 and  name HN   )(resid   92 and  name HN   ) 4.5 2.0 0.7
assign (resid   93 and  name HN   )(resid  111 and  name HN   ) 3.0 1.2 0.5
assign (resid   93 and  name HN   )(resid  113 and  name HN   ) 4.5 2.0 0.7
assign (resid   94 and  name HN   )(resid   93 and  name HN   ) 4.0 2.0 1.0
assign (resid   94 and  name HN   )(resid   88 and  name HN   ) 4.0 2.0 1.0
assign (resid   95 and  name HN   )(resid   94 and  name HN   ) 4.0 2.2 1.0
assign (resid   95 and  name HN   )(resid   96 and  name HN   ) 4.5 2.0 0.5
assign (resid   95 and  name HN   )(resid  109 and  name HN   ) 3.0 1.2 0.5
assign (resid   97 and  name HN   )(resid  107 and  name HN   ) 4.5 2.5 0.5
assign (resid   97 and  name HN   )(resid   98 and  name HN   ) 4.0 2.2 1.0
assign (resid   97 and  name HN   )(resid   96 and  name HN   ) 4.0 2.2 1.0
assign (resid   99 and  name HN   )(resid  100 and  name HN   ) 4.0 2.2 1.0
assign (resid  100 and  name HN   )(resid  101 and  name HN   ) 2.5 0.7 0.2
assign (resid  100 and  name HN   )(resid   82 and  name HN   ) 4.0 2.0 1.0
assign (resid  101 and  name HN   )(resid   99 and  name HN   ) 4.0 2.0 1.0
assign (resid  102 and  name HN   )(resid  103 and  name HN   ) 4.5 2.0 0.7
assign (resid  102 and  name HN   )(resid  101 and  name HN   ) 4.5 2.0 0.7
assign (resid  106 and  name HN   )(resid  126 and  name HN   ) 3.0 1.2 0.5
assign (resid  107 and  name HN   )(resid  108 and  name HN   ) 4.0 2.2 1.0
assign (resid  107 and  name HN   )(resid  106 and  name HN   ) 4.0 2.2 1.0
assign (resid  108 and  name HN   )(resid  124 and  name HN   ) 3.0 1.2 0.5
assign (resid  108 and  name HN   )(resid  126 and  name HN   ) 4.5 2.0 0.7
assign (resid  109 and  name HN   )(resid  110 and  name HN   ) 4.0 2.0 1.0
assign (resid  110 and  name HN   )(resid  122 and  name HN   ) 3.0 1.2 0.3
assign (resid  110 and  name HN   )(resid  124 and  name HN   ) 4.5 2.0 0.5
assign (resid  110 and  name HN   )(resid  111 and  name HN   ) 4.0 2.0 1.0
assign (resid  111 and  name HN   )(resid  112 and  name HN   ) 4.0 2.2 1.0
assign (resid  112 and  name HN   )(resid  113 and  name HN   ) 4.0 2.2 1.0
assign (resid  112 and  name HN   )(resid  120 and  name HN   ) 3.0 1.2 0.5
assign (resid  113 and  name HN   )(resid   91 and  name HN   ) 4.0 2.2 1.0
assign (resid  113 and  name HN   )(resid  114 and  name HN   ) 4.0 2.2 1.0
assign (resid  114 and  name HN   )(resid  118 and  name HN   ) 3.0 1.2 0.5
assign (resid  114 and  name HN   )(resid  115 and  name HN   ) 4.0 2.2 1.0
assign (resid  114 and  name HN   )(resid  116 and  name HN   ) 4.5 2.0 0.7
assign (resid  116 and  name HN   )(resid  117 and  name HN   ) 3.0 1.2 0.3
assign (resid  116 and  name HN   )(resid  118 and  name HN   ) 4.0 2.0 1.0
assign (resid  117 and  name HN   )(resid  118 and  name HN   ) 2.5 0.7 0.2
assign (resid  118 and  name HN   )(resid  119 and  name HN   ) 4.0 2.2 1.0
assign (resid  119 and  name HN   )(resid  134 and  name HN   ) 4.0 2.2 1.0
assign (resid  120 and  name HN   )(resid  121 and  name HN   ) 4.0 2.2 1.0
assign (resid  120 and  name HN   )(resid  119 and  name HN   ) 4.0 2.2 1.0
assign (resid  121 and  name HN   )(resid  132 and  name HN   ) 3.0 1.2 0.5
assign (resid  123 and  name HN   )(resid  130 and  name HN   ) 3.0 1.2 0.5
assign (resid  123 and  name HN   )(resid  122 and  name HN   ) 4.0 2.2 1.0
assign (resid  123 and  name HN   )(resid  124 and  name HN   ) 4.0 2.2 1.0
assign (resid  125 and  name HN   )(resid  126 and  name HN   ) 4.0 2.2 1.0
assign (resid  125 and  name HN   )(resid  128 and  name HN   ) 3.0 1.2 0.5
assign (resid  125 and  name HN   )(resid  130 and  name HN   ) 4.5 1.5 0.7
assign (resid  126 and  name HN   )(resid  127 and  name HN   ) 4.0 2.0 1.0
assign (resid  126 and  name HN   )(resid  128 and  name HN   ) 4.0 2.0 1.0
assign (resid  129 and  name HN   )(resid  130 and  name HN   ) 4.0 2.0 1.0
assign (resid  130 and  name HN   )(resid  124 and  name HN   ) 4.5 2.0 0.5
assign (resid  130 and  name HN   )(resid  131 and  name HN   ) 4.5 2.0 0.5
assign (resid  131 and  name HN   )(resid  13  and  name HN   ) 3.0 1.2 0.5
assign (resid  132 and  name HN   )(resid  131 and  name HN   ) 4.5 2.0 0.7
assign (resid  132 and  name HN   )(resid  122 and  name HN   ) 4.5 2.0 0.7
assign (resid  133 and  name HN   )(resid  134 and  name HN   ) 4.0 2.2 1.0
assign (resid  133 and  name HN   )(resid  132 and  name HN   ) 4.0 2.2 1.0
assign (resid  133 and  name HN   )(resid   11 and  name HN   ) 2.5 0.7 0.4
assign (resid  133 and  name HN   )(resid   10 and  name HN   ) 3.0 1.2 0.8
assign (resid  133 and  name HN   )(resid   12 and  name HA   ) 3.0 1.2 0.8
assign (resid  134 and  name HN   )(resid  135 and  name HN   ) 4.0 2.2 1.0
assign (resid  135 and  name HN   )(resid    9 and  name HN   ) 4.0 2.0 1.0
assign (resid  135 and  name HN   )(resid  136 and  name HN   ) 4.0 2.0 1.0
assign (resid  136 and  name HN   )(resid  137 and  name HN   ) 4.5 2.0 0.5
assign (resid  136 and  name HN   )(resid    8 and  name HN   ) 4.0 2.2 1.0
assign (resid  137 and  name HN   )(resid    7 and  name HN   ) 3.0 1.2 0.5
!CaH(i)-CbH(j) intraresidual and interresidual NOEs
!P1
assign (resid    1 and  name HA   )(resid    1 and  name HB#  ) 2.5 0.7 0.2
assign (resid    1 and  name HA   )(resid    1 and  name HG#  ) 4.0 2.0 1.0
assign (resid    1 and  name HA   )(resid    1 and  name HD#  ) 4.0 2.0 1.0
!N2
assign (resid    2 and  name HA   )(resid    2 and  name HB#  ) 2.5 0.7 0.2
assign (resid    2 and  name HA   )(resid   45 and  name HB#  ) 3.0 2.2 1.3
!F3
assign (resid    3 and  name HA   )(resid    3 and  name HB1  ) 3.0 1.2 0.3
assign (resid    3 and  name HA   )(resid    3 and  name HB2  ) 3.0 1.2 0.3
assign (resid    3 and  name HA   )(resid  113 and  name HD1# ) 3.0 1.7 1.6
assign (resid    3 and  name HA   )(resid  113 and  name HD2# ) 2.5 1.5 1.2
assign (resid    3 and  name HN   )(resid    3 and  name HB1  ) 3.0 1.2 0.5
assign (resid    3 and  name HN   )(resid    3 and  name HB2  ) 2.5 0.7 0.4
assign (resid    3 and  name HN   )(resid    3 and  name HD1  ) 2.5 0.7 0.2
assign (resid    3 and  name HN   )(resid    3 and  name HE1  ) 4.0 2.0 1.0
assign (resid    3 and  name HN   )(resid   45 and  name HB#  ) 4.0 3.0 2.0
assign (resid    3 and  name HN   )(resid   45 and  name HG#  ) 3.0 2.2 1.5
assign (resid    3 and  name HN   )(resid  113 and  name HG   ) 4.0 2.0 1.0
assign (resid    3 and  name HN   )(resid  113 and  name HD2# ) 4.0 3.0 2.0
assign (resid    3 and  name HN   )(resid  113 and  name HD1# ) 4.5 3.0 1.7
assign (resid    3 and  name HN   )(resid    2 and  name HA   ) 2.5 0.7 0.2
assign (resid    3 and  name HN   )(resid    2 and  name HB1  ) 3.0 1.2 0.5
assign (resid    3 and  name HN   )(resid    2 and  name HB2  ) 4.0 2.0 1.0
assign (resid    3 and  name HN   )(resid   50 and  name HD2  ) 4.0 2.0 1.0
assign (resid    3 and  name HN   )(resid   50 and  name HE2  ) 4.0 2.0 1.0
assign (resid    3 and  name HN   )(resid   43 and  name HG2# ) 4.0 3.0 2.0
assign (resid    3 and  name HB1  )(resid   43 and  name HG2# ) 3.0 2.2 1.5
assign (resid    3 and  name HB2  )(resid   43 and  name HG2# ) 3.0 2.2 1.5
assign (resid    3 and  name HB1  )(resid   43 and  name HG1# ) 4.0 3.0 2.0
!S4
assign (resid    4 and  name HA   )(resid    4 and  name HB#  ) 2.5 0.7 0.2
assign (resid    4 and  name HA   )(resid   43 and  name HG2# ) 3.0 1.7 1.3
assign (resid    4 and  name HA   )(resid   43 and  name HB   ) 3.0 1.2 0.3
assign (resid    4 and  name HA   )(resid   44 and  name HB#  ) 4.5 3.0 1.5
assign (resid    4 and  name HA   )(resid   43 and  name HD1# ) 4.5 3.0 1.5
assign (resid    4 and  name HN   )(resid    4 and  name HA   ) 2.5 0.7 0.4
assign (resid    4 and  name HN   )(resid    4 and  name HB#  ) 2.5 1.3 0.8
assign (resid    4 and  name HN   )(resid    2 and  name HA   ) 3.0 1.2 0.5
assign (resid    4 and  name HN   )(resid    2 and  name HB1  ) 4.0 2.0 1.0
assign (resid    4 and  name HN   )(resid    2 and  name HB2  ) 4.0 2.0 1.0
assign (resid    4 and  name HN   )(resid   45 and  name HG#  ) 4.0 3.0 2.0
assign (resid    4 and  name HN   )(resid  113 and  name HG   ) 4.5 2.5 1.0
assign (resid    4 and  name HN   )(resid  113 and  name HD2# ) 4.0 3.0 2.0
assign (resid    4 and  name HN   )(resid   43 and  name HB   ) 4.0 2.0 1.0
assign (resid    4 and  name HN   )(resid   43 and  name HG2# ) 4.0 3.0 2.0
assign (resid    4 and  name HN   )(resid    3 and  name HD1  ) 4.0 2.0 1.0
assign (resid    4 and  name HN   )(resid    3 and  name HB1  ) 4.0 2.0 1.0
assign (resid    4 and  name HN   )(resid    3 and  name HB2  ) 4.0 2.0 1.0
!G5
assign (resid    5 and  name HN   )(resid    4 and  name HA   ) 2.3 0.7 0.2
assign (resid    5 and  name HN   )(resid   43 and  name HB   ) 3.0 1.2 0.3
assign (resid    5 and  name HN   )(resid   43 and  name HD1# ) 4.0 3.0 2.0
assign (resid    5 and  name HN   )(resid    5 and  name HA1  ) 2.5 0.7 0.4
assign (resid    5 and  name HN   )(resid    5 and  name HA2  ) 2.5 0.7 0.4
assign (resid    5 and  name HN   )(resid    7 and  name HD1  ) 4.5 2.5 0.7
assign (resid    5 and  name HN   )(resid   42 and  name HA   ) 4.0 2.0 1.0
assign (resid    5 and  name HN   )(resid    4 and  name HB#  ) 3.0 2.2 1.5
!N6
assign (resid    6 and  name HA   )(resid    6 and  name HB#  ) 2.5 0.7 0.2
assign (resid    6 and  name HA   )(resid   42 and  name HG#  ) 4.0 3.2 2.0
assign (resid    6 and  name HA   )(resid   42 and  name HB1  ) 4.0 2.2 1.0
assign (resid    6 and  name HA   )(resid   42 and  name HB2  ) 3.0 1.2 0.3
assign (resid    6 and  name HN   )(resid    6 and  name HA   ) 2.5 0.7 0.4
assign (resid    6 and  name HN   )(resid    6 and  name HB#  ) 2.5 1.3 0.8
assign (resid    6 and  name HN   )(resid    5 and  name HA1  ) 2.5 0.7 0.2
assign (resid    6 and  name HN   )(resid    5 and  name HA2  ) 2.5 0.7 0.2
assign (resid    6 and  name HN   )(resid  136 and  name HD#  ) 4.0 3.2 2.0
assign (resid    6 and  name HN   )(resid  136 and  name HG#  ) 2.5 1.7 1.4
assign (resid    6 and  name HN   )(resid  137 and  name HG#  ) 4.0 3.2 2.0
assign (resid    6 and  name HN   )(resid    6 and  name HD21 ) 4.0 2.0 1.0
assign (resid    6 and  name HN   )(resid    6 and  name HD22 ) 4.0 2.0 1.0 
assign (resid    6 and  name HA   )(resid    6 and  name HD21 ) 4.0 2.0 1.0
assign (resid    6 and  name HA   )(resid    6 and  name HD22 ) 4.0 2.0 1.0
assign (resid    6 and  name HD21 )(resid   42 and  name HG#  ) 4.0 3.0 2.0
assign (resid    6 and  name HD22 )(resid   42 and  name HG#  ) 4.0 3.0 2.0
assign (resid    7 and  name HN   )(resid    6 and  name HD2# ) 4.0 3.0 2.0 
assign (resid    7 and  name HB2  )(resid    6 and  name HD2# ) 4.5 2.0 1.7
!W7
assign (resid    7 and  name HA   )(resid    7 and  name HB2  ) 3.0 1.2 0.3
assign (resid    7 and  name HA   )(resid    7 and  name HB1  ) 3.0 1.2 0.3
assign (resid    7 and  name HN   )(resid    6 and  name HA   ) 2.3 0.7 0.2
assign (resid    7 and  name HN   )(resid    6 and  name HB#  ) 2.5 1.7 1.2
assign (resid    7 and  name HN   )(resid   42 and  name HA   ) 3.0 1.2 0.5
assign (resid    7 and  name HN   )(resid   42 and  name HB#  ) 4.0 3.2 2.0
assign (resid    7 and  name HN   )(resid   41 and  name HB   ) 4.0 2.2 1.0
assign (resid    7 and  name HN   )(resid   41 and  name HG2# ) 4.0 3.0 2.3
assign (resid    7 and  name HN   )(resid   43 and  name HD1# ) 4.0 3.0 2.3
assign (resid    7 and  name HN   )(resid    7 and  name HD1  ) 3.0 1.2 0.5
assign (resid    7 and  name HN   )(resid    7 and  name HB2  ) 2.5 0.7 0.4
assign (resid    7 and  name HN   )(resid    7 and  name HB1  ) 3.0 1.2 1.0
assign (resid    7 and  name HN   )(resid    7 and  name HA   ) 2.5 0.7 0.4 
assign (resid    7 and  name HN   )(resid  134 and  name HD2  ) 4.5 2.0 0.7
!K8
assign (resid    8 and  name HA   )(resid    9 and  name HG2# ) 4.0 3.2 2.0
assign (resid    8 and  name HA   )(resid    8 and  name HB#  ) 2.5 0.7 0.2
assign (resid    8 and  name HA   )(resid    9 and  name HB   ) 4.0 2.0 1.0
assign (resid    8 and  name HA   )(resid    8 and  name HG#  ) 3.0 1.8 0.9
assign (resid    8 and  name HA   )(resid    8 and  name HD#  ) 4.0 3.2 2.0
assign (resid    8 and  name HA   )(resid   40 and  name HB#  ) 3.0 2.2 1.8
assign (resid    8 and  name HN   )(resid    7 and  name HA   ) 2.3 0.7 0.2
assign (resid    8 and  name HA   )(resid    7 and  name HB1  ) 4.0 2.0 1.0
assign (resid    8 and  name HA   )(resid    7 and  name HB2  ) 4.0 2.0 1.0
assign (resid    8 and  name HN   )(resid    8 and  name HA   ) 2.5 0.7 0.4
assign (resid    8 and  name HN   )(resid    8 and  name HB#  ) 2.5 1.3 0.8
assign (resid    8 and  name HN   )(resid    8 and  name HG#  ) 2.5 1.3 1.4
assign (resid    8 and  name HN   )(resid    8 and  name HD#  ) 4.0 3.2 2.0
assign (resid    8 and  name HN   )(resid  134 and  name HA   ) 4.0 2.2 1.0
assign (resid    8 and  name HN   )(resid  136 and  name HA   ) 3.0 1.2 0.8
assign (resid    8 and  name HN   )(resid  134 and  name HB1  ) 4.0 2.2 1.0
assign (resid    8 and  name HN   )(resid  137 and  name HG#  ) 4.0 3.0 2.0
assign (resid    8 and  name HN   )(resid  135 and  name HG1# ) 3.0 2.2 1.5
assign (resid    8 and  name HN   )(resid  135 and  name HG2# ) 4.0 3.0 2.5
assign (resid    8 and  name HN   )(resid    7 and  name HE3  ) 4.0 2.0 1.0
assign (resid    8 and  name HN   )(resid  134 and  name HD2  ) 3.0 1.2 0.3
assign (resid    8 and  name HN   )(resid    7 and  name HB2  ) 4.0 2.2 1.0
assign (resid    8 and  name HN   )(resid    7 and  name HB1  ) 3.0 1.2 0.5
!I9
assign (resid    9 and  name HA   )(resid    9 and  name HB   ) 2.5 0.7 0.2
assign (resid    9 and  name HA   )(resid    9 and  name HD1# ) 4.0 3.0 2.0
assign (resid    9 and  name HA   )(resid    9 and  name HG1# ) 3.0 1.8 0.9
assign (resid    9 and  name HA   )(resid    9 and  name HG2# ) 3.0 1.8 0.9
assign (resid    9 and  name HN   )(resid    9 and  name HA   ) 2.5 0.7 0.4
assign (resid    9 and  name HN   )(resid    9 and  name HB   ) 2.5 0.7 0.4
assign (resid    9 and  name HN   )(resid    9 and  name HG2# ) 2.5 1.7 1.2
assign (resid    9 and  name HN   )(resid  134 and  name HA   ) 4.0 2.0 1.0
assign (resid    9 and  name HN   )(resid  134 and  name HD2  ) 3.0 1.2 0.5
assign (resid    9 and  name HN   )(resid  134 and  name HE2  ) 4.0 2.0 1.0
assign (resid    9 and  name HN   )(resid    8 and  name HA   ) 2.5 0.7 0.2
assign (resid    9 and  name HN   )(resid    8 and  name HB#  ) 2.5 1.7 1.4
assign (resid    9 and  name HN   )(resid    8 and  name HG#  ) 4.0 3.0 2.0
!I10
assign (resid   10 and  name HA   )(resid   10 and  name HB   ) 2.5 0.7 0.2
assign (resid   10 and  name HA   )(resid   10 and  name HG1# ) 4.0 2.8 1.6
assign (resid   10 and  name HA   )(resid   10 and  name HG2# ) 2.5 1.3 0.8
assign (resid   10 and  name HA   )(resid   10 and  name HD1# ) 4.0 2.8 1.6
assign (resid   10 and  name HN   )(resid   10 and  name HB   ) 4.0 2.2 1.0
assign (resid   10 and  name HN   )(resid   10 and  name HG1# ) 3.0 2.2 1.5
assign (resid   10 and  name HN   )(resid   10 and  name HG2# ) 2.5 1.7 1.4
assign (resid   10 and  name HN   )(resid   10 and  name HD1# ) 4.0 3.0 2.0
assign (resid   10 and  name HN   )(resid    9 and  name HA   ) 2.5 0.7 0.4
assign (resid   10 and  name HN   )(resid    9 and  name HB   ) 4.0 2.2 1.0
assign (resid   10 and  name HN   )(resid    9 and  name HG12 ) 3.0 1.2 0.5
assign (resid   10 and  name HN   )(resid  134 and  name HA   ) 3.0 1.2 0.5
assign (resid   10 and  name HN   )(resid  134 and  name HD2  ) 4.5 2.0 1.0
!R11
assign (resid   11 and  name HA   )(resid   11 and  name HB#  ) 2.5 0.7 0.2
assign (resid   11 and  name HA   )(resid   11 and  name HG#  ) 2.5 1.3 0.8
assign (resid   11 and  name HA   )(resid   11 and  name HD#  ) 4.0 3.0 2.0
assign (resid   11 and  name HA   )(resid   12 and  name HB#  ) 4.0 3.0 2.0
assign (resid   11 and  name HE   )(resid   10 and  name HD1# ) 4.5 3.0 1.5
assign (resid   11 and  name HE   )(resid   11 and  name HB#  ) 4.5 3.0 1.5
assign (resid   11 and  name HN   )(resid   11 and  name HB#  ) 2.5 1.3 0.8
assign (resid   11 and  name HN   )(resid   11 and  name HG#  ) 4.0 3.0 2.0
assign (resid   11 and  name HN   )(resid   10 and  name HA   ) 4.0 2.2 1.0
assign (resid   11 and  name HN   )(resid   10 and  name HB   ) 3.5 1.7 0.5
assign (resid   11 and  name HN   )(resid   10 and  name HG2# ) 3.0 2.2 1.8 
assign (resid   11 and  name HN   )(resid   10 and  name HG11 ) 3.0 1.2 0.8
assign (resid   11 and  name HN   )(resid   10 and  name HD1# ) 4.0 3.0 2.0
assign (resid   11 and  name HN   )(resid    9 and  name HA   ) 4.0 2.2 1.0
assign (resid   11 and  name HN   )(resid    9 and  name HB   ) 4.0 2.2 1.0
assign (resid   11 and  name HN   )(resid    9 and  name HG1# ) 3.0 2.2 1.5
assign (resid   11 and  name HN   )(resid    9 and  name HD1# ) 4.0 3.0 2.0
assign (resid   11 and  name HN   )(resid  134 and  name HA   ) 4.0 2.2 1.0
assign (resid   11 and  name HN   )(resid  132 and  name HA   ) 4.0 2.2 1.0
assign (resid   11 and  name HN   )(resid  132 and  name HB#  ) 4.0 3.0 2.0
!S12
assign (resid   12 and  name HA   )(resid   12 and  name HB1  ) 2.8 1.0 0.2
assign (resid   12 and  name HA   )(resid   12 and  name HB2  ) 3.0 1.2 0.3
assign (resid   12 and  name HA   )(resid   13 and  name HG2  ) 4.0 2.0 1.0
assign (resid   12 and  name HA   )(resid   13 and  name HB#  ) 4.0 3.2 2.0
assign (resid   12 and  name HA   )(resid   11 and  name HB#  ) 4.0 3.2 2.0
assign (resid   12 and  name HA   )(resid  132 and  name HG#  ) 4.0 3.2 2.0
assign (resid   12 and  name HA   )(resid  131 and  name HG2# ) 3.0 2.2 1.8
assign (resid   12 and  name HA   )(resid    9 and  name HD1# ) 4.0 3.2 2.0
assign (resid   12 and  name HN   )(resid   12 and  name HB1  ) 3.0 1.2 0.5
assign (resid   12 and  name HN   )(resid   12 and  name HB2  ) 4.0 2.0 1.0
assign (resid   12 and  name HN   )(resid   11 and  name HA   ) 2.5 0.7 0.2
assign (resid   12 and  name HN   )(resid   11 and  name HB#  ) 2.5 1.7 1.4
assign (resid   12 and  name HN   )(resid   11 and  name HG#  ) 3.0 2.2 1.3
assign (resid   12 and  name HN   )(resid   13 and  name HG#  ) 4.0 3.0 2.0
assign (resid   12 and  name HN   )(resid   10 and  name HD1# ) 4.0 3.0 2.3
assign (resid   12 and  name HN   )(resid    9 and  name HD1# ) 4.5 3.0 1.7
assign (resid   12 and  name HB2  )(resid    9 and  name HD1# ) 4.0 3.0 2.0
assign (resid   12 and  name HB1  )(resid    9 and  name HD1# ) 3.0 2.0 1.3
!E13
assign (resid   13 and  name HA   )(resid   13 and  name HB1  ) 2.5 0.7 0.2
assign (resid   13 and  name HA   )(resid   13 and  name HB2  ) 2.5 0.7 0.2
assign (resid   13 and  name HA   )(resid   13 and  name HG#  ) 3.0 2.0 1.3
assign (resid   13 and  name HN   )(resid   13 and  name HB#  ) 2.5 1.3 1.0
assign (resid   13 and  name HN   )(resid   13 and  name HG#  ) 3.0 2.0 1.3
assign (resid   13 and  name HN   )(resid  131 and  name HG2# ) 4.0 3.2 2.0
assign (resid   13 and  name HN   )(resid  132 and  name HA   ) 3.0 1.2 0.8
assign (resid   13 and  name HN   )(resid   12 and  name HA   ) 2.3 0.7 0.2
assign (resid   13 and  name HN   )(resid   12 and  name HB1  ) 4.0 2.2 1.0
!N14
assign (resid   14 and  name HA   )(resid   14 and  name HB1  ) 3.0 1.2 0.3
assign (resid   14 and  name HA   )(resid   14 and  name HB2  ) 2.5 0.7 0.4
assign (resid   14 and  name HA   )(resid   17 and  name HB1  ) 3.0 1.2 0.8
assign (resid   14 and  name HA   )(resid   17 and  name HB2  ) 4.0 2.0 1.0
assign (resid   14 and  name HA   )(resid   13 and  name HG#  ) 4.0 3.0 2.0
assign (resid   14 and  name HN   )(resid   14 and  name HA   ) 2.5 0.7 0.4
assign (resid   14 and  name HN   )(resid   14 and  name HB1  ) 3.5 1.2 0.5
assign (resid   14 and  name HN   )(resid   14 and  name HB2  ) 4.0 2.2 1.0
assign (resid   14 and  name HN   )(resid   13 and  name HA   ) 2.5 0.7 0.4
assign (resid   14 and  name HN   )(resid   13 and  name HB#  ) 3.0 2.2 1.5
assign (resid   14 and  name HN   )(resid   13 and  name HG#  ) 3.0 2.2 1.5
assign (resid   14 and  name HN   )(resid  130 and  name HA   ) 4.5 2.0 0.7
assign (resid   14 and  name HA   )(resid   14 and  name HD21 ) 4.5 2.0 0.7
assign (resid   14 and  name HA   )(resid   14 and  name HD22 ) 4.5 2.0 0.7
assign (resid   14 and  name HB1  )(resid   14 and  name HD21 ) 3.0 1.2 0.5
assign (resid   14 and  name HB1  )(resid   14 and  name HD22 ) 3.0 1.2 1.0
assign (resid   13 and  name HG1  )(resid   14 and  name HD21 ) 3.0 1.2 0.5
assign (resid   13 and  name HG1  )(resid   14 and  name HD22 ) 3.0 1.2 0.5
assign (resid   13 and  name HG2  )(resid   14 and  name HD21 ) 3.0 1.2 0.5
assign (resid   13 and  name HG2  )(resid   14 and  name HD22 ) 3.0 1.2 0.5
assign (resid   14 and  name HB2  )(resid   14 and  name HD21 ) 3.0 1.2 0.5
assign (resid   14 and  name HB2  )(resid   14 and  name HD22 ) 3.5 1.2 0.5
assign (resid  129 and  name HN   )(resid   14 and  name HD21 ) 4.0 2.0 1.0
assign (resid  129 and  name HN   )(resid   14 and  name HD22 ) 4.0 2.0 1.0
assign (resid  129 and  name HB   )(resid   14 and  name HD21 ) 4.0 2.0 1.0
assign (resid  129 and  name HG1# )(resid   14 and  name HD21 ) 3.0 2.2 1.8
assign (resid  129 and  name HG1# )(resid   14 and  name HD22 ) 3.0 2.2 1.5
!F15
assign (resid   15 and  name HA   )(resid   15 and  name HB2  ) 3.0 1.2 0.3
assign (resid   15 and  name HA   )(resid   15 and  name HB1  ) 3.0 1.2 0.3
assign (resid   15 and  name HA   )(resid  130 and  name HB2  ) 4.0 2.2 1.0
assign (resid   15 and  name HA   )(resid  130 and  name HB1  ) 4.0 2.2 1.5
assign (resid   15 and  name HN   )(resid   15 and  name HB2  ) 2.5 0.7 0.4
assign (resid   15 and  name HN   )(resid   15 and  name HB1  ) 2.5 0.7 0.4
assign (resid   15 and  name HN   )(resid   15 and  name HD1  ) 4.0 2.2 1.0
assign (resid   15 and  name HN   )(resid   15 and  name HD2  ) 4.0 2.2 1.0
assign (resid   15 and  name HN   )(resid   14 and  name HA   ) 3.0 1.2 0.5
assign (resid   15 and  name HN   )(resid   14 and  name HB2  ) 4.0 2.2 1.0
!E16
assign (resid   16 and  name HA   )(resid   16 and  name HB#  ) 2.5 0.7 0.2
assign (resid   16 and  name HA   )(resid   16 and  name HG#  ) 3.0 1.8 0.9
assign (resid   16 and  name HA   )(resid   19 and  name HB2  ) 3.0 1.2 0.3
assign (resid   16 and  name HA   )(resid   19 and  name HB1  ) 4.0 2.0 1.0
assign (resid   16 and  name HA   )(resid   19 and  name HD1# ) 4.0 3.0 2.0
assign (resid   16 and  name HA   )(resid   19 and  name HG   ) 3.0 1.2 0.5
assign (resid   16 and  name HA   )(resid   20 and  name HG1  ) 4.0 2.0 1.0
assign (resid   16 and  name HA   )(resid   20 and  name HD1  ) 4.0 2.0 1.0
assign (resid   16 and  name HA   )(resid   20 and  name HD2  ) 4.0 2.0 2.0
assign (resid   16 and  name HA   )(resid   33 and  name HG2# ) 3.0 2.2 1.3
assign (resid   16 and  name HA   )(resid   32 and  name HB#  ) 4.0 3.0 2.5
assign (resid   16 and  name HN   )(resid   16 and  name HB#  ) 2.5 1.3 1.0
assign (resid   16 and  name HN   )(resid   17 and  name HA   ) 4.5 2.0 0.7
assign (resid   16 and  name HN   )(resid   14 and  name HA   ) 4.0 2.0 1.0
assign (resid   16 and  name HN   )(resid   33 and  name HG#  ) 3.0 2.2 2.7
assign (resid   16 and  name HN   )(resid   15 and  name HA   ) 4.0 2.0 1.0
assign (resid   16 and  name HN   )(resid   15 and  name HB1  ) 4.0 2.0 1.0
assign (resid   16 and  name HN   )(resid   15 and  name HB2  ) 3.0 1.2 0.5
assign (resid   16 and  name HN   )(resid   15 and  name HD2  ) 4.0 2.0 1.0
!E17
assign (resid   17 and  name HA   )(resid   17 and  name HB#  ) 2.5 0.7 0.2
assign (resid   17 and  name HA   )(resid   20 and  name HB#  ) 3.0 1.8 1.3
assign (resid   17 and  name HA   )(resid   20 and  name HG#  ) 4.0 3.0 2.0
assign (resid   17 and  name HA   )(resid   17 and  name HG#  ) 3.0 1.8 0.9
assign (resid   17 and  name HN   )(resid   17 and  name HA   ) 3.0 1.2 0.5
assign (resid   17 and  name HN   )(resid   17 and  name HB#  ) 2.5 1.3 1.0
assign (resid   17 and  name HN   )(resid   17 and  name HG1  ) 2.5 0.7 0.4
assign (resid   17 and  name HN   )(resid   17 and  name HG2  ) 2.5 0.7 0.4
assign (resid   17 and  name HN   )(resid   16 and  name HB#  ) 3.0 2.2 1.5
assign (resid   17 and  name HN   )(resid   18 and  name HA   ) 4.5 2.0 0.7
assign (resid   17 and  name HN   )(resid   16 and  name HA   ) 3.0 1.2 0.5
assign (resid   17 and  name HN   )(resid   14 and  name HA   ) 3.0 1.2 0.5
!L18
assign (resid   18 and  name HA   )(resid   18 and  name HB#  ) 2.5 0.7 0.2
assign (resid   18 and  name HA   )(resid   21 and  name HB   ) 3.0 1.2 0.5
assign (resid   18 and  name HN   )(resid   18 and  name HG   ) 4.0 2.2 1.0
assign (resid   18 and  name HN   )(resid   18 and  name HA   ) 2.5 0.7 0.4
assign (resid   18 and  name HN   )(resid   18 and  name HB#  ) 2.5 1.3 1.0
assign (resid   18 and  name HB2  )(resid   19 and  name HD2# ) 3.0 2.2 1.8
assign (resid   18 and  name HB1  )(resid   19 and  name HD2# ) 2.5 1.5 1.7
assign (resid   18 and  name HB1  )(resid   19 and  name HD1# ) 4.0 3.2 2.0
assign (resid   18 and  name HN   )(resid   19 and  name HA   ) 4.0 2.2 1.0
assign (resid   18 and  name HN   )(resid   19 and  name HB2  ) 4.0 2.2 1.0
assign (resid   18 and  name HN   )(resid   19 and  name HG   ) 4.0 2.2 1.0
assign (resid   18 and  name HN   )(resid   19 and  name HD2# ) 4.0 3.2 2.0
assign (resid   18 and  name HN   )(resid   17 and  name HA   ) 3.0 1.2 0.5
assign (resid   18 and  name HN   )(resid   17 and  name HB#  ) 4.0 3.2 2.0
assign (resid   18 and  name HN   )(resid   17 and  name HG#  ) 4.0 3.2 2.0
assign (resid   18 and  name HN   )(resid  130 and  name HB2  ) 4.0 2.2 1.0
assign (resid   18 and  name HN   )(resid   21 and  name HB   ) 4.0 2.2 1.7
assign (resid   18 and  name HN   )(resid   20 and  name HG#  ) 4.0 3.2 1.3
assign (resid   18 and  name HN   )(resid   14 and  name HB2  ) 4.0 2.2 1.0
!L19
assign (resid   19 and  name HA   )(resid   19 and  name HB2  ) 3.0 1.2 0.3
assign (resid   19 and  name HA   )(resid   19 and  name HB1  ) 2.5 0.7 0.2
assign (resid   19 and  name HA   )(resid   22 and  name HB1  ) 3.0 1.2 0.5
assign (resid   19 and  name HA   )(resid   22 and  name HB2  ) 2.5 0.7 0.2
assign (resid   19 and  name HA   )(resid   19 and  name HG   ) 4.0 2.2 1.0
assign (resid   19 and  name HA   )(resid   19 and  name HD2# ) 2.5 1.7 1.5
assign (resid   19 and  name HA   )(resid   19 and  name HD1# ) 4.0 2.7 2.0
assign (resid   19 and  name HA   )(resid   22 and  name HD2# ) 2.5 1.7 1.2
assign (resid   19 and  name HA   )(resid   22 and  name HD1# ) 3.0 1.7 1.8
assign (resid   19 and  name HN   )(resid   20 and  name HG#  ) 2.5 1.7 1.4
assign (resid   19 and  name HN   )(resid   20 and  name HB#  ) 4.0 3.0 2.0
assign (resid   19 and  name HN   )(resid   16 and  name HA   ) 3.0 1.2 0.5
assign (resid   19 and  name HN   )(resid   19 and  name HB2  ) 2.5 0.7 0.2
assign (resid   19 and  name HN   )(resid   19 and  name HB1  ) 3.0 1.2 0.7
assign (resid   19 and  name HN   )(resid   19 and  name HD2# ) 3.0 1.7 1.3
assign (resid   19 and  name HN   )(resid   19 and  name HD1# ) 4.0 3.0 2.0
assign (resid   19 and  name HN   )(resid   21 and  name HG1# ) 3.0 2.2 1.8
assign (resid   19 and  name HN   )(resid   22 and  name HD2# ) 4.0 3.0 2.0                                                               4.0 3.0 2.0
assign (resid   19 and  name HN   )(resid   18 and  name HA   ) 3.0 1.2 0.5
assign (resid   19 and  name HN   )(resid   18 and  name HB#  ) 3.0 2.2 1.5
!K20
assign (resid   20 and  name HA   )(resid   20 and  name HB#  ) 2.5 0.7 0.2
assign (resid   20 and  name HA   )(resid   20 and  name HG#  ) 2.8 1.5 1.3
assign (resid   20 and  name HA   )(resid   20 and  name HD#  ) 4.0 3.0 2.0
assign (resid   20 and  name HN   )(resid   17 and  name HA   ) 3.0 1.2 0.5
assign (resid   20 and  name HN   )(resid   20 and  name HA   ) 2.5 0.7 0.4
assign (resid   20 and  name HN   )(resid   20 and  name HB#  ) 2.5 1.3 1.0
assign (resid   20 and  name HN   )(resid   20 and  name HG#  ) 3.0 2.2 1.3
assign (resid   20 and  name HN   )(resid   20 and  name HD1  ) 4.0 2.2 1.0
assign (resid   20 and  name HN   )(resid   20 and  name HD2  ) 4.0 2.2 1.0
assign (resid   20 and  name HN   )(resid   20 and  name HE2  ) 4.5 2.0 0.7
assign (resid   20 and  name HN   )(resid   17 and  name HG#  ) 4.0 3.0 2.0
assign (resid   20 and  name HN   )(resid   18 and  name HA   ) 4.0 2.2 1.0
assign (resid   20 and  name HN   )(resid   19 and  name HA   ) 4.0 2.2 1.0
assign (resid   20 and  name HN   )(resid   19 and  name HB1  ) 4.0 2.2 1.0
assign (resid   20 and  name HN   )(resid   19 and  name HB2  ) 3.0 1.2 0.5
assign (resid   20 and  name HN   )(resid   19 and  name HG   ) 4.0 2.2 1.0
assign (resid   20 and  name HN   )(resid   19 and  name HD1# ) 4.0 3.2 2.0
assign (resid   20 and  name HN   )(resid   19 and  name HD2# ) 4.0 3.2 2.0
assign (resid   20 and  name HN   )(resid   16 and  name HA   ) 4.0 2.2 1.0
assign (resid   20 and  name HN   )(resid   18 and  name HD1# ) 4.0 3.0 2.5
assign (resid   20 and  name HN   )(resid   22 and  name HB2  ) 4.0 2.2 1.0
!V21
assign (resid   21 and  name HA   )(resid   21 and  name HB   ) 2.5 0.7 0.2
assign (resid   21 and  name HA   )(resid   21 and  name HG1# ) 3.0 1.8 0.9
assign (resid   21 and  name HA   )(resid   21 and  name HG2# ) 3.0 1.8 0.9
assign (resid   21 and  name HN   )(resid   21 and  name HA   ) 3.0 1.2 0.3
assign (resid   21 and  name HN   )(resid   21 and  name HB   ) 2.5 0.7 0.4
assign (resid   21 and  name HN   )(resid   21 and  name HG1# ) 2.5 1.7 1.9
assign (resid   21 and  name HN   )(resid   21 and  name HG2# ) 3.0 2.2 1.5
assign (resid   21 and  name HN   )(resid   22 and  name HD1# ) 3.0 2.2 2.0
assign (resid   21 and  name HN   )(resid   20 and  name HA   ) 3.0 1.2 0.5
assign (resid   21 and  name HN   )(resid   20 and  name HB1  ) 3.5 1.2 0.5
assign (resid   21 and  name HN   )(resid   20 and  name HB2  ) 3.0 1.2 0.3
assign (resid   21 and  name HN   )(resid   20 and  name HG#  ) 3.0 2.2 1.5
assign (resid   21 and  name HN   )(resid   19 and  name HA   ) 4.0 2.2 1.0
assign (resid   21 and  name HN   )(resid   18 and  name HA   ) 3.0 1.2 0.5
assign (resid   21 and  name HN   )(resid   17 and  name HA   ) 4.0 2.2 1.0
!L22
assign (resid   22 and  name HA   )(resid   22 and  name HB1  ) 2.5 0.7 0.2
assign (resid   22 and  name HA   )(resid   22 and  name HB2  ) 3.0 1.2 0.3
assign (resid   22 and  name HA   )(resid   22 and  name HD1# ) 2.3 2.0 1.2
assign (resid   22 and  name HA   )(resid   22 and  name HD2# ) 4.5 3.0 1.5
assign (resid   22 and  name HA   )(resid  105 and  name HG#  ) 3.0 1.7 1.3
assign (resid   22 and  name HA   )(resid   22 and  name HG   ) 4.0 2.0 1.0
assign (resid   22 and  name HN   )(resid   22 and  name HB1  ) 3.0 1.2 0.5
assign (resid   22 and  name HN   )(resid   22 and  name HB2  ) 2.5 0.7 0.4
assign (resid   22 and  name HN   )(resid   22 and  name HG   ) 4.0 2.0 1.0
assign (resid   22 and  name HN   )(resid   22 and  name HD1# ) 2.5 1.7 1.4
assign (resid   22 and  name HN   )(resid   22 and  name HD2# ) 4.0 3.0 2.0
assign (resid   22 and  name HN   )(resid   21 and  name HA   ) 3.0 1.2 0.5
assign (resid   22 and  name HN   )(resid   21 and  name HB   ) 3.0 1.2 0.7
assign (resid   22 and  name HN   )(resid   21 and  name HG2# ) 3.0 2.0 1.8
assign (resid   22 and  name HN   )(resid   21 and  name HG1# ) 4.0 3.0 2.0
assign (resid   22 and  name HN   )(resid   18 and  name HG   ) 4.0 2.0 1.0
assign (resid   22 and  name HN   )(resid   19 and  name HA   ) 3.0 1.2 0.5
assign (resid   22 and  name HN   )(resid   20 and  name HB#  ) 4.0 3.0 2.0
!G23
assign (resid   23 and  name HN   )(resid   23 and  name HA1  ) 2.5 0.7 0.4
assign (resid   23 and  name HN   )(resid   23 and  name HA2  ) 2.5 0.7 0.4
assign (resid   23 and  name HN   )(resid   20 and  name HA   ) 4.0 2.0 1.0 
assign (resid   23 and  name HN   )(resid   21 and  name HA   ) 4.0 2.0 1.0
assign (resid   23 and  name HN   )(resid   21 and  name HG1# ) 4.0 3.0 2.0
assign (resid   23 and  name HN   )(resid   21 and  name HG2# ) 4.0 3.0 2.3
assign (resid   23 and  name HN   )(resid   22 and  name HB1  ) 3.0 1.2 0.5
assign (resid   23 and  name HN   )(resid   22 and  name HB2  ) 3.0 1.2 0.5
assign (resid   23 and  name HN   )(resid   22 and  name HD1# ) 3.3 2.2 1.7
assign (resid   23 and  name HN   )(resid   22 and  name HD2# ) 4.0 3.0 2.0
!V24
assign (resid   24 and  name HA   )(resid   24 and  name HB   ) 2.5 0.7 0.4
assign (resid   24 and  name HA   )(resid   24 and  name HG1# ) 2.5 1.3 0.8
assign (resid   24 and  name HA   )(resid   24 and  name HG2# ) 3.0 1.8 0.9
assign (resid   24 and  name HA   )(resid   29 and  name HG#  ) 4.0 3.0 2.0
assign (resid   24 and  name HN   )(resid   24 and  name HB   ) 3.5 1.2 0.5
assign (resid   24 and  name HN   )(resid   24 and  name HG2# ) 2.5 1.7 1.2
assign (resid   24 and  name HN   )(resid   24 and  name HG1# ) 4.5 3.0 1.5
assign (resid   24 and  name HN   )(resid   25 and  name HB1  ) 4.0 2.2 1.0
assign (resid   24 and  name HN   )(resid   23 and  name HA2  ) 3.0 1.2 0.3
assign (resid   24 and  name HN   )(resid   23 and  name HA1  ) 3.0 1.2 0.5
assign (resid   24 and  name HN   )(resid   20 and  name HA   ) 4.0 2.2 1.0
!N25
assign (resid   25 and  name HA   )(resid   25 and  name HB1  ) 3.0 1.2 0.3
assign (resid   25 and  name HA   )(resid   25 and  name HB2  ) 2.5 0.7 0.2
assign (resid   25 and  name HN   )(resid   25 and  name HB1  ) 2.5 0.7 0.4
assign (resid   25 and  name HN   )(resid   25 and  name HB2  ) 3.0 1.2 0.5
assign (resid   25 and  name HN   )(resid   24 and  name HB   ) 3.0 1.2 0.7
assign (resid   25 and  name HN   )(resid   24 and  name HA   ) 3.0 1.2 0.5 
assign (resid   25 and  name HN   )(resid   24 and  name HG2# ) 3.0 2.2 1.8
assign (resid   25 and  name HN   )(resid   28 and  name HG   ) 4.5 2.0 0.7
assign (resid   25 and  name HD22 )(resid   28 and  name HB2  ) 4.0 2.0 1.0
assign (resid   25 and  name HD21 )(resid   28 and  name HB2  ) 3.0 1.2 0.5
assign (resid   25 and  name HD21 )(resid   26 and  name HB   ) 4.0 2.0 1.0
assign (resid   25 and  name HD22 )(resid   26 and  name HG2# ) 4.0 3.0 2.0
assign (resid   25 and  name HD21 )(resid   26 and  name HG2# ) 3.0 2.2 1.8
!V26
assign (resid   26 and  name HA   )(resid   26 and  name HB   ) 2.5 0.7 0.4
assign (resid   26 and  name HA   )(resid   28 and  name HB1  ) 4.5 2.0 1.2
assign (resid   26 and  name HA   )(resid   28 and  name HB2  ) 4.0 2.0 1.0
assign (resid   26 and  name HA   )(resid   29 and  name HG1  ) 4.0 2.0 1.0
assign (resid   26 and  name HA   )(resid   29 and  name HG2  ) 4.0 2.0 1.0
assign (resid   26 and  name HN   )(resid   28 and  name HD2# ) 3.0 2.2 2.0
!M27
assign (resid   27 and  name HA   )(resid   27 and  name HB2  ) 2.5 0.7 0.2
assign (resid   27 and  name HA   )(resid   27 and  name HB1  ) 3.0 1.2 0.3
assign (resid   27 and  name HA   )(resid   27 and  name HG1  ) 3.0 1.2 0.3
assign (resid   27 and  name HA   )(resid   27 and  name HG2  ) 3.0 1.2 0.3
assign (resid   27 and  name HA   )(resid   30 and  name HB#  ) 4.5 3.0 1.5
assign (resid   27 and  name HA   )(resid   26 and  name HG2# ) 4.0 3.0 2.3 
assign (resid   27 and  name HA   )(resid   26 and  name HB   ) 4.0 2.0 1.0
assign (resid   27 and  name HN   )(resid   27 and  name HA   ) 2.5 0.7 0.4
assign (resid   27 and  name HN   )(resid   27 and  name HB2  ) 2.5 0.7 0.4
assign (resid   27 and  name HN   )(resid   27 and  name HB1  ) 3.0 1.2 0.3
assign (resid   27 and  name HN   )(resid   27 and  name HG1  ) 4.0 2.0 1.0
assign (resid   27 and  name HN   )(resid   27 and  name HG2  ) 4.0 2.0 1.0
assign (resid   27 and  name HN   )(resid   26 and  name HA   ) 3.0 1.2 0.5
assign (resid   27 and  name HN   )(resid   26 and  name HB   ) 3.0 1.2 0.5
assign (resid   27 and  name HN   )(resid   26 and  name HG1# ) 3.5 2.0 1.5
assign (resid   27 and  name HN   )(resid   26 and  name HG2# ) 3.0 2.2 1.8
assign (resid   27 and  name HN   )(resid   28 and  name HB2  ) 4.0 2.0 1.0
assign (resid   27 and  name HN   )(resid   25 and  name HA   ) 4.0 2.0 1.0
assign (resid   27 and  name HN   )(resid   25 and  name HB1  ) 4.0 2.0 1.0
assign (resid   27 and  name HN   )(resid   25 and  name HB2  ) 4.0 2.0 1.0
assign (resid   27 and  name HN   )(resid   29 and  name HD#  ) 4.0 3.0 2.0
!L28
assign (resid   28 and  name HA   )(resid   28 and  name HB1  ) 2.5 0.7 0.2
assign (resid   28 and  name HA   )(resid   28 and  name HB2  ) 3.0 1.2 0.3
assign (resid   28 and  name HA   )(resid   27 and  name HB1  ) 4.0 2.0 1.0
assign (resid   28 and  name HA   )(resid   28 and  name HD2# ) 3.0 2.2 1.8
assign (resid   28 and  name HA   )(resid   28 and  name HD1# ) 4.0 3.0 2.3
assign (resid   28 and  name HA   )(resid   31 and  name HB   ) 3.0 1.2 0.3
assign (resid   28 and  name HN   )(resid   28 and  name HG   ) 3.0 1.2 1.0
assign (resid   28 and  name HN   )(resid   28 and  name HB1  ) 4.0 2.0 1.0
assign (resid   28 and  name HN   )(resid   28 and  name HB2  ) 2.5 0.7 0.2
assign (resid   28 and  name HN   )(resid   28 and  name HD1# ) 3.0 2.2 1.8
assign (resid   28 and  name HN   )(resid   28 and  name HD2# ) 3.0 2.2 1.5
assign (resid   28 and  name HN   )(resid   27 and  name HA   ) 4.0 2.0 1.0
assign (resid   28 and  name HN   )(resid   27 and  name HB#  ) 2.5 1.7 1.4
assign (resid   28 and  name HN   )(resid   27 and  name HG1  ) 4.0 2.0 1.0
assign (resid   28 and  name HN   )(resid   27 and  name HG2  ) 4.0 2.0 1.0
!R29
assign (resid   29 and  name HN   )(resid   33 and  name HG2# ) 4.0 2.2 2.3
!K30
assign (resid   30 and  name HA   )(resid   30 and  name HB1  ) 3.0 1.2 0.3
assign (resid   30 and  name HA   )(resid   30 and  name HB2  ) 2.5 0.7 0.2
assign (resid   30 and  name HA   )(resid   30 and  name HG#  ) 4.0 2.6 1.6
assign (resid   30 and  name HA   )(resid   30 and  name HD#  ) 3.0 1.7 1.3
assign (resid   30 and  name HA   )(resid   33 and  name HB   ) 3.0 1.2 0.3
assign (resid   30 and  name HA   )(resid   33 and  name HG2# ) 3.0 2.2 1.8
assign (resid   30 and  name HA   )(resid   31 and  name HG1# ) 4.5 3.0 1.5
assign (resid   30 and  name HN   )(resid   30 and  name HA   ) 3.0 1.2 0.5
assign (resid   30 and  name HN   )(resid   30 and  name HB1  ) 3.0 1.2 0.5
assign (resid   30 and  name HN   )(resid   30 and  name HB2  ) 3.0 1.2 0.5
assign (resid   30 and  name HN   )(resid   30 and  name HD#  ) 4.0 3.0 2.0
assign (resid   30 and  name HN   )(resid   30 and  name HG#  ) 4.0 3.0 2.0
assign (resid   30 and  name HN   )(resid   27 and  name HA   ) 4.0 2.2 1.0
assign (resid   30 and  name HN   )(resid   33 and  name HG2# ) 3.0 2.2 1.8
!I31
assign (resid   31 and  name HA   )(resid   31 and  name HG2# ) 2.5 1.3 0.8
assign (resid   31 and  name HA   )(resid   34 and  name HB#  ) 2.5 1.7 1.2
assign (resid   31 and  name HA   )(resid   31 and  name HG1# ) 2.5 1.3 0.8
assign (resid   31 and  name HN   )(resid   31 and  name HB   ) 3.0 1.2 0.5
assign (resid   31 and  name HN   )(resid   31 and  name HG1# ) 4.0 3.2 2.0
assign (resid   31 and  name HN   )(resid   31 and  name HG2# ) 4.0 3.2 2.0
!A32
assign (resid   32 and  name HA   )(resid   35 and  name HB#  ) 3.0 2.2 1.3
assign (resid   32 and  name HN   )(resid   32 and  name HB#  ) 2.5 1.3 0.8
assign (resid   32 and  name HN   )(resid   35 and  name HB#  ) 3.0 2.2 2.3
assign (resid   32 and  name HN   )(resid   33 and  name HG2# ) 3.0 2.2 1.5
assign (resid   32 and  name HN   )(resid   33 and  name HB   ) 4.0 2.0 1.0
assign (resid   32 and  name HN   )(resid   31 and  name HB   ) 3.0 1.2 0.5
assign (resid   32 and  name HN   )(resid   31 and  name HG2# ) 3.0 2.2 1.5
assign (resid   32 and  name HN   )(resid   30 and  name HA   ) 3.0 1.2 1.0
assign (resid   32 and  name HN   )(resid   19 and  name HD1# ) 4.5 3.0 1.7
assign (resid   32 and  name HN   )(resid   32 and  name HA   ) 2.5 0.7 0.4
!V33
assign (resid   33 and  name HA   )(resid   33 and  name HG1# ) 2.5 1.3 0.8
assign (resid   33 and  name HA   )(resid   33 and  name HG2# ) 2.5 1.3 0.8
assign (resid   33 and  name HA   )(resid   36 and  name HB#  ) 3.0 2.2 1.3
assign (resid   33 and  name HN   )(resid   33 and  name HA   ) 2.5 0.7 0.4
assign (resid   33 and  name HN   )(resid   33 and  name HB   ) 2.5 0.7 0.4
assign (resid   33 and  name HN   )(resid   32 and  name HB#  ) 2.5 1.7 1.2
assign (resid   33 and  name HN   )(resid   31 and  name HB   ) 4.0 2.0 1.0
assign (resid   33 and  name HN   )(resid   31 and  name HG2# ) 4.0 3.0 2.0
assign (resid   33 and  name HN   )(resid   34 and  name HA   ) 4.0 2.0 1.0
assign (resid   33 and  name HN   )(resid   30 and  name HA   ) 3.0 1.2 0.5
assign (resid   33 and  name HN   )(resid   32 and  name HA   ) 3.0 1.2 0.5
assign (resid   33 and  name HN   )(resid   15 and  name HE2  ) 4.0 2.0 1.0
assign (resid   33 and  name HN   )(resid   19 and  name HD1# ) 4.0 3.0 2.0
assign (resid   33 and  name HN   )(resid   19 and  name HG   ) 4.5 2.0 1.0
assign (resid   33 and  name HN   )(resid   33 and  name HG2# ) 2.5 1.7 1.4
!A34
assign (resid   34 and  name HA   )(resid   33 and  name HG#  ) 4.0 3.0 3.4
assign (resid   34 and  name HN   )(resid   34 and  name HB#  ) 2.5 1.3 0.8
assign (resid   34 and  name HN   )(resid   33 and  name HA   ) 3.0 1.2 0.5
assign (resid   34 and  name HN   )(resid   33 and  name HB   ) 3.0 1.2 0.5
!A35
assign (resid   35 and  name HA   )(resid   58 and  name HG#  ) 4.0 2.0 3.4
assign (resid   35 and  name HA   )(resid   34 and  name HB#  ) 4.0 3.0 2.0
assign (resid   35 and  name HN   )(resid   35 and  name HB#  ) 2.5 1.3 1.0
assign (resid   35 and  name HN   )(resid   34 and  name HA   ) 3.0 1.2 0.5
assign (resid   35 and  name HN   )(resid   34 and  name HB#  ) 4.0 3.0 2.0
assign (resid   35 and  name HN   )(resid   32 and  name HA   ) 4.0 2.0 1.0
assign (resid   35 and  name HN   )(resid   31 and  name HG2# ) 3.5 2.0 1.5
!A36
assign (resid   36 and  name HA   )(resid   36 and  name HB#  ) 2.5 0.7 0.2
assign (resid   36 and  name HA   )(resid   56 and  name HG2# ) 4.0 3.0 2.0
assign (resid   36 and  name HA   )(resid   39 and  name HB#  ) 2.5 1.5 1.2
assign (resid   36 and  name HA   )(resid   39 and  name HG#  ) 4.0 3.0 2.0
assign (resid   36 and  name HA   )(resid   35 and  name HB#  ) 3.5 2.0 1.3
assign (resid   36 and  name HN   )(resid   35 and  name HA   ) 4.5 2.0 0.5
assign (resid   36 and  name HN   )(resid   35 and  name HB#  ) 3.0 1.8 1.5
assign (resid   36 and  name HN   )(resid   32 and  name HA   ) 4.0 2.0 1.0
assign (resid   36 and  name HN   )(resid   37 and  name HB#  ) 4.0 3.0 2.0
assign (resid   36 and  name HN   )(resid   39 and  name HG#  ) 4.0 3.0 2.0
assign (resid   36 and  name HN   )(resid   39 and  name HD#  ) 4.0 3.0 2.0
assign (resid   36 and  name HN   )(resid   33 and  name HG1# ) 4.0 3.0 2.0
assign (resid   36 and  name HN   )(resid   33 and  name HG2# ) 4.0 3.0 2.3
!S37
assign (resid   37 and  name HN   )(resid   37 and  name HA   ) 2.5 0.7 0.4
assign (resid   37 and  name HN   )(resid   37 and  name HB#  ) 3.0 1.8 1.1
assign (resid   37 and  name HN   )(resid   36 and  name HB#  ) 3.0 2.2 1.5
assign (resid   37 and  name HN   )(resid   35 and  name HB#  ) 4.0 3.0 2.0
assign (resid   37 and  name HN   )(resid   38 and  name HG#  ) 4.0 3.0 2.0
assign (resid   37 and  name HN   )(resid   35 and  name HA   ) 4.5 2.0 0.7
assign (resid   37 and  name HN   )(resid   34 and  name HA   ) 4.5 2.0 0.7
assign (resid   37 and  name HN   )(resid   56 and  name HG2# ) 4.0 3.0 2.0
!K38
assign (resid   38 and  name HA   )(resid   38 and  name HB#  ) 2.5 0.7 0.2
assign (resid   38 and  name HA   )(resid   38 and  name HG#  ) 4.0 3.0 2.0
assign (resid   38 and  name HA   )(resid   38 and  name HD#  ) 3.0 2.0 1.3
assign (resid   38 and  name HA   )(resid    9 and  name HG2# ) 2.5 1.2 1.2
assign (resid   38 and  name HA   )(resid    9 and  name HD1# ) 3.0 2.0 1.3
assign (resid   38 and  name HA   )(resid   39 and  name HD#  ) 3.0 2.0 1.3
assign (resid   38 and  name HN   )(resid   37 and  name HB#  ) 4.0 3.0 2.0
assign (resid   38 and  name HN   )(resid   38 and  name HB#  ) 3.0 2.2 1.3
assign (resid   38 and  name HN   )(resid   38 and  name HG#  ) 3.0 2.2 1.5
!P39
assign (resid   39 and  name HA   )(resid   56 and  name HG2# ) 2.5 1.7 1.5
assign (resid   39 and  name HA   )(resid   39 and  name HB#  ) 2.5 1.7 1.2
assign (resid   39 and  name HA   )(resid   39 and  name HG#  ) 3.0 2.2 1.5
assign (resid   39 and  name HD1  )(resid   38 and  name HG#  ) 4.0 3.0 2.0
!A40
assign (resid   40 and  name HA   )(resid   40 and  name HB#  ) 2.5 0.7 0.2
assign (resid   40 and  name HA   )(resid    8 and  name HG#  ) 3.0 2.2 1.3
assign (resid   40 and  name HA   )(resid    8 and  name HB#  ) 4.0 2.7 2.0
assign (resid   40 and  name HN   )(resid   40 and  name HB#  ) 2.5 1.3 1.0
assign (resid   40 and  name HN   )(resid   54 and  name HA   ) 4.5 2.0 0.7
assign (resid   40 and  name HN   )(resid   56 and  name HA   ) 3.0 1.2 0.5
assign (resid   40 and  name HN   )(resid   56 and  name HG2# ) 4.0 2.7 2.0
assign (resid   40 and  name HN   )(resid   41 and  name HG2# ) 4.5 3.0 1.5
assign (resid   40 and  name HN   )(resid   39 and  name HA   ) 2.5 0.7 0.2
assign (resid   40 and  name HN   )(resid   39 and  name HB#  ) 4.0 2.7 2.0
!V41
assign (resid   41 and  name HA   )(resid   41 and  name HG1# ) 2.5 1.3 0.8
assign (resid   41 and  name HA   )(resid   41 and  name HG2# ) 2.5 1.3 0.8
assign (resid   41 and  name HA   )(resid   54 and  name HG2# ) 3.0 2.2 1.8
assign (resid   41 and  name HA   )(resid   54 and  name HB   ) 4.5 2.0 0.7
assign (resid   41 and  name HA   )(resid   53 and  name HB1  ) 4.5 2.0 0.5
assign (resid   41 and  name HN   )(resid   41 and  name HB   ) 3.0 1.2 0.3
assign (resid   41 and  name HN   )(resid   41 and  name HG1# ) 3.0 2.2 1.5
assign (resid   41 and  name HN   )(resid   41 and  name HG2# ) 4.0 3.2 2.0
assign (resid   41 and  name HN   )(resid   40 and  name HA   ) 2.3 0.7 0.2
assign (resid   41 and  name HN   )(resid   40 and  name HB#  ) 2.5 1.7 1.7
assign (resid   41 and  name HN   )(resid    7 and  name HB2  ) 4.0 2.2 1.0
assign (resid   41 and  name HN   )(resid    7 and  name HB1  ) 4.5 2.0 0.7
assign (resid   41 and  name HN   )(resid    7 and  name HD1  ) 4.0 2.2 1.0
assign (resid   41 and  name HN   )(resid    8 and  name HA   ) 4.0 2.2 1.0
assign (resid   41 and  name HN   )(resid  134 and  name HE2  ) 4.0 2.0 1.0
!E42
assign (resid   42 and  name HA   )(resid   42 and  name HB1  ) 3.0 1.2 0.3
assign (resid   42 and  name HA   )(resid   42 and  name HB2  ) 2.5 0.7 0.2
assign (resid   42 and  name HA   )(resid   42 and  name HG#  ) 3.0 1.8 0.9
assign (resid   42 and  name HA   )(resid   41 and  name HG1# ) 4.0 3.0 2.0
assign (resid   42 and  name HA   )(resid   43 and  name HD1# ) 4.0 3.0 2.0
assign (resid   42 and  name HN   )(resid   42 and  name HB1  ) 2.5 0.7 0.4
assign (resid   42 and  name HN   )(resid   42 and  name HB2  ) 3.0 1.2 0.5
assign (resid   42 and  name HN   )(resid   42 and  name HG#  ) 4.0 3.0 2.0
assign (resid   42 and  name HN   )(resid   53 and  name HB1  ) 4.0 2.0 1.0
assign (resid   42 and  name HN   )(resid   41 and  name HA   ) 2.3 0.7 0.2
assign (resid   42 and  name HN   )(resid   41 and  name HG#  ) 2.5 1.7 2.8
assign (resid   42 and  name HN   )(resid   41 and  name HB   ) 4.0 2.2 1.0
assign (resid   42 and  name HN   )(resid   54 and  name HA   ) 3.0 1.2 0.5
assign (resid   42 and  name HN   )(resid   54 and  name HG2# ) 4.5 2.5 1.5
!I43
assign (resid   43 and  name HA   )(resid   43 and  name HG2# ) 2.5 1.3 0.8
assign (resid   43 and  name HA   )(resid   41 and  name HG1# ) 4.0 3.0 2.0
assign (resid   43 and  name HN   )(resid   43 and  name HG2# ) 3.0 2.2 1.5
assign (resid   43 and  name HN   )(resid   43 and  name HB   ) 2.5 0.7 0.4
assign (resid   43 and  name HN   )(resid   43 and  name HD1# ) 4.0 3.0 2.0
assign (resid   43 and  name HN   )(resid   43 and  name HG1# ) 4.0 3.0 2.0
assign (resid   43 and  name HN   )(resid    6 and  name HA   ) 3.0 1.2 0.5
assign (resid   43 and  name HN   )(resid    7 and  name HD1  ) 3.0 1.2 0.5
assign (resid   43 and  name HN   )(resid   42 and  name HA   ) 2.3 0.7 0.2
assign (resid   43 and  name HN   )(resid   42 and  name HB#  ) 3.0 1.2 1.5
assign (resid   43 and  name HN   )(resid   41 and  name HG1# ) 3.0 2.2 1.5
assign (resid   52 and  name HG2# )(resid   43 and  name HG11 ) 2.5 1.7 1.4 
!K44
assign (resid   44 and  name HA   )(resid   44 and  name HB#  ) 3.0 1.2 0.3
assign (resid   44 and  name HA   )(resid   44 and  name HG1  ) 3.0 1.2 0.5
assign (resid   44 and  name HA   )(resid   44 and  name HG2  ) 3.0 1.2 0.3
assign (resid   44 and  name HA   )(resid   44 and  name HD#  ) 4.0 3.0 2.0
assign (resid   44 and  name HN   )(resid   44 and  name HB#  ) 3.0 2.2 1.5
assign (resid   44 and  name HN   )(resid   43 and  name HA   ) 2.3 0.7 0.2
assign (resid   44 and  name HN   )(resid   51 and  name HB1  ) 4.0 2.2 1.0
assign (resid   44 and  name HN   )(resid   51 and  name HB2  ) 4.0 2.2 1.0 
assign (resid   44 and  name HN   )(resid   51 and  name HD1  ) 3.0 1.2 0.5
assign (resid   44 and  name HN   )(resid   43 and  name HG2# ) 2.5 1.7 1.5
assign (resid   44 and  name HN   )(resid   44 and  name HG#  ) 4.0 3.0 2.0
assign (resid   44 and  name HN   )(resid   43 and  name HB   ) 4.0 2.2 1.0
assign (resid   44 and  name HN   )(resid   43 and  name HD1# ) 4.5 2.0 1.7
assign (resid   44 and  name HN   )(resid   52 and  name HG2# ) 4.5 2.0 1.7
!Q45
assign (resid   45 and  name HN   )(resid   45 and  name HA   ) 3.0 1.2 0.5
assign (resid   45 and  name HN   )(resid   44 and  name HA   ) 2.5 0.7 0.4
assign (resid   45 and  name HN   )(resid   44 and  name HB#  ) 3.0 2.2 1.5
assign (resid   45 and  name HN   )(resid    4 and  name HB#  ) 4.5 3.0 1.5
assign (resid   45 and  name HN   )(resid   45 and  name HG#  ) 4.0 3.2 2.0
assign (resid   45 and  name HN   )(resid   45 and  name HB#  ) 3.0 1.7 1.5
assign (resid   45 and  name HN   )(resid   43 and  name HG2# ) 4.0 3.2 2.0
assign (resid   45 and  name HE21 )(resid   45 and  name HB#  ) 4.0 3.0 3.0
assign (resid   45 and  name HE22 )(resid   45 and  name HB#  ) 4.0 3.0 3.0
assign (resid   50 and  name HZ   )(resid   45 and  name HE2# ) 4.0 3.2 2.0
assign (resid   45 and  name HE21 )(resid   50 and  name HE2  ) 4.0 2.0 1.0
assign (resid   45 and  name HE22 )(resid   50 and  name HE2  ) 4.0 2.0 1.0
assign (resid   87 and  name HH2  )(resid   45 and  name HE21 ) 4.0 2.0 1.0
assign (resid   87 and  name HH2  )(resid   45 and  name HE22 ) 4.0 2.0 1.0
assign (resid   87 and  name HZ2  )(resid   45 and  name HE21 ) 4.0 2.0 1.0
assign (resid   87 and  name HZ2  )(resid   45 and  name HE22 ) 4.0 2.0 1.0
assign (resid   45 and  name HE21 )(resid    2 and  name HA   ) 4.5 2.5 0.7
assign (resid   45 and  name HE22 )(resid    2 and  name HA   ) 4.5 2.5 0.7
assign (resid   45 and  name HE21 )(resid    3 and  name HD1  ) 4.0 2.0 1.0
assign (resid   45 and  name HE22 )(resid    3 and  name HD1  ) 4.0 2.0 1.0
assign (resid   45 and  name HE21 )(resid    3 and  name HE1  ) 4.0 2.0 1.0
assign (resid   45 and  name HE22 )(resid    3 and  name HE1  ) 4.0 2.0 1.0
!E46
assign (resid   46 and  name HA   )(resid   46 and  name HB#  ) 2.5 1.3 0.8
assign (resid   46 and  name HA   )(resid   46 and  name HG#  ) 2.5 1.3 0.8
assign (resid   46 and  name HA   )(resid   45 and  name HG#  ) 3.0 1.8 1.3
assign (resid   46 and  name HA   )(resid   49 and  name HB   ) 4.5 2.0 0.7
assign (resid   46 and  name HN   )(resid   46 and  name HB#  ) 2.5 1.7 1.0
assign (resid   46 and  name HN   )(resid   50 and  name HA   ) 3.0 1.2 0.5
assign (resid   46 and  name HN   )(resid   46 and  name HG#  ) 3.0 2.2 1.3
assign (resid   46 and  name HN   )(resid   49 and  name HG2# ) 3.0 2.2 1.3
assign (resid   46 and  name HN   )(resid   49 and  name HB   ) 4.0 2.2 1.0
assign (resid   46 and  name HN   )(resid   47 and  name HA#  ) 4.5 3.0 1.7
assign (resid   46 and  name HN   )(resid   46 and  name HA   ) 3.0 1.2 0.5
assign (resid   46 and  name HN   )(resid   45 and  name HA   ) 2.5 0.7 0.2
!G47
assign (resid   47 and  name HN   )(resid   46 and  name HA   ) 3.0 1.2 0.5
assign (resid   47 and  name HN   )(resid   46 and  name HB1  ) 4.0 2.0 1.0
assign (resid   47 and  name HN   )(resid   46 and  name HB2  ) 4.0 2.0 1.0
!D48
assign (resid   48 and  name HA   )(resid   48 and  name HB1  ) 3.0 1.2 0.3
assign (resid   48 and  name HA   )(resid   48 and  name HB2  ) 3.0 1.2 0.3
assign (resid   48 and  name HA   )(resid   67 and  name HB   ) 4.0 2.0 1.0
assign (resid   48 and  name HA   )(resid   67 and  name HG1# ) 4.5 3.0 1.7
assign (resid   48 and  name HA   )(resid   67 and  name HG2# ) 3.0 2.2 1.3
assign (resid   48 and  name HN   )(resid   48 and  name HA   ) 3.0 1.2 0.3
assign (resid   48 and  name HN   )(resid   48 and  name HB1  ) 2.5 0.7 0.4
assign (resid   48 and  name HN   )(resid   48 and  name HB2  ) 3.0 1.2 0.5
assign (resid   48 and  name HN   )(resid   49 and  name HB   ) 4.5 2.0 0.7
assign (resid   48 and  name HN   )(resid   47 and  name HA1  ) 2.5 0.7 0.4
assign (resid   48 and  name HN   )(resid   47 and  name HA2  ) 3.0 1.2 0.3
!T49
assign (resid   49 and  name HA   )(resid   49 and  name HB   ) 3.0 1.2 0.3
assign (resid   49 and  name HA   )(resid   49 and  name HG2# ) 2.5 1.3 0.8
assign (resid   49 and  name HA   )(resid   66 and  name HB#  ) 3.0 2.2 1.3
assign (resid   49 and  name HA   )(resid   66 and  name HG#  ) 4.0 3.0 2.0
assign (resid   49 and  name HN   )(resid   49 and  name HB   ) 2.5 0.7 0.2
assign (resid   49 and  name HN   )(resid   49 and  name HG2# ) 3.0 2.2 1.3
assign (resid   49 and  name HN   )(resid   48 and  name HA   ) 3.0 1.2 0.5
assign (resid   49 and  name HN   )(resid   48 and  name HB1  ) 4.0 2.0 1.0
assign (resid   49 and  name HN   )(resid   48 and  name HB2  ) 4.0 2.0 1.0
assign (resid   49 and  name HN   )(resid   50 and  name HZ   ) 4.5 2.0 0.7
assign (resid   49 and  name HN   )(resid   50 and  name HD1  ) 4.5 2.0 1.0
assign (resid   49 and  name HN   )(resid   47 and  name HA1  ) 4.0 2.0 1.0
assign (resid   49 and  name HN   )(resid   47 and  name HA2  ) 4.0 2.0 1.0
assign (resid   49 and  name HB   )(resid   46 and  name HB1  ) 4.0 2.0 1.0
assign (resid   49 and  name HB   )(resid   46 and  name HB2  ) 4.0 2.0 1.0
!F50
assign (resid   50 and  name HA   )(resid   50 and  name HB#  ) 4.0 2.0 1.0
assign (resid   50 and  name HA   )(resid   44 and  name HB#  ) 4.0 3.0 2.0
assign (resid   50 and  name HA   )(resid   45 and  name HB#  ) 4.0 3.0 2.0
assign (resid   50 and  name HN   )(resid   49 and  name HA   ) 2.5 0.7 0.2
assign (resid   50 and  name HN   )(resid   50 and  name HB#  ) 3.0 1.8 0.9
assign (resid   50 and  name HN   )(resid   49 and  name HG2# ) 2.5 1.7 1.4
assign (resid   50 and  name HN   )(resid   50 and  name HD1  ) 3.0 1.2 0.5
assign (resid   50 and  name HN   )(resid   66 and  name HA   ) 4.0 2.0 1.0
assign (resid   50 and  name HB1  )(resid   52 and  name HD1# ) 3.0 2.2 1.5
!Y51
assign (resid   51 and  name HN   )(resid   51 and  name HB1  ) 3.0 1.2 0.3
assign (resid   51 and  name HN   )(resid   51 and  name HB2  ) 3.0 1.2 0.3
assign (resid   51 and  name HN   )(resid   51 and  name HD1  ) 4.0 2.2 1.0
assign (resid   51 and  name HN   )(resid   44 and  name HB2  ) 4.0 2.2 1.0
assign (resid   51 and  name HN   )(resid   44 and  name HG#  ) 4.0 3.2 2.0
assign (resid   51 and  name HN   )(resid   43 and  name HG2# ) 3.0 2.2 1.5
assign (resid   51 and  name HN   )(resid   50 and  name HA   ) 2.5 0.7 0.2
assign (resid   51 and  name HN   )(resid   50 and  name HB#  ) 4.0 3.2 2.0
assign (resid   51 and  name HN   )(resid   50 and  name HD2  ) 4.0 2.0 1.0
assign (resid   51 and  name HN   )(resid   64 and  name HA   ) 4.5 2.0 0.5
!I52
assign (resid   52 and  name HA   )(resid   52 and  name HB   ) 3.0 1.2 0.3
assign (resid   52 and  name HA   )(resid   52 and  name HG2# ) 2.5 1.3 0.8
assign (resid   52 and  name HA   )(resid   52 and  name HG1# ) 3.0 2.0 1.3
assign (resid   52 and  name HN   )(resid   52 and  name HB   ) 3.0 1.2 0.3
assign (resid   52 and  name HN   )(resid   52 and  name HG2# ) 4.0 3.0 2.0
assign (resid   52 and  name HN   )(resid   52 and  name HD1# ) 4.0 3.0 2.0
assign (resid   52 and  name HN   )(resid   51 and  name HA   ) 2.5 0.7 0.2
assign (resid   52 and  name HN   )(resid   51 and  name HD1  ) 3.0 1.2 0.3
assign (resid   52 and  name HN   )(resid   51 and  name HE1  ) 4.0 2.0 1.0
assign (resid   52 and  name HN   )(resid   64 and  name HA   ) 3.0 1.2 0.5
!K53
assign (resid   53 and  name HA   )(resid   53 and  name HB1  ) 3.0 1.2 0.3
assign (resid   53 and  name HA   )(resid   53 and  name HB2  ) 2.5 0.7 0.2
assign (resid   53 and  name HA   )(resid   53 and  name HG#  ) 2.5 1.3 0.9
assign (resid   53 and  name HA   )(resid   62 and  name HB#  ) 4.0 3.2 2.0
assign (resid   53 and  name HN   )(resid   53 and  name HB1  ) 3.0 1.2 0.5
assign (resid   53 and  name HN   )(resid   53 and  name HB2  ) 3.0 1.2 0.5
assign (resid   53 and  name HN   )(resid   42 and  name HB1  ) 3.0 1.2 0.5
assign (resid   53 and  name HN   )(resid   42 and  name HB2  ) 4.0 2.0 1.0
assign (resid   53 and  name HN   )(resid   52 and  name HG2# ) 3.0 2.2 1.8
assign (resid   53 and  name HN   )(resid   53 and  name HG#  ) 4.0 3.2 2.0
assign (resid   53 and  name HN   )(resid   42 and  name HG#  ) 4.5 3.0 1.7
assign (resid   53 and  name HN   )(resid   52 and  name HB   ) 4.5 2.0 0.5
assign (resid   53 and  name HN   )(resid   43 and  name HA   ) 4.5 2.0 0.5
assign (resid   53 and  name HN   )(resid   52 and  name HA   ) 2.5 0.7 0.2
!T54
assign (resid   54 and  name HA   )(resid   54 and  name HG2# ) 2.5 1.3 0.8
assign (resid   54 and  name HA   )(resid   41 and  name HG1# ) 3.0 1.7 1.5
assign (resid   54 and  name HA   )(resid   41 and  name HG2# ) 3.0 1.7 1.3
assign (resid   54 and  name HN   )(resid   54 and  name HB   ) 3.0 1.2 0.5
assign (resid   54 and  name HN   )(resid   54 and  name HG2# ) 3.0 2.2 1.5
assign (resid   54 and  name HN   )(resid   53 and  name HA   ) 2.3 0.7 0.2
assign (resid   54 and  name HN   )(resid   53 and  name HB#  ) 4.0 3.2 2.0
assign (resid   54 and  name HN   )(resid   53 and  name HG#  ) 3.0 1.7 1.3
assign (resid   54 and  name HN   )(resid   52 and  name HG2# ) 4.0 3.2 2.0
assign (resid   54 and  name HN   )(resid   62 and  name HA   ) 4.0 2.0 1.0
assign (resid   54 and  name HN   )(resid   62 and  name HB#  ) 4.0 3.0 2.0
!S55
assign (resid   55 and  name HA   )(resid   55 and  name HB1  ) 2.5 0.7 0.2
assign (resid   55 and  name HA   )(resid   55 and  name HB2  ) 3.0 1.2 0.3
assign (resid   55 and  name HA   )(resid   60 and  name HB   ) 4.5 2.0 0.5
assign (resid   55 and  name HA   )(resid   60 and  name HG2# ) 2.5 1.7 1.2
assign (resid   55 and  name HA   )(resid   54 and  name HB   ) 4.5 2.0 0.5
assign (resid   55 and  name HN   )(resid   55 and  name HB1  ) 4.0 2.0 1.0
assign (resid   55 and  name HN   )(resid   55 and  name HB2  ) 3.0 2.0 1.5
assign (resid   55 and  name HN   )(resid   41 and  name HA   ) 4.0 2.0 1.0
assign (resid   55 and  name HN   )(resid   41 and  name HB   ) 4.5 2.0 1.0
assign (resid   55 and  name HN   )(resid   41 and  name HG2# ) 4.0 3.0 2.0
assign (resid   55 and  name HN   )(resid   40 and  name HB#  ) 3.0 2.2 1.5
assign (resid   55 and  name HN   )(resid   54 and  name HA   ) 2.3 0.7 0.2
assign (resid   55 and  name HN   )(resid   54 and  name HB   ) 4.0 2.0 1.0
assign (resid   55 and  name HN   )(resid   54 and  name HG2# ) 3.0 2.2 1.3
!T56
assign (resid   56 and  name HA   )(resid   56 and  name HB   ) 2.5 0.7 0.4
assign (resid   56 and  name HB   )(resid   39 and  name HA   ) 4.0 2.2 1.0
assign (resid   56 and  name HA   )(resid   56 and  name HG2# ) 2.5 1.3 0.8
assign (resid   56 and  name HA   )(resid   39 and  name HB#  ) 4.0 2.7 2.0
assign (resid   56 and  name HB   )(resid   57 and  name HG2# ) 2.5 1.7 1.5
assign (resid   56 and  name HB   )(resid   59 and  name HB#  ) 3.0 2.0 1.5
assign (resid   56 and  name HB   )(resid   35 and  name HB#  ) 3.0 2.0 1.5
assign (resid   56 and  name HN   )(resid   56 and  name HB   ) 3.0 1.2 0.7
assign (resid   56 and  name HN   )(resid   56 and  name HG2# ) 3.0 2.2 1.3
assign (resid   56 and  name HN   )(resid   55 and  name HA   ) 2.5 0.7 0.2
assign (resid   56 and  name HN   )(resid   55 and  name HB#  ) 2.5 1.7 1.4
assign (resid   56 and  name HN   )(resid   60 and  name HA   ) 3.0 1.2 0.5
!T57
!assign (resid   57 and  name HA   )(resid   57 and  name HG2# ) 2.5 1.3 0.8
assign (resid   57 and  name HA   )(resid   57 and  name HG2# ) 3.0 1.8 0.9
assign (resid   57 and  name HA   )(resid   58 and  name HG#  ) 4.0 3.0 3.4
assign (resid   57 and  name HB   )(resid   58 and  name HG#  ) 4.0 3.0 3.4
assign (resid   57 and  name HB   )(resid   57 and  name HA   ) 2.5 0.7 0.2
!V58
assign (resid   58 and  name HA   )(resid   58 and  name HB   ) 2.5 0.7 0.4
assign (resid   58 and  name HA   )(resid   58 and  name HG#  ) 2.5 1.3 0.8
!assign (resid   58 and  name HA   )(resid   59 and  name HB#  ) 3.0 1.7 1.3
assign (resid   58 and  name HA   )(resid   59 and  name HB#  ) 4.0 3.0 2.0
assign (resid   58 and  name HN   )(resid   58 and  name HB   ) 2.5 0.7 0.4
assign (resid   58 and  name HN   )(resid   57 and  name HA   ) 4.0 2.0 1.0
assign (resid   58 and  name HN   )(resid   57 and  name HB   ) 3.0 1.2 0.8
assign (resid   58 and  name HN   )(resid   57 and  name HG2# ) 4.0 3.0 2.0
assign (resid   58 and  name HN   )(resid   56 and  name HG2# ) 4.0 3.0 2.0
assign (resid   58 and  name HN   )(resid   59 and  name HG#  ) 4.0 3.0 2.3
!R59
assign (resid   59 and  name HA   )(resid   59 and  name HB#  ) 2.5 0.7 0.2
assign (resid   59 and  name HA   )(resid   59 and  name HG#  ) 3.0 1.8 0.9
assign (resid   59 and  name HN   )(resid   59 and  name HB#  ) 2.5 1.7 1.0
assign (resid   59 and  name HN   )(resid   59 and  name HG#  ) 3.0 2.2 1.5
assign (resid   59 and  name HN   )(resid   59 and  name HD#  ) 4.5 3.0 1.7
assign (resid   59 and  name HN   )(resid   58 and  name HA   ) 3.0 1.2 0.3
assign (resid   59 and  name HN   )(resid   58 and  name HB   ) 3.0 1.2 0.3
assign (resid   59 and  name HN   )(resid   58 and  name HG#  ) 2.5 2.0 2.6
assign (resid   59 and  name HN   )(resid   55 and  name HA   ) 4.0 2.2 1.0
assign (resid   59 and  name HN   )(resid   57 and  name HA   ) 4.0 2.2 1.0
assign (resid   59 and  name HN   )(resid   56 and  name HG2# ) 3.0 2.5 2.0
!T60
assign (resid   60 and  name HA   )(resid   60 and  name HG2# ) 2.5 1.3 0.8
assign (resid   60 and  name HA   )(resid   54 and  name HG2# ) 4.0 3.0 2.0
assign (resid   60 and  name HA   )(resid   55 and  name HB1  ) 3.0 1.2 0.3
assign (resid   60 and  name HA   )(resid   55 and  name HB2  ) 4.0 2.2 1.0
assign (resid   60 and  name HN   )(resid   60 and  name HB   ) 4.0 2.2 1.0
assign (resid   60 and  name HN   )(resid   60 and  name HG2# ) 4.0 3.2 2.0
assign (resid   60 and  name HN   )(resid   59 and  name HB#  ) 4.0 3.2 2.0
assign (resid   60 and  name HN   )(resid   59 and  name HG#  ) 4.0 3.2 2.0
assign (resid   60 and  name HB   )(resid   59 and  name HG#  ) 3.0 1.7 1.8
!T61
assign (resid   61 and  name HA   )(resid   61 and  name HB   ) 2.5 0.7 0.4
assign (resid   61 and  name HA   )(resid   60 and  name HB   ) 4.5 2.0 0.7
assign (resid   61 and  name HA   )(resid   61 and  name HG2# ) 2.5 1.3 0.8
assign (resid   61 and  name HN   )(resid   61 and  name HB   ) 4.0 2.2 1.0
assign (resid   61 and  name HN   )(resid   61 and  name HG2# ) 2.5 1.7 1.7
assign (resid   61 and  name HN   )(resid   60 and  name HA   ) 2.5 0.7 0.2
assign (resid   61 and  name HN   )(resid   60 and  name HB   ) 4.0 2.2 1.0
assign (resid   61 and  name HN   )(resid   60 and  name HG2# ) 3.0 2.2 1.5
assign (resid   61 and  name HN   )(resid   55 and  name HA   ) 3.0 1.2 0.5
!E62
assign (resid   62 and  name HA   )(resid   62 and  name HB1  ) 2.5 0.7 0.4
assign (resid   62 and  name HA   )(resid   62 and  name HB2  ) 2.5 0.7 0.4
assign (resid   62 and  name HA   )(resid   62 and  name HG#  ) 3.0 2.2 1.3
assign (resid   62 and  name HA   )(resid   53 and  name HG#  ) 4.0 3.2 2.0
assign (resid   62 and  name HN   )(resid   62 and  name HB#  ) 2.5 1.3 1.4
assign (resid   62 and  name HN   )(resid   62 and  name HG#  ) 3.0 2.2 1.5
assign (resid   62 and  name HN   )(resid   61 and  name HA   ) 2.3 0.7 0.2
assign (resid   62 and  name HN   )(resid   61 and  name HG2# ) 2.5 1.7 1.9
!I63
assign (resid   63 and  name HA   )(resid   63 and  name HB   ) 3.0 1.2 0.3
assign (resid   63 and  name HA   )(resid   63 and  name HG1# ) 3.0 2.0 1.3
assign (resid   63 and  name HA   )(resid   63 and  name HG2# ) 2.5 1.3 0.8
assign (resid   63 and  name HN   )(resid   63 and  name HB   ) 4.0 2.2 1.0
assign (resid   63 and  name HN   )(resid   52 and  name HB   ) 4.0 2.2 1.0
assign (resid   63 and  name HN   )(resid   52 and  name HG1# ) 3.0 2.2 1.7
assign (resid   63 and  name HN   )(resid   62 and  name HA   ) 2.3 0.7 0.2
assign (resid   63 and  name HN   )(resid   62 and  name HG#  ) 4.0 3.2 2.0
assign (resid   63 and  name HN   )(resid   62 and  name HB#  ) 3.0 2.2 1.5
assign (resid   63 and  name HN   )(resid   53 and  name HA   ) 3.0 1.2 0.5
assign (resid   63 and  name HN   )(resid   51 and  name HE#  ) 4.0 3.2 3.0
assign (resid   63 and  name HN   )(resid   63 and  name HG2# ) 2.5 1.7 1.4
assign (resid   63 and  name HN   )(resid   63 and  name HG1# ) 4.0 3.2 2.0
assign (resid   63 and  name HG11 )(resid   52 and  name HD1# ) 3.0 2.2 1.5
assign (resid   63 and  name HG12 )(resid   52 and  name HD1# ) 3.0 2.2 1.5
!N64
assign (resid   64 and  name HA   )(resid   64 and  name HB#  ) 2.5 0.7 0.2
assign (resid   64 and  name HA   )(resid   51 and  name HB#  ) 4.5 3.0 1.5
assign (resid   64 and  name HN   )(resid   64 and  name HB#  ) 2.5 1.7 1.2
assign (resid   64 and  name HN   )(resid   64 and  name HD2# ) 4.0 3.0 2.0
assign (resid   64 and  name HN   )(resid   71 and  name HE#  ) 4.5 3.0 2.5
assign (resid   64 and  name HN   )(resid   63 and  name HA   ) 2.3 0.7 0.2
assign (resid   64 and  name HN   )(resid   63 and  name HB   ) 2.5 0.7 0.2
assign (resid   64 and  name HN   )(resid   63 and  name HG2# ) 3.0 2.2 1.5
assign (resid   64 and  name HN   )(resid   63 and  name HG11 ) 4.0 2.2 1.0
assign (resid   64 and  name HN   )(resid   63 and  name HG12 ) 4.0 2.2 1.0
assign (resid   64 and  name HN   )(resid   65 and  name HD2  ) 4.5 3.0 1.0
assign (resid   64 and  name HN   )(resid   65 and  name HE2  ) 4.5 3.0 1.0
!N64(side-NH)
assign (resid   64 and  name HA   )(resid   64 and  name HD21 ) 4.0 2.0 1.0
assign (resid   64 and  name HA   )(resid   64 and  name HD22 ) 4.0 2.0 1.0
assign (resid   64 and  name HN   )(resid   64 and  name HD21 ) 4.0 2.0 1.0
assign (resid   64 and  name HN   )(resid   64 and  name HD22 ) 4.0 2.0 1.0
assign (resid   63 and  name HA   )(resid   64 and  name HD2# ) 4.5 3.0 1.7
assign (resid   65 and  name HD2  )(resid   64 and  name HD21 ) 4.0 2.0 1.5
!F65
assign (resid   65 and  name HA   )(resid   65 and  name HB#  ) 2.5 0.7 0.2
assign (resid   65 and  name HA   )(resid   66 and  name HG#  ) 3.0 2.2 1.3
assign (resid   65 and  name HN   )(resid   65 and  name HD2  ) 3.0 1.2 0.3
assign (resid   65 and  name HN   )(resid   65 and  name HE2  ) 4.0 2.2 1.0
assign (resid   65 and  name HN   )(resid   64 and  name HA   ) 2.3 0.7 0.2
assign (resid   65 and  name HN   )(resid   64 and  name HB#  ) 2.5 1.7 1.2
assign (resid   65 and  name HN   )(resid   51 and  name HA   ) 3.0 1.2 0.5
assign (resid   65 and  name HN   )(resid   49 and  name HG2# ) 3.0 2.2 1.5
assign (resid   65 and  name HN   )(resid   63 and  name HG1# ) 4.0 3.2 2.0
!K66
assign (resid   66 and  name HA   )(resid   49 and  name HB   ) 4.5 2.0 0.5
assign (resid   66 and  name HA   )(resid   66 and  name HB1  ) 2.5 0.7 0.2
assign (resid   66 and  name HA   )(resid   66 and  name HB2  ) 2.5 0.7 0.2
assign (resid   66 and  name HA   )(resid   49 and  name HG2# ) 3.0 2.2 1.8
assign (resid   66 and  name HN   )(resid   65 and  name HA   ) 2.3 0.7 0.2
assign (resid   66 and  name HN   )(resid   66 and  name HB1  ) 3.0 1.2 0.5
assign (resid   66 and  name HN   )(resid   66 and  name HB2  ) 3.0 1.2 0.8
assign (resid   66 and  name HN   )(resid   66 and  name HG#  ) 3.0 2.2 1.5
assign (resid   66 and  name HN   )(resid   69 and  name HB#  ) 4.0 3.2 2.0
assign (resid   66 and  name HN   )(resid   65 and  name HB#  ) 3.0 2.2 1.5
assign (resid   66 and  name HN   )(resid   65 and  name HD1  ) 4.0 2.0 1.0
assign (resid   66 and  name HN   )(resid   65 and  name HE1  ) 4.0 2.0 1.0
!V67
assign (resid   67 and  name HA   )(resid   67 and  name HG1# ) 2.5 1.7 1.2
assign (resid   67 and  name HA   )(resid   67 and  name HG2# ) 2.5 1.7 1.2
assign (resid   67 and  name HA   )(resid   85 and  name HB   ) 2.5 0.7 0.2
assign (resid   67 and  name HA   )(resid   85 and  name HG1# ) 4.0 3.0 2.0
assign (resid   67 and  name HA   )(resid   85 and  name HG2# ) 4.5 2.5 1.7
assign (resid   67 and  name HN   )(resid   67 and  name HB   ) 2.5 0.7 0.5
assign (resid   67 and  name HN   )(resid   67 and  name HG1# ) 3.0 1.7 1.5
assign (resid   67 and  name HN   )(resid   67 and  name HG2# ) 2.5 1.7 1.4
assign (resid   67 and  name HN   )(resid   48 and  name HA   ) 4.0 2.2 1.0
assign (resid   67 and  name HN   )(resid   49 and  name HA   ) 3.0 1.2 0.5
assign (resid   67 and  name HN   )(resid   66 and  name HA   ) 2.5 0.7 0.4
assign (resid   67 and  name HN   )(resid   66 and  name HB1  ) 3.0 1.2 0.8
assign (resid   67 and  name HN   )(resid   66 and  name HB2  ) 3.0 1.2 0.5
assign (resid   67 and  name HN   )(resid   66 and  name HG#  ) 3.0 1.7 1.5
assign (resid   67 and  name HN   )(resid   48 and  name HB1  ) 3.0 1.2 0.8
assign (resid   67 and  name HN   )(resid   48 and  name HB2  ) 3.0 1.2 0.5
assign (resid   67 and  name HN   )(resid   65 and  name HE#  ) 4.0 3.2 3.0
assign (resid   67 and  name HN   )(resid   65 and  name HD1  ) 4.0 2.0 1.0
assign (resid   67 and  name HN   )(resid   50 and  name HD1  ) 4.0 2.0 1.0
assign (resid   67 and  name HN   )(resid   50 and  name HE1  ) 4.0 2.0 1.0
!G68
!assign (resid   68 and  name HN   )(resid   70 and  name HG#  ) 4.0 3.0 2.0
assign (resid   68 and  name HN   )(resid   67 and  name HA   ) 2.5 0.7 0.4
assign (resid   68 and  name HN   )(resid   67 and  name HB   ) 4.0 2.0 1.0
assign (resid   68 and  name HN   )(resid   67 and  name HG1# ) 3.0 2.5 2.0
assign (resid   68 and  name HN   )(resid   67 and  name HG2# ) 4.0 3.0 2.0
assign (resid   68 and  name HN   )(resid   66 and  name HG#  ) 3.0 2.2 1.5
assign (resid   68 and  name HN   )(resid   85 and  name HG1# ) 4.0 3.0 2.0
assign (resid   68 and  name HN   )(resid   85 and  name HG2# ) 4.5 2.0 2.0
assign (resid   68 and  name HN   )(resid   68 and  name HA1  ) 3.0 1.2 0.3
assign (resid   68 and  name HN   )(resid   68 and  name HA2  ) 2.5 0.7 0.2
!E69
assign (resid   69 and  name HA   )(resid   69 and  name HB#  ) 2.5 0.7 0.2
assign (resid   69 and  name HA   )(resid   84 and  name HD1# ) 3.0 2.2 1.8
assign (resid   69 and  name HN   )(resid   69 and  name HB#  ) 2.5 1.7 1.2
assign (resid   69 and  name HN   )(resid   69 and  name HG#  ) 2.5 1.7 1.2
assign (resid   69 and  name HN   )(resid   67 and  name HG2# ) 4.0 3.0 2.7
assign (resid   69 and  name HN   )(resid   67 and  name HG1# ) 4.0 3.2 2.5
assign (resid   69 and  name HN   )(resid   67 and  name HA   ) 4.0 2.2 1.0
assign (resid   69 and  name HN   )(resid   66 and  name HB#  ) 4.0 3.2 2.0
assign (resid   69 and  name HN   )(resid   68 and  name HA1  ) 4.0 2.2 1.0
assign (resid   69 and  name HN   )(resid   68 and  name HA2  ) 4.0 2.2 1.0
!E70
assign (resid   70 and  name HA   )(resid   70 and  name HG#  ) 3.0 1.8 0.9
assign (resid   70 and  name HA   )(resid   70 and  name HB1  ) 2.5 0.7 0.2
assign (resid   70 and  name HA   )(resid   70 and  name HB2  ) 3.0 1.2 0.3
assign (resid   70 and  name HA   )(resid   84 and  name HD1# ) 2.5 1.7 1.2
assign (resid   70 and  name HA   )(resid   84 and  name HB1  ) 4.0 2.0 1.0
assign (resid   70 and  name HA   )(resid   84 and  name HB2  ) 3.0 1.2 0.3
assign (resid   70 and  name HN   )(resid   70 and  name HB2  ) 3.0 1.2 0.5
assign (resid   70 and  name HN   )(resid   70 and  name HB1  ) 3.3 1.2 0.5
assign (resid   70 and  name HN   )(resid   70 and  name HG#  ) 2.5 1.7 1.2
assign (resid   70 and  name HN   )(resid   69 and  name HB#  ) 3.0 2.2 1.5
assign (resid   70 and  name HN   )(resid   69 and  name HG#  ) 4.0 2.2 2.0
assign (resid   70 and  name HN   )(resid   69 and  name HA   ) 2.5 0.7 0.4
assign (resid   70 and  name HN   )(resid   70 and  name HA   ) 3.0 1.2 0.5
assign (resid   70 and  name HN   )(resid   84 and  name HD1# ) 3.0 2.2 1.5
assign (resid   70 and  name HN   )(resid   84 and  name HD2# ) 3.0 2.2 2.2
!F71
assign (resid   71 and  name HA   )(resid   71 and  name HB1  ) 2.5 0.7 0.2
assign (resid   71 and  name HA   )(resid   71 and  name HB2  ) 2.5 0.7 0.2
assign (resid   71 and  name HN   )(resid   71 and  name HB1  ) 4.0 2.2 1.0
assign (resid   71 and  name HN   )(resid   71 and  name HB2  ) 4.0 2.2 1.0
assign (resid   71 and  name HN   )(resid   71 and  name HD2  ) 3.0 1.2 0.3
assign (resid   71 and  name HN   )(resid   71 and  name HE2  ) 4.0 2.2 1.0
assign (resid   71 and  name HN   )(resid   70 and  name HA   ) 2.3 0.7 0.2
assign (resid   71 and  name HN   )(resid   70 and  name HB1  ) 3.3 1.2 0.5
assign (resid   71 and  name HN   )(resid   70 and  name HB2  ) 4.0 2.0 1.0
assign (resid   71 and  name HN   )(resid   70 and  name HG#  ) 4.0 3.2 2.0
assign (resid   71 and  name HN   )(resid   82 and  name HB1  ) 4.0 2.0 1.0
assign (resid   71 and  name HN   )(resid   82 and  name HZ#  ) 4.0 3.0 2.0
assign (resid   71 and  name HN   )(resid   82 and  name HG#  ) 4.0 3.0 2.0
assign (resid   71 and  name HN   )(resid   82 and  name HE#  ) 4.0 3.0 2.0
assign (resid   71 and  name HN   )(resid   84 and  name HA   ) 4.0 2.0 1.0
!E72
assign (resid   72 and  name HA   )(resid   72 and  name HB2  ) 3.0 1.2 0.3
assign (resid   72 and  name HA   )(resid   72 and  name HB1  ) 2.5 0.7 0.2
assign (resid   72 and  name HA   )(resid   72 and  name HG2  ) 2.5 0.7 0.2
assign (resid   72 and  name HA   )(resid   72 and  name HG1  ) 4.0 2.2 1.0
assign (resid   72 and  name HA   )(resid   82 and  name HB2  ) 3.0 1.2 0.3
assign (resid   72 and  name HA   )(resid   82 and  name HB1  ) 4.0 2.2 1.0
assign (resid   72 and  name HA   )(resid   82 and  name HG#  ) 4.0 3.0 2.0
assign (resid   72 and  name HN   )(resid   72 and  name HA   ) 2.5 0.7 0.4
assign (resid   72 and  name HN   )(resid   72 and  name HB1  ) 3.0 1.7 1.0
assign (resid   72 and  name HN   )(resid   72 and  name HB2  ) 2.5 0.7 0.4
assign (resid   72 and  name HN   )(resid   72 and  name HG2  ) 3.0 1.2 0.5
assign (resid   72 and  name HN   )(resid   72 and  name HG1  ) 3.0 1.2 0.5
assign (resid   72 and  name HN   )(resid   71 and  name HA   ) 2.3 0.7 0.2
assign (resid   72 and  name HN   )(resid   71 and  name HB1  ) 3.0 1.2 0.5
assign (resid   72 and  name HN   )(resid   71 and  name HB2  ) 2.5 0.7 0.4
assign (resid   72 and  name HN   )(resid   71 and  name HD1  ) 3.0 1.2 0.3
!E73
assign (resid   73 and  name HA   )(resid   73 and  name HB#  ) 2.5 0.7 0.2
assign (resid   73 and  name HA   )(resid   73 and  name HG#  ) 4.0 2.8 1.6
assign (resid   73 and  name HN   )(resid   73 and  name HB#  ) 4.0 2.8 1.6
assign (resid   73 and  name HN   )(resid   73 and  name HG#  ) 4.0 3.0 2.0
assign (resid   73 and  name HN   )(resid   72 and  name HA   ) 2.3 0.7 0.2
assign (resid   73 and  name HN   )(resid   72 and  name HB1  ) 4.0 2.2 1.0
assign (resid   73 and  name HN   )(resid   72 and  name HB2  ) 3.0 1.2 0.5
assign (resid   73 and  name HN   )(resid   72 and  name HG#  ) 4.0 3.0 2.0
assign (resid   73 and  name HN   )(resid   82 and  name HA   ) 3.0 1.2 0.5
assign (resid   73 and  name HN   )(resid   82 and  name HB2  ) 4.0 2.2 1.0
!Q74
assign (resid   74 and  name HA   )(resid   74 and  name HB#  ) 2.5 0.7 0.2
assign (resid   74 and  name HA   )(resid   74 and  name HG#  ) 3.0 1.8 0.9
assign (resid   74 and  name HA   )(resid   80 and  name HB#  ) 4.0 3.0 2.0
assign (resid   74 and  name HA   )(resid   75 and  name HG2# ) 4.0 3.0 2.0
assign (resid   74 and  name HN   )(resid   73 and  name HA   ) 2.3 0.7 0.2
assign (resid   74 and  name HN   )(resid   74 and  name HB#  ) 2.5 1.3 1.0
assign (resid   74 and  name HN   )(resid   63 and  name HA   ) 3.0 1.2 0.5
assign (resid   74 and  name HN   )(resid   73 and  name HB#  ) 3.0 2.2 1.5
assign (resid   74 and  name HN   )(resid   74 and  name HG#  ) 3.0 2.0 1.5
assign (resid   74 and  name HE21 )(resid   74 and  name HB#  ) 4.0 3.0 2.0
assign (resid   74 and  name HE22 )(resid   74 and  name HB#  ) 4.0 3.0 2.0
assign (resid   74 and  name HE21 )(resid   74 and  name HG#  ) 3.0 2.2 1.5
assign (resid   74 and  name HE22 )(resid   74 and  name HG#  ) 3.0 2.2 1.5
!T75
assign (resid   75 and  name HA   )(resid   75 and  name HB   ) 2.5 0.7 0.2
assign (resid   75 and  name HA   )(resid   75 and  name HG2# ) 3.0 1.8 0.9
assign (resid   75 and  name HA   )(resid  107 and  name HG2# ) 4.0 3.0 2.0
assign (resid   75 and  name HN   )(resid   75 and  name HB   ) 3.0 1.2 0.5
assign (resid   75 and  name HN   )(resid   75 and  name HG2# ) 2.5 1.7 1.4
assign (resid   75 and  name HN   )(resid   74 and  name HA   ) 2.5 0.7 0.2
assign (resid   75 and  name HN   )(resid   74 and  name HB#  ) 2.5 1.7 1.4
assign (resid   75 and  name HN   )(resid   74 and  name HG1  ) 4.0 2.0 1.0
assign (resid   75 and  name HN   )(resid   74 and  name HG2  ) 4.0 2.0 1.0
!V76
assign (resid   76 and  name HA   )(resid   76 and  name HB   ) 2.5 0.7 0.4
assign (resid   76 and  name HA   )(resid   75 and  name HG2# ) 4.0 3.0 2.0
assign (resid   76 and  name HN   )(resid   76 and  name HA   ) 2.5 0.7 0.4
assign (resid   76 and  name HN   )(resid   76 and  name HB   ) 2.5 0.7 0.2
assign (resid   76 and  name HN   )(resid   75 and  name HA   ) 3.0 1.2 0.5
assign (resid   76 and  name HN   )(resid   75 and  name HB   ) 3.0 1.2 0.5
assign (resid   76 and  name HN   )(resid   75 and  name HG2# ) 2.5 1.7 1.4
assign (resid   76 and  name HN   )(resid   22 and  name HD2# ) 4.0 3.0 2.0
assign (resid   76 and  name HN   )(resid   22 and  name HD1# ) 4.5 3.0 1.7
!D77
assign (resid   77 and  name HA   )(resid   77 and  name HB1  ) 2.5 0.7 0.4
assign (resid   77 and  name HA   )(resid   77 and  name HB2  ) 2.5 0.7 0.2
assign (resid   77 and  name HA   )(resid   19 and  name HD2# ) 4.5 3.0 1.7
assign (resid   77 and  name HA   )(resid   22 and  name HD2# ) 2.5 1.7 1.2
assign (resid   77 and  name HN   )(resid   77 and  name HA   ) 2.5 0.7 0.4
assign (resid   77 and  name HN   )(resid   77 and  name HB1  ) 3.0 1.2 0.5
assign (resid   77 and  name HN   )(resid   77 and  name HB2  ) 3.0 1.2 0.5
assign (resid   77 and  name HN   )(resid   75 and  name HG2# ) 3.0 2.2 2.0
assign (resid   77 and  name HN   )(resid   78 and  name HA1  ) 4.0 2.0 1.0
assign (resid   77 and  name HN   )(resid   78 and  name HA2  ) 4.0 2.0 1.0
assign (resid   77 and  name HN   )(resid   76 and  name HB   ) 4.0 2.0 1.0
assign (resid   77 and  name HN   )(resid   79 and  name HB#  ) 4.0 3.0 2.0
assign (resid   77 and  name HN   )(resid   79 and  name HG#  ) 4.0 3.2 2.0
assign (resid   77 and  name HN   )(resid   22 and  name HD1# ) 4.0 3.2 2.0
!G78
assign (resid   78 and  name HN   )(resid   78 and  name HA1  ) 2.5 0.7 0.4
assign (resid   78 and  name HN   )(resid   78 and  name HA2  ) 2.5 0.7 0.2
assign (resid   78 and  name HN   )(resid   79 and  name HB2  ) 3.0 1.2 0.5
assign (resid   78 and  name HN   )(resid   79 and  name HG#  ) 4.5 3.0 1.5
assign (resid   78 and  name HN   )(resid   74 and  name HB#  ) 4.5 3.0 1.7
assign (resid   78 and  name HN   )(resid   74 and  name HE2# ) 4.0 3.0 2.0
assign (resid   78 and  name HN   )(resid   77 and  name HA   ) 3.0 1.2 0.5
assign (resid   78 and  name HN   )(resid   77 and  name HB1  ) 4.0 2.0 1.0
assign (resid   78 and  name HN   )(resid   77 and  name HB2  ) 3.0 1.2 0.5
assign (resid   78 and  name HN   )(resid   75 and  name HG2# ) 4.0 3.0 2.0
!R79
assign (resid   79 and  name HA   )(resid   79 and  name HB2  ) 2.5 0.7 0.4
assign (resid   79 and  name HA   )(resid   79 and  name HB1  ) 3.0 1.2 0.3
assign (resid   79 and  name HA   )(resid   79 and  name HG#  ) 3.0 1.8 0.9
assign (resid   79 and  name HE   )(resid   79 and  name HB1  ) 2.5 0.7 0.4
assign (resid   79 and  name HE   )(resid   79 and  name HB2  ) 3.0 1.2 0.5
assign (resid   79 and  name HE   )(resid   79 and  name HG1  ) 3.0 1.2 0.5
assign (resid   79 and  name HE   )(resid   79 and  name HG2  ) 4.0 2.0 1.0
assign (resid   79 and  name HE   )(resid   79 and  name HD1  ) 3.0 1.2 0.5
assign (resid   79 and  name HE   )(resid   79 and  name HD2  ) 3.0 1.2 0.5
assign (resid   79 and  name HN   )(resid   79 and  name HB2  ) 2.5 0.7 0.4
assign (resid   79 and  name HN   )(resid   79 and  name HB1  ) 3.0 1.2 0.5
assign (resid   79 and  name HN   )(resid   79 and  name HG#  ) 3.0 1.7 1.3
assign (resid   79 and  name HN   )(resid   78 and  name HA1  ) 4.0 2.2 1.0
assign (resid   79 and  name HN   )(resid   78 and  name HA2  ) 4.0 2.2 1.0
assign (resid   79 and  name HN   )(resid   75 and  name HG2# ) 3.0 1.7 1.8
assign (resid   79 and  name HN   )(resid   74 and  name HA   ) 4.0 2.2 1.0
!P80
!assign (resid   80 and  name HA   )(resid  100 and  name HG   ) 3.0 1.2 0.3
assign (resid   80 and  name HA   )(resid  100 and  name HG   ) 4.0 2.0 1.0
assign (resid   80 and  name HA   )(resid   80 and  name HD#  ) 4.0 2.0 1.0
assign (resid   80 and  name HA   )(resid   80 and  name HB1  ) 2.5 0.7 0.2
assign (resid   80 and  name HA   )(resid   80 and  name HB2  ) 2.5 0.7 0.5
assign (resid   80 and  name HA   )(resid   80 and  name HG#  ) 3.0 2.2 1.5
assign (resid   80 and  name HA   )(resid   74 and  name HB#  ) 4.0 3.0 2.0
assign (resid   80 and  name HA   )(resid   74 and  name HG#  ) 4.0 3.0 2.0
!C81
assign (resid   81 and  name HA   )(resid   81 and  name HB#  ) 2.5 0.7 0.2
assign (resid   81 and  name HA   )(resid  100 and  name HG   ) 2.5 0.7 0.2
assign (resid   81 and  name HA   )(resid   82 and  name HB1  ) 4.0 2.2 1.0
assign (resid   81 and  name HA   )(resid   99 and  name HD2# ) 4.0 3.0 2.0
assign (resid   81 and  name HN   )(resid  100 and  name HG   ) 3.0 1.2 0.5
assign (resid   81 and  name HN   )(resid   80 and  name HA   ) 2.5 0.7 0.2
assign (resid   81 and  name HN   )(resid   80 and  name HB1  ) 4.0 2.2 1.0
assign (resid   81 and  name HN   )(resid   80 and  name HB2  ) 4.0 2.2 1.0
assign (resid   81 and  name HN   )(resid   73 and  name HG#  ) 4.5 3.0 0.7
assign (resid   81 and  name HN   )(resid   74 and  name HA   ) 3.0 1.2 0.5
!K82
assign (resid   82 and  name HA   )(resid   82 and  name HB1  ) 3.0 1.2 0.3
assign (resid   82 and  name HA   )(resid   82 and  name HB2  ) 2.5 0.7 0.2
assign (resid   82 and  name HA   )(resid   82 and  name HG#  ) 3.0 2.0 1.3
assign (resid   82 and  name HA   )(resid   72 and  name HB#  ) 4.0 3.0 2.0
assign (resid   82 and  name HA   )(resid   72 and  name HG1  ) 4.0 2.0 1.0
assign (resid   82 and  name HA   )(resid   72 and  name HG2  ) 4.0 2.0 1.0
assign (resid   82 and  name HA   )(resid  100 and  name HG   ) 4.0 2.2 1.0
assign (resid   82 and  name HN   )(resid   82 and  name HB1  ) 2.5 0.7 0.4
assign (resid   82 and  name HN   )(resid   82 and  name HB2  ) 3.0 1.2 0.5
assign (resid   82 and  name HN   )(resid   82 and  name HG#  ) 3.0 2.0 1.3
assign (resid   82 and  name HN   )(resid  100 and  name HG   ) 3.5 1.2 0.5
assign (resid   82 and  name HN   )(resid   81 and  name HA   ) 2.3 0.7 0.2
assign (resid   82 and  name HN   )(resid   81 and  name HB1  ) 3.0 1.2 1.0
assign (resid   82 and  name HN   )(resid   81 and  name HB2  ) 2.5 0.7 0.4
assign (resid   82 and  name HN   )(resid   83 and  name HB#  ) 4.5 3.0 1.7
assign (resid   82 and  name HN   )(resid   83 and  name HA   ) 4.5 2.0 0.7
assign (resid   82 and  name HN   )(resid   99 and  name HA   ) 4.0 2.2 1.0
!S83
assign (resid   83 and  name HA   )(resid   83 and  name HB1  ) 3.0 1.2 0.3
assign (resid   83 and  name HA   )(resid   83 and  name HB2  ) 2.5 0.7 0.2
assign (resid   83 and  name HA   )(resid   97 and  name HG1  ) 2.5 0.7 0.2
assign (resid   83 and  name HA   )(resid   97 and  name HG2  ) 3.0 1.2 0.3
assign (resid   83 and  name HN   )(resid   83 and  name HB2  ) 3.0 1.2 0.3
assign (resid   83 and  name HN   )(resid   83 and  name HB1  ) 2.5 0.7 0.2
assign (resid   83 and  name HN   )(resid   82 and  name HA   ) 2.5 0.7 0.2
assign (resid   83 and  name HN   )(resid   82 and  name HG#  ) 4.0 3.0 2.0
assign (resid   83 and  name HN   )(resid   72 and  name HA   ) 3.0 1.2 0.5
assign (resid   83 and  name HN   )(resid   72 and  name HB1  ) 4.5 2.0 1.0
assign (resid   83 and  name HN   )(resid   72 and  name HG#  ) 4.0 3.0 2.0
!L84
assign (resid   84 and  name HA   )(resid   84 and  name HB2  ) 2.5 0.7 0.2
assign (resid   84 and  name HA   )(resid   84 and  name HB1  ) 4.0 2.2 1.0
assign (resid   84 and  name HA   )(resid   84 and  name HG   ) 3.0 1.2 0.5
assign (resid   84 and  name HN   )(resid   83 and  name HA   ) 2.3 0.7 0.2
assign (resid   84 and  name HN   )(resid   83 and  name HB#  ) 3.0 2.2 1.3
assign (resid   84 and  name HN   )(resid   84 and  name HB1  ) 2.5 0.7 0.4
assign (resid   84 and  name HN   )(resid   84 and  name HB2  ) 3.0 1.2 0.5
assign (resid   84 and  name HN   )(resid   97 and  name HA   ) 3.0 1.2 0.8
assign (resid   84 and  name HN   )(resid   97 and  name HB#  ) 4.5 3.0 1.7
assign (resid   84 and  name HN   )(resid   97 and  name HG#  ) 4.5 3.0 1.7
assign (resid   84 and  name HN   )(resid   95 and  name HB1  ) 4.0 2.0 1.2
assign (resid   84 and  name HN   )(resid   95 and  name HB2  ) 4.0 2.0 1.2
!V85
assign (resid   85 and  name HA   )(resid   85 and  name HB   ) 2.5 0.7 0.4
assign (resid   85 and  name HA   )(resid   85 and  name HG1# ) 3.0 1.8 0.9
assign (resid   85 and  name HA   )(resid   85 and  name HG2# ) 3.0 1.8 0.9
assign (resid   85 and  name HN   )(resid   85 and  name HA   ) 4.0 2.2 1.0
assign (resid   85 and  name HN   )(resid   85 and  name HB   ) 2.5 0.7 0.4
assign (resid   85 and  name HN   )(resid   85 and  name HG1# ) 4.0 3.0 2.0
assign (resid   85 and  name HN   )(resid   85 and  name HG2# ) 3.0 1.7 1.3
assign (resid   85 and  name HN   )(resid   84 and  name HG   ) 4.0 2.2 1.0
assign (resid   85 and  name HN   )(resid   84 and  name HA   ) 2.3 0.7 0.4
assign (resid   85 and  name HN   )(resid   84 and  name HB2  ) 4.0 2.0 1.0
assign (resid   85 and  name HN   )(resid   84 and  name HB1  ) 3.0 1.2 0.8
assign (resid   85 and  name HN   )(resid   84 and  name HD2# ) 3.0 2.0 1.5
assign (resid   85 and  name HN   )(resid   84 and  name HD1# ) 3.0 2.0 1.5
assign (resid   85 and  name HN   )(resid   71 and  name HE2  ) 4.0 2.0 1.0
!K86
assign (resid   86 and  name HA   )(resid   86 and  name HB2  ) 2.5 0.7 0.2
assign (resid   86 and  name HA   )(resid   86 and  name HB1  ) 3.0 1.2 0.3
assign (resid   86 and  name HA   )(resid   86 and  name HG#  ) 4.0 2.8 1.6
assign (resid   86 and  name HA   )(resid   86 and  name HE#  ) 4.0 3.0 2.0
assign (resid   86 and  name HA   )(resid   67 and  name HG1# ) 2.5 1.5 1.2
assign (resid   86 and  name HA   )(resid   85 and  name HG1# ) 4.0 3.0 2.0
assign (resid   86 and  name HN   )(resid   86 and  name HB1  ) 3.0 1.2 0.5
assign (resid   86 and  name HN   )(resid   86 and  name HB2  ) 3.0 1.2 0.5
assign (resid   86 and  name HN   )(resid   86 and  name HG1  ) 2.5 0.7 0.4
assign (resid   86 and  name HN   )(resid   86 and  name HG2  ) 2.5 0.7 0.4
assign (resid   86 and  name HN   )(resid   95 and  name HA   ) 3.0 1.2 0.5
assign (resid   86 and  name HN   )(resid   85 and  name HA   ) 2.3 0.7 0.2
assign (resid   86 and  name HN   )(resid   85 and  name HG1# ) 2.5 1.7 1.4
assign (resid   86 and  name HN   )(resid   85 and  name HG2# ) 4.0 3.0 2.0
assign (resid   86 and  name HN   )(resid   93 and  name HB2  ) 4.0 2.2 1.0
!W87
assign (resid   87 and  name HA   )(resid   87 and  name HB1  ) 2.5 0.7 0.2
assign (resid   87 and  name HA   )(resid   87 and  name HB2  ) 3.0 1.2 0.3
assign (resid   87 and  name HA   )(resid   93 and  name HG#  ) 3.0 2.2 1.3
assign (resid   87 and  name HA   )(resid   93 and  name HB#  ) 2.5 0.7 1.2
assign (resid   87 and  name HA   )(resid   94 and  name HG2# ) 4.0 3.0 2.0
assign (resid   87 and  name HA   )(resid   67 and  name HG1# ) 4.0 3.0 2.0
assign (resid   87 and  name HA   )(resid   93 and  name HE#  ) 3.0 2.2 1.8
assign (resid   87 and  name HN   )(resid   87 and  name HA   ) 3.0 1.2 0.3
assign (resid   87 and  name HN   )(resid   87 and  name HB1  ) 3.0 1.2 0.5
assign (resid   87 and  name HN   )(resid   87 and  name HB2  ) 2.5 0.7 0.2
assign (resid   87 and  name HN   )(resid   87 and  name HD1  ) 2.5 0.7 0.4
assign (resid   87 and  name HN   )(resid   87 and  name HE1  ) 4.0 2.0 1.0
assign (resid   87 and  name HN   )(resid   86 and  name HA   ) 2.3 0.7 0.2
assign (resid   87 and  name HN   )(resid   86 and  name HB1  ) 3.0 1.2 0.5
assign (resid   87 and  name HN   )(resid   86 and  name HB2  ) 2.5 0.7 0.2
assign (resid   87 and  name HN   )(resid   86 and  name HG1  ) 4.0 2.0 1.0
assign (resid   87 and  name HN   )(resid   86 and  name HG2  ) 4.0 2.0 1.0
assign (resid   87 and  name HN   )(resid   67 and  name HG1# ) 2.5 1.7 1.4
assign (resid   87 and  name HN   )(resid   93 and  name HA   ) 4.0 2.0 1.0
assign (resid   87 and  name HN   )(resid   67 and  name HB   ) 4.0 2.0 1.0
!E88
assign (resid   88 and  name HA   )(resid   88 and  name HB2  ) 2.5 0.7 0.2
assign (resid   88 and  name HA   )(resid   88 and  name HB1  ) 3.0 1.2 0.3
assign (resid   88 and  name HA   )(resid   88 and  name HG#  ) 3.0 1.5 0.9
assign (resid   88 and  name HA   )(resid   94 and  name HG2# ) 3.0 2.2 1.8
assign (resid   88 and  name HN   )(resid   88 and  name HB2  ) 2.5 0.7 0.4
assign (resid   88 and  name HN   )(resid   88 and  name HB1  ) 2.5 0.7 0.4
assign (resid   88 and  name HN   )(resid   88 and  name HG2  ) 4.0 2.0 1.0
assign (resid   88 and  name HN   )(resid   88 and  name HG1  ) 4.0 2.0 1.0
assign (resid   88 and  name HN   )(resid   87 and  name HA   ) 2.5 0.7 0.2
assign (resid   88 and  name HN   )(resid   87 and  name HB2  ) 4.0 2.0 1.0
assign (resid   88 and  name HN   )(resid   87 and  name HB1  ) 3.0 1.2 0.5
assign (resid   88 and  name HN   )(resid   87 and  name HE3  ) 2.5 0.7 0.4
assign (resid   88 and  name HN   )(resid   93 and  name HA   ) 3.0 1.2 0.3
assign (resid   88 and  name HN   )(resid   92 and  name HG#  ) 4.0 3.0 2.0
assign (resid   88 and  name HN   )(resid   92 and  name HD#  ) 4.5 3.0 2.2
assign (resid   88 and  name HN   )(resid   94 and  name HG2# ) 4.0 3.0 2.0
!S89
assign (resid   89 and  name HA   )(resid   89 and  name HB2  ) 2.5 0.7 0.2
assign (resid   89 and  name HA   )(resid   89 and  name HB1  ) 2.5 0.7 0.2
assign (resid   89 and  name HN   )(resid   91 and  name HA   ) 4.5 2.0 1.0
assign (resid   89 and  name HN   )(resid   87 and  name HA   ) 4.0 2.0 1.0
assign (resid   89 and  name HN   )(resid   88 and  name HA   ) 3.0 1.2 0.5
assign (resid   89 and  name HN   )(resid   88 and  name HB2  ) 3.0 1.2 0.5
assign (resid   89 and  name HN   )(resid   92 and  name HB#  ) 3.0 2.2 1.5
assign (resid   89 and  name HN   )(resid   88 and  name HB1  ) 2.5 0.7 0.2
assign (resid   89 and  name HN   )(resid   88 and  name HG#  ) 3.0 2.2 1.3
assign (resid   89 and  name HN   )(resid   93 and  name HA   ) 4.0 2.0 1.0
assign (resid   89 and  name HN   )(resid   90 and  name HA   ) 4.0 2.0 1.0
assign (resid   89 and  name HN   )(resid   87 and  name HB2  ) 4.0 2.0 1.0
assign (resid   89 and  name HN   )(resid   87 and  name HB1  ) 3.0 1.2 0.5
assign (resid   89 and  name HN   )(resid   87 and  name HE3  ) 4.0 2.0 1.0
assign (resid   89 and  name HN   )(resid   92 and  name HG#  ) 4.0 3.0 2.0
assign (resid   89 and  name HN   )(resid   92 and  name HD#  ) 4.0 3.0 2.0
!E90
assign (resid   90 and  name HA   )(resid   90 and  name HB#  ) 2.5 0.7 0.2
assign (resid   90 and  name HA   )(resid   90 and  name HG#  ) 2.5 1.3 1.2
assign (resid   90 and  name HN   )(resid   90 and  name HB#  ) 2.5 1.3 1.2
assign (resid   90 and  name HN   )(resid   90 and  name HA   ) 2.5 0.7 0.4
assign (resid   90 and  name HN   )(resid   90 and  name HG#  ) 2.5 1.7 1.4
assign (resid   90 and  name HN   )(resid   89 and  name HA   ) 2.5 0.7 0.4
assign (resid   90 and  name HN   )(resid   89 and  name HB1  ) 3.0 1.2 0.7
assign (resid   90 and  name HN   )(resid   89 and  name HB2  ) 2.5 0.7 0.4
!N91
assign (resid   91 and  name HA   )(resid   91 and  name HB1  ) 2.5 0.7 0.2
assign (resid   91 and  name HA   )(resid   91 and  name HB2  ) 2.5 0.7 0.4
assign (resid   91 and  name HN   )(resid   91 and  name HA   ) 2.5 0.7 0.4
assign (resid   91 and  name HN   )(resid   91 and  name HB2  ) 3.0 1.3 0.3
assign (resid   91 and  name HN   )(resid   91 and  name HB1  ) 3.0 1.2 1.0
assign (resid   91 and  name HN   )(resid   90 and  name HA   ) 3.0 1.2 0.5
assign (resid   91 and  name HN   )(resid   90 and  name HB#  ) 2.5 1.7 1.4
assign (resid   91 and  name HN   )(resid   90 and  name HG#  ) 3.0 2.2 1.3
assign (resid   91 and  name HN   )(resid   89 and  name HB1  ) 4.0 2.2 1.0
assign (resid   91 and  name HN   )(resid   89 and  name HB2  ) 4.0 2.2 1.0
!assign (resid   91 and  name HN   )(resid   87 and  name HA   ) 4.5 2.0 0.7
assign (resid   91 and  name HN   )(resid   87 and  name HZ3  ) 4.5 2.0 0.7
assign (resid  113 and  name HB1  )(resid   91 and  name HD21 ) 4.0 2.2 1.0
assign (resid  113 and  name HB1  )(resid   91 and  name HD22 ) 4.0 2.2 1.0
assign (resid   91 and  name HB1  )(resid   91 and  name HD21 ) 3.0 1.2 0.5
assign (resid   91 and  name HB1  )(resid   91 and  name HD22 ) 3.0 1.2 1.0
assign (resid   91 and  name HB2  )(resid   91 and  name HD21 ) 3.0 1.2 0.5
assign (resid   91 and  name HB2  )(resid   91 and  name HD22 ) 3.0 1.2 0.5
!K92
assign (resid   92 and  name HA   )(resid   92 and  name HD#  ) 4.0 3.0 2.0
assign (resid   92 and  name HA   )(resid   92 and  name HB#  ) 2.5 0.7 0.2
assign (resid   92 and  name HA   )(resid   92 and  name HG#  ) 3.0 1.8 0.9
assign (resid   92 and  name HA   )(resid   88 and  name HB1  ) 4.0 2.2 1.0
assign (resid   92 and  name HA   )(resid   93 and  name HG#  ) 4.0 3.0 2.0
assign (resid   92 and  name HN   )(resid   92 and  name HB#  ) 2.5 1.3 1.0
assign (resid   92 and  name HN   )(resid   92 and  name HG#  ) 3.0 2.2 1.5
assign (resid   92 and  name HN   )(resid   92 and  name HD1  ) 4.5 2.0 0.7
assign (resid   92 and  name HN   )(resid   92 and  name HD2  ) 4.5 2.0 1.0
assign (resid   92 and  name HN   )(resid   91 and  name HA   ) 3.0 1.2 0.3
assign (resid   92 and  name HN   )(resid   91 and  name HB1  ) 4.0 2.2 1.0
assign (resid   92 and  name HN   )(resid   91 and  name HB2  ) 4.0 2.0 1.0
assign (resid   92 and  name HN   )(resid   88 and  name HG#  ) 4.0 3.0 2.2
assign (resid   92 and  name HN   )(resid   87 and  name HZ3  ) 4.0 2.2 1.0
assign (resid   92 and  name HN   )(resid   87 and  name HE3  ) 3.0 1.2 0.5
assign (resid   92 and  name HN   )(resid   90 and  name HA   ) 4.0 2.2 1.0
assign (resid   92 and  name HN   )(resid    3 and  name HZ   ) 4.0 2.2 1.0
!M93
assign (resid   93 and  name HA   )(resid   93 and  name HB#  ) 2.5 0.7 0.2
assign (resid   93 and  name HA   )(resid   93 and  name HG#  ) 4.0 2.8 1.6
assign (resid   93 and  name HA   )(resid   94 and  name HG1# ) 4.0 3.0 2.3
assign (resid   93 and  name HA   )(resid   94 and  name HG2# ) 3.0 2.2 1.3
assign (resid   93 and  name HA   )(resid   85 and  name HG1# ) 4.0 3.0 2.0
assign (resid   93 and  name HN   )(resid   93 and  name HB#  ) 2.5 1.3 1.0
assign (resid   93 and  name HN   )(resid   93 and  name HG#  ) 2.5 1.7 1.4
assign (resid   93 and  name HN   )(resid   92 and  name HA   ) 2.3 0.7 0.2
assign (resid   93 and  name HN   )(resid   92 and  name HB2  ) 4.0 2.0 1.0
assign (resid   93 and  name HN   )(resid   93 and  name HE#  ) 3.0 2.2 2.3
assign (resid   93 and  name HN   )(resid   92 and  name HG#  ) 3.0 2.2 1.5
assign (resid   93 and  name HN   )(resid   92 and  name HD#  ) 4.0 3.2 2.0
assign (resid   93 and  name HN   )(resid  112 and  name HA   ) 3.0 1.2 0.5
assign (resid   93 and  name HN   )(resid  112 and  name HB#  ) 4.5 3.0 1.7
assign (resid   93 and  name HN   )(resid    3 and  name HZ   ) 4.5 2.0 1.0
assign (resid   93 and  name HN   )(resid   94 and  name HG2# ) 4.5 2.0 1.7
!V94
assign (resid   94 and  name HA   )(resid   94 and  name HG1# ) 2.5 1.3 0.8
assign (resid   94 and  name HA   )(resid   94 and  name HG2# ) 2.5 1.3 0.8
assign (resid   94 and  name HA   )(resid   94 and  name HB   ) 2.5 0.7 0.4
assign (resid   94 and  name HA   )(resid  110 and  name HG2# ) 2.5 1.7 1.2
assign (resid   94 and  name HN   )(resid   94 and  name HA   ) 3.0 1.2 0.5
assign (resid   94 and  name HN   )(resid   94 and  name HB   ) 3.0 1.2 0.3
assign (resid   94 and  name HN   )(resid   93 and  name HA   ) 2.3 0.7 0.2
assign (resid   94 and  name HN   )(resid   93 and  name HB#  ) 2.5 1.7 1.4
assign (resid   94 and  name HN   )(resid   95 and  name HA   ) 4.0 2.0 1.0
assign (resid   94 and  name HN   )(resid   85 and  name HA   ) 4.0 2.0 1.0
assign (resid   94 and  name HN   )(resid   85 and  name HG1# ) 3.0 2.2 1.5
assign (resid   94 and  name HN   )(resid   87 and  name HA   ) 3.0 1.2 0.5
assign (resid   94 and  name HN   )(resid   94 and  name HG2# ) 2.5 1.7 1.4
!C95
assign (resid   95 and  name HA   )(resid   95 and  name HB2  ) 2.5 0.7 0.2
assign (resid   95 and  name HA   )(resid   95 and  name HB1  ) 3.0 1.2 0.3
assign (resid   95 and  name HA   )(resid   85 and  name HG1# ) 4.0 3.0 2.0
assign (resid   95 and  name HA   )(resid   85 and  name HG2# ) 4.0 3.0 2.0
assign (resid   95 and  name HN   )(resid   95 and  name HB1  ) 2.5 0.7 0.4
assign (resid   95 and  name HN   )(resid   95 and  name HB2  ) 3.0 1.2 0.3
assign (resid   95 and  name HN   )(resid   94 and  name HA   ) 2.3 0.7 0.2
assign (resid   95 and  name HN   )(resid   94 and  name HB   ) 3.0 1.2 0.3
assign (resid   95 and  name HN   )(resid   94 and  name HG1# ) 3.0 2.2 1.5
assign (resid   95 and  name HN   )(resid   94 and  name HG2# ) 4.0 3.0 2.0
assign (resid   95 and  name HN   )(resid  110 and  name HG2# ) 3.0 2.2 1.5
assign (resid   95 and  name HN   )(resid  110 and  name HA   ) 3.0 1.2 0.5
assign (resid   95 and  name HN   )(resid  108 and  name HB#  ) 4.5 3.0 1.5
!E96
assign (resid   96 and  name HA   )(resid   96 and  name HB#  ) 2.5 0.7 0.2
assign (resid   96 and  name HA   )(resid   96 and  name HG#  ) 4.0 2.8 1.6
assign (resid   96 and  name HA   )(resid   94 and  name HG1# ) 4.0 3.0 2.2
assign (resid   96 and  name HA   )(resid   97 and  name HB#  ) 3.0 2.2 1.3
assign (resid   96 and  name HA   )(resid  108 and  name HB#  ) 3.0 2.2 1.3
assign (resid   96 and  name HN   )(resid   96 and  name HB#  ) 2.5 1.3 0.8
assign (resid   96 and  name HN   )(resid   95 and  name HA   ) 2.3 0.7 0.2
assign (resid   96 and  name HN   )(resid   96 and  name HG1  ) 4.0 2.0 1.0
assign (resid   96 and  name HN   )(resid   96 and  name HG2  ) 4.0 2.0 1.0
assign (resid   96 and  name HN   )(resid   97 and  name HA   ) 4.5 2.0 0.7
assign (resid   96 and  name HN   )(resid   85 and  name HA   ) 3.0 1.2 0.5
assign (resid   96 and  name HN   )(resid   84 and  name HG   ) 4.5 2.0 0.7
assign (resid   96 and  name HN   )(resid   84 and  name HD2# ) 4.0 3.0 2.0
assign (resid   96 and  name HG1  )(resid   84 and  name HD2# ) 3.0 2.2 1.5
assign (resid   96 and  name HG2  )(resid   84 and  name HD2# ) 4.0 3.0 2.0
assign (resid   96 and  name HN   )(resid   85 and  name HG1# ) 4.5 3.0 1.5
!Q97
assign (resid   97 and  name HA   )(resid   97 and  name HG#  ) 3.0 1.8 0.9
assign (resid   97 and  name HA   )(resid   97 and  name HB1  ) 2.5 0.7 0.4
assign (resid   97 and  name HA   )(resid   97 and  name HB2  ) 3.0 1.2 0.3
assign (resid   97 and  name HN   )(resid  108 and  name HA   ) 3.0 1.2 0.5
assign (resid   97 and  name HN   )(resid   96 and  name HA   ) 2.3 0.7 0.2
assign (resid   97 and  name HN   )(resid   96 and  name HB#  ) 2.5 1.7 1.4
assign (resid   97 and  name HN   )(resid   97 and  name HG1  ) 4.0 2.2 1.0
assign (resid   97 and  name HN   )(resid   97 and  name HG2  ) 4.0 2.2 1.0
assign (resid   97 and  name HN   )(resid   97 and  name HB1  ) 3.0 1.2 0.5
assign (resid   97 and  name HN   )(resid   97 and  name HB2  ) 3.0 1.2 0.5
assign (resid   97 and  name HN   )(resid   98 and  name HB1  ) 4.0 2.0 1.0
assign (resid   75 and  name HB   )(resid   97 and  name HE2# ) 4.0 3.0 2.0
assign (resid   97 and  name HE22 )(resid   75 and  name HG2# ) 4.5 2.0 1.7
assign (resid   97 and  name HA   )(resid   97 and  name HE21 ) 4.0 2.0 1.0
assign (resid  109 and  name HE1  )(resid   97 and  name HE21 ) 3.0 1.2 0.5
assign (resid  109 and  name HE1  )(resid   97 and  name HE22 ) 3.0 1.2 0.5
assign (resid   97 and  name HN   )(resid  107 and  name HG1  ) 4.0 2.2 1.0
!K98
assign (resid   98 and  name HA   )(resid   98 and  name HB1  ) 2.5 0.7 0.4
assign (resid   98 and  name HA   )(resid   98 and  name HB2  ) 3.0 1.2 0.3
assign (resid   98 and  name HA   )(resid   98 and  name HG#  ) 3.0 1.8 0.9
assign (resid   98 and  name HN   )(resid   98 and  name HB2  ) 4.0 2.2 1.0
assign (resid   98 and  name HN   )(resid   98 and  name HB1  ) 3.0 1.2 0.3
assign (resid   98 and  name HN   )(resid   98 and  name HG#  ) 3.0 2.2 1.5
assign (resid   98 and  name HN   )(resid   97 and  name HA   ) 2.3 0.7 0.2
assign (resid   98 and  name HN   )(resid   97 and  name HB1  ) 4.0 2.2 1.0
assign (resid   98 and  name HN   )(resid   97 and  name HB2  ) 4.0 2.2 1.0
assign (resid   98 and  name HN   )(resid   97 and  name HG#  ) 4.0 3.2 2.0
assign (resid   98 and  name HN   )(resid   82 and  name HB1  ) 4.0 2.2 1.0
assign (resid   98 and  name HN   )(resid   83 and  name HA   ) 3.0 1.2 0.5
assign (resid   98 and  name HN   )(resid   83 and  name HB#  ) 4.5 3.0 1.7
assign (resid   98 and  name HN   )(resid   81 and  name HA   ) 4.0 2.0 1.0
assign (resid   98 and  name HN   )(resid   81 and  name HB#  ) 4.0 3.0 2.0
!L99
assign (resid   99 and  name HA   )(resid   99 and  name HB1  ) 2.5 0.7 0.3
assign (resid   99 and  name HA   )(resid   99 and  name HB2  ) 3.0 1.2 0.3
assign (resid   99 and  name HA   )(resid   99 and  name HG   ) 2.5 0.7 0.3
assign (resid   99 and  name HA   )(resid  100 and  name HG   ) 4.5 2.5 0.7
assign (resid   99 and  name HA   )(resid   81 and  name HB#  ) 4.0 3.0 2.0
assign (resid   99 and  name HA   )(resid   99 and  name HD2# ) 2.5 1.7 1.4
assign (resid   99 and  name HN   )(resid   99 and  name HB1  ) 3.0 1.2 0.5
assign (resid   99 and  name HN   )(resid   99 and  name HB2  ) 2.5 0.7 0.2
assign (resid   99 and  name HN   )(resid   98 and  name HA   ) 3.0 1.2 0.3
assign (resid   99 and  name HN   )(resid   81 and  name HA   ) 4.5 2.5 0.6
assign (resid   99 and  name HN   )(resid   81 and  name HB#  ) 4.5 3.0 1.5
assign (resid   99 and  name HN   )(resid   99 and  name HG   ) 3.0 1.2 0.3
assign (resid   99 and  name HN   )(resid   99 and  name HD1# ) 2.5 1.7 1.2
!L100
assign (resid  100 and  name HA   )(resid  100 and  name HB#  ) 2.5 0.7 0.2
assign (resid  100 and  name HN   )(resid  100 and  name HA   ) 2.5 0.7 0.4
assign (resid  100 and  name HN   )(resid  100 and  name HB#  ) 2.5 1.3 0.8
assign (resid  100 and  name HN   )(resid  100 and  name HG   ) 2.5 0.7 0.4
assign (resid  100 and  name HN   )(resid   99 and  name HA   ) 2.5 0.7 0.4
assign (resid  100 and  name HN   )(resid   99 and  name HB1  ) 3.0 1.2 0.5
assign (resid  100 and  name HN   )(resid   99 and  name HB2  ) 3.0 1.2 0.5
assign (resid  100 and  name HN   )(resid   99 and  name HD2# ) 3.0 2.2 1.5
assign (resid  100 and  name HN   )(resid   81 and  name HA   ) 2.5 0.7 0.4
assign (resid  100 and  name HN   )(resid   81 and  name HB#  ) 4.0 3.0 2.0
assign (resid  100 and  name HN   )(resid   80 and  name HG#  ) 3.0 2.2 1.5
assign (resid  100 and  name HN   )(resid   80 and  name HB#  ) 4.5 3.0 1.5
!K101
assign (resid  101 and  name HA   )(resid  101 and  name HB#  ) 2.5 0.7 0.3
assign (resid  101 and  name HA   )(resid  101 and  name HG#  ) 3.0 1.8 0.9
assign (resid  101 and  name HN   )(resid   81 and  name HA   ) 4.0 2.0 1.0
assign (resid  101 and  name HN   )(resid  100 and  name HA   ) 3.0 1.2 0.5
assign (resid  101 and  name HN   )(resid  100 and  name HB#  ) 3.0 2.2 1.5
assign (resid  101 and  name HN   )(resid  100 and  name HG   ) 4.0 2.0 1.0
assign (resid  101 and  name HN   )(resid  101 and  name HA   ) 2.5 0.7 0.4
assign (resid  101 and  name HN   )(resid  102 and  name HA#  ) 4.0 3.0 2.0
assign (resid  101 and  name HN   )(resid   80 and  name HB#  ) 4.0 3.0 2.0
assign (resid  101 and  name HN   )(resid   80 and  name HG#  ) 4.0 3.0 2.0
assign (resid  101 and  name HN   )(resid   99 and  name HD1# ) 3.0 2.2 2.0
assign (resid  101 and  name HN   )(resid   99 and  name HD2# ) 3.0 2.2 1.5
!G102
assign (resid  102 and  name HN   )(resid  102 and  name HA1  ) 2.5 0.7 0.4
assign (resid  102 and  name HN   )(resid  102 and  name HA2  ) 2.5 0.7 0.2
assign (resid  102 and  name HN   )(resid  101 and  name HA   ) 2.5 0.7 0.2
assign (resid  102 and  name HN   )(resid  101 and  name HB#  ) 3.0 2.2 1.5
assign (resid  102 and  name HN   )(resid  101 and  name HD#  ) 3.0 2.2 1.5
assign (resid  102 and  name HN   )(resid  101 and  name HG#  ) 3.0 2.2 1.5
!E103
assign (resid  103 and  name HN   )(resid  103 and  name HB#  ) 2.5 1.3 1.0
assign (resid  103 and  name HN   )(resid  103 and  name HG#  ) 3.0 2.2 1.5
assign (resid  103 and  name HN   )(resid  102 and  name HA1  ) 2.5 0.7 0.2
assign (resid  103 and  name HN   )(resid  102 and  name HA2  ) 2.5 0.7 0.4
assign (resid  103 and  name HN   )(resid   99 and  name HD1# ) 3.0 2.2 1.5
!G104
assign (resid  104 and  name HN   )(resid  104 and  name HA1  ) 2.5 0.7 0.4
assign (resid  104 and  name HN   )(resid  104 and  name HA2  ) 2.5 0.7 0.4
assign (resid  104 and  name HN   )(resid  103 and  name HA   ) 3.0 1.2 0.5
assign (resid  104 and  name HN   )(resid  103 and  name HB#  ) 2.5 1.7 1.4
assign (resid  104 and  name HN   )(resid  103 and  name HG1  ) 2.5 0.7 0.4
assign (resid  104 and  name HN   )(resid  103 and  name HG2  ) 2.5 0.7 0.4
assign (resid  104 and  name HN   )(resid  105 and  name HD1  ) 3.0 1.2 0.5
assign (resid  104 and  name HN   )(resid  105 and  name HD2  ) 3.0 1.2 0.5
assign (resid  104 and  name HN   )(resid   99 and  name HD1# ) 3.0 2.2 1.5
!assign (resid  104 and  name HN   )(resid   99 and  name HD2# ) 3.0 2.2 1.5
!P105
assign (resid  105 and  name HA   )(resid  105 and  name HB#  ) 2.5 0.7 0.2
assign (resid  105 and  name HA   )(resid  105 and  name HG#  ) 4.0 2.0 1.0
assign (resid  105 and  name HA   )(resid  105 and  name HD1  ) 4.5 2.5 1.0
assign (resid  105 and  name HA   )(resid  105 and  name HD2  ) 4.5 2.5 1.0
!K106
assign (resid  106 and  name HA   )(resid  106 and  name HB#  ) 2.5 0.7 0.2
assign (resid  106 and  name HA   )(resid  106 and  name HG1  ) 3.0 1.2 0.3
assign (resid  106 and  name HA   )(resid  106 and  name HG2  ) 3.0 1.2 0.5
assign (resid  106 and  name HA   )(resid  106 and  name HD#  ) 3.0 1.2 1.3
assign (resid  106 and  name HA   )(resid  107 and  name HG2# ) 4.0 3.0 2.0
assign (resid  106 and  name HN   )(resid  106 and  name HA   ) 2.5 0.7 0.4
assign (resid  106 and  name HN   )(resid  106 and  name HG#  ) 3.0 1.2 1.3
assign (resid  106 and  name HN   )(resid  106 and  name HD#  ) 4.0 2.0 2.0
assign (resid  106 and  name HN   )(resid  106 and  name HB#  ) 2.5 1.3 0.8
assign (resid  106 and  name HN   )(resid  105 and  name HA   ) 2.5 0.7 0.2
assign (resid  106 and  name HN   )(resid  105 and  name HB#  ) 3.0 2.2 1.3
assign (resid  106 and  name HN   )(resid  105 and  name HG#  ) 3.0 2.2 1.5
assign (resid  106 and  name HN   )(resid  126 and  name HA   ) 3.0 1.2 0.5
assign (resid  106 and  name HN   )(resid  126 and  name HB#  ) 4.0 2.0 2.0
!T107
assign (resid  107 and  name HA   )(resid  107 and  name HB   ) 2.5 0.5 0.2
assign (resid  107 and  name HA   )(resid  124 and  name HB   ) 4.5 2.0 0.5
assign (resid  107 and  name HA   )(resid  106 and  name HB#  ) 4.0 3.0 2.0
assign (resid  107 and  name HA   )(resid  106 and  name HG#  ) 4.5 3.0 1.5
assign (resid  107 and  name HA   )(resid  107 and  name HG2# ) 2.5 1.3 0.8
assign (resid  107 and  name HA   )(resid  124 and  name HG2# ) 4.5 3.0 1.5
assign (resid  107 and  name HA   )(resid  125 and  name HB#  ) 3.0 2.2 1.3
assign (resid  107 and  name HN   )(resid  107 and  name HG2# ) 2.5 1.7 1.7
assign (resid  107 and  name HN   )(resid  107 and  name HB   ) 3.0 1.2 0.5
assign (resid  107 and  name HN   )(resid  106 and  name HA   ) 2.3 0.7 0.4
assign (resid  107 and  name HN   )(resid  106 and  name HB#  ) 3.0 2.2 1.3
assign (resid  107 and  name HN   )(resid  106 and  name HD#  ) 4.0 3.0 2.0
assign (resid  107 and  name HN   )(resid  106 and  name HG1  ) 3.0 1.2 0.5
assign (resid  107 and  name HN   )(resid  106 and  name HG2  ) 3.0 1.2 0.5
assign (resid  107 and  name HN   )(resid  106 and  name HZ#  ) 4.5 3.0 1.7
assign (resid  107 and  name HN   )(resid   97 and  name HB2  ) 4.0 2.2 1.0
assign (resid  107 and  name HN   )(resid   98 and  name HA   ) 3.0 1.2 0.5
assign (resid  107 and  name HN   )(resid  107 and  name HG1  ) 4.0 2.2 1.0
!S108
assign (resid  108 and  name HA   )(resid  108 and  name HB#  ) 2.5 0.7 0.2
assign (resid  108 and  name HA   )(resid  107 and  name HB   ) 4.0 2.2 1.0
assign (resid  108 and  name HA   )(resid   97 and  name HB#  ) 3.0 1.7 1.3
assign (resid  108 and  name HA   )(resid   96 and  name HB#  ) 4.0 3.0 2.0
assign (resid  108 and  name HN   )(resid  125 and  name HA   ) 4.0 2.0 1.0
assign (resid  108 and  name HN   )(resid  125 and  name HB#  ) 4.0 3.0 2.0
assign (resid  108 and  name HN   )(resid  124 and  name HB   ) 4.0 2.0 1.0
assign (resid  108 and  name HN   )(resid  124 and  name HG2# ) 4.0 3.0 2.0
assign (resid  108 and  name HN   )(resid  107 and  name HA   ) 2.3 0.7 0.2
assign (resid  108 and  name HN   )(resid  107 and  name HB   ) 2.5 0.7 0.4
assign (resid  108 and  name HN   )(resid  107 and  name HG2# ) 2.5 1.7 1.4
assign (resid  108 and  name HN   )(resid  106 and  name HZ#  ) 4.0 3.0 2.0
!W109
assign (resid  109 and  name HA   )(resid  109 and  name HB1  ) 3.0 1.2 0.3
assign (resid  109 and  name HA   )(resid  109 and  name HB2  ) 3.0 1.2 0.3
assign (resid  109 and  name HA   )(resid  110 and  name HG2# ) 3.0 2.2 1.3
assign (resid  109 and  name HA   )(resid  123 and  name HE#  ) 4.0 3.2 2.0
assign (resid  109 and  name HA   )(resid  123 and  name HG2  ) 4.0 2.2 1.0
assign (resid  109 and  name HN   )(resid  109 and  name HB1  ) 4.0 2.2 1.0
assign (resid  109 and  name HN   )(resid  109 and  name HB2  ) 4.0 2.2 1.0
assign (resid  109 and  name HN   )(resid  109 and  name HD1  ) 4.0 2.2 1.0
assign (resid  109 and  name HN   )(resid   95 and  name HB1  ) 2.5 0.7 0.4
assign (resid  109 and  name HN   )(resid   95 and  name HB2  ) 3.0 1.2 1.0
assign (resid  109 and  name HN   )(resid  108 and  name HA   ) 2.5 0.7 0.2
assign (resid  109 and  name HN   )(resid  108 and  name HB#  ) 2.5 1.7 1.2
assign (resid  109 and  name HN   )(resid   96 and  name HA   ) 4.0 2.2 1.0
assign (resid  109 and  name HN   )(resid   96 and  name HB#  ) 4.0 3.0 2.3
assign (resid  109 and  name HN   )(resid  110 and  name HG2# ) 4.0 3.0 2.0
assign (resid  109 and  name HN   )(resid   94 and  name HG1# ) 4.0 3.0 2.0
!T110
assign (resid  110 and  name HA   )(resid  110 and  name HB   ) 2.5 0.7 0.2
assign (resid  110 and  name HA   )(resid  110 and  name HG2# ) 2.5 1.3 0.8
assign (resid  110 and  name HA   )(resid   95 and  name HB1  ) 4.0 2.2 1.0
assign (resid  110 and  name HA   )(resid   94 and  name HG1# ) 4.0 3.0 2.0
assign (resid  110 and  name HA   )(resid   94 and  name HG2# ) 4.0 3.0 2.3
assign (resid  110 and  name HN   )(resid  110 and  name HG2# ) 2.5 1.7 1.4
assign (resid  110 and  name HN   )(resid  122 and  name HG2# ) 4.0 3.0 2.0
assign (resid  110 and  name HN   )(resid  109 and  name HA   ) 2.3 0.7 0.2
assign (resid  110 and  name HN   )(resid  109 and  name HB1  ) 3.0 1.2 0.5
assign (resid  110 and  name HN   )(resid  109 and  name HB2  ) 2.5 0.7 0.4
assign (resid  110 and  name HN   )(resid  109 and  name HE3  ) 3.0 1.2 0.5
assign (resid  110 and  name HN   )(resid  121 and  name HA   ) 4.0 2.0 1.0
assign (resid  110 and  name HN   )(resid  123 and  name HA   ) 4.0 2.0 1.0
assign (resid  110 and  name HN   )(resid  123 and  name HG#  ) 4.0 3.0 2.0
assign (resid  110 and  name HN   )(resid  111 and  name HB#  ) 4.0 3.0 2.0
assign (resid  110 and  name HN   )(resid  111 and  name HG#  ) 4.0 3.0 2.0
assign (resid  110 and  name HB   )(resid   94 and  name HG1# ) 3.0 1.7 1.3
assign (resid  110 and  name HN   )(resid  121 and  name HD1# ) 4.0 3.0 2.0
assign (resid  110 and  name HN   )(resid  121 and  name HD2# ) 4.0 3.0 2.0
!M111
assign (resid  111 and  name HA   )(resid  111 and  name HB#  ) 2.5 0.7 0.2
assign (resid  111 and  name HA   )(resid  111 and  name HG1  ) 4.5 2.0 0.5
assign (resid  111 and  name HA   )(resid  111 and  name HG2  ) 4.5 2.0 0.5
assign (resid  111 and  name HA   )(resid  119 and  name HG   ) 4.5 2.0 0.7
assign (resid  111 and  name HN   )(resid  111 and  name HA   ) 3.0 1.2 0.5
assign (resid  111 and  name HN   )(resid  111 and  name HB#  ) 2.5 1.3 1.2
assign (resid  111 and  name HN   )(resid   92 and  name HA   ) 4.0 2.2 1.0
assign (resid  111 and  name HN   )(resid   94 and  name HA   ) 3.0 1.2 0.5
assign (resid  111 and  name HN   )(resid   94 and  name HG1# ) 4.0 3.0 2.0
assign (resid  111 and  name HN   )(resid   94 and  name HG2# ) 4.0 3.0 2.0
assign (resid  111 and  name HN   )(resid   93 and  name HG#  ) 4.0 3.0 2.0
assign (resid  111 and  name HN   )(resid   92 and  name HG#  ) 4.0 3.0 2.0
assign (resid  111 and  name HN   )(resid  110 and  name HA   ) 2.3 0.7 0.2
assign (resid  111 and  name HN   )(resid  110 and  name HB   ) 3.0 1.2 0.5
assign (resid  111 and  name HN   )(resid  110 and  name HG2# ) 3.0 2.2 1.8
assign (resid  111 and  name HN   )(resid  109 and  name HZ3  ) 4.0 2.2 1.0
assign (resid  111 and  name HN   )(resid  109 and  name HE3  ) 4.0 2.2 1.0
assign (resid  111 and  name HB2  )(resid   52 and  name HD1# ) 4.0 3.0 2.0
!E112
assign (resid  112 and  name HA   )(resid  112 and  name HB#  ) 2.5 0.7 0.2
assign (resid  112 and  name HA   )(resid  112 and  name HG#  ) 4.0 2.8 1.6
assign (resid  112 and  name HA   )(resid   92 and  name HG#  ) 4.0 3.2 2.0
assign (resid  112 and  name HN   )(resid   92 and  name HG#  ) 4.0 3.2 2.0
assign (resid  112 and  name HN   )(resid  120 and  name HG2# ) 3.0 2.2 1.5
assign (resid  112 and  name HN   )(resid  119 and  name HA   ) 4.0 2.2 1.0
assign (resid  112 and  name HN   )(resid  119 and  name HG   ) 4.0 2.2 1.0
assign (resid  112 and  name HN   )(resid  121 and  name HA   ) 3.0 1.2 0.5
assign (resid  112 and  name HN   )(resid  112 and  name HB#  ) 2.5 1.3 1.0
assign (resid  112 and  name HN   )(resid  112 and  name HG#  ) 3.0 2.2 1.5
assign (resid  112 and  name HN   )(resid  111 and  name HA   ) 2.3 0.7 0.2
assign (resid  112 and  name HN   )(resid  111 and  name HB#  ) 3.0 2.2 1.5
assign (resid  112 and  name HN   )(resid    3 and  name HE#  ) 4.5 3.0 2.5
!L113
assign (resid  113 and  name HA   )(resid  113 and  name HB1  ) 3.0 1.2 0.3
assign (resid  113 and  name HA   )(resid  113 and  name HB2  ) 2.5 0.7 0.2
assign (resid  113 and  name HA   )(resid  113 and  name HG   ) 4.0 2.2 1.0
assign (resid  113 and  name HA   )(resid  113 and  name HD1# ) 2.5 1.5 1.7
assign (resid  113 and  name HA   )(resid  113 and  name HD2# ) 2.5 1.5 1.2
assign (resid  113 and  name HA   )(resid  119 and  name HG   ) 3.0 1.2 0.5
assign (resid  113 and  name HA   )(resid  119 and  name HD2# ) 4.5 3.0 1.5
assign (resid  113 and  name HN   )(resid  113 and  name HB1  ) 2.5 0.7 0.4
assign (resid  113 and  name HN   )(resid  113 and  name HB2  ) 2.5 0.7 0.4
assign (resid  113 and  name HN   )(resid  113 and  name HG   ) 4.0 2.2 1.0
assign (resid  113 and  name HN   )(resid  113 and  name HD2# ) 3.0 2.2 1.7
assign (resid  113 and  name HN   )(resid   91 and  name HD21 ) 4.5 2.0 0.5
assign (resid  113 and  name HN   )(resid  119 and  name HA   ) 4.5 2.0 0.7
assign (resid  113 and  name HN   )(resid  112 and  name HA   ) 2.3 0.7 0.2
assign (resid  113 and  name HN   )(resid  112 and  name HB#  ) 2.5 1.7 1.4
assign (resid  113 and  name HN   )(resid  112 and  name HG#  ) 3.0 2.2 1.5
assign (resid  113 and  name HN   )(resid   92 and  name HA   ) 3.0 1.2 0.5
assign (resid  113 and  name HN   )(resid   92 and  name HB#  ) 3.0 2.2 1.3
assign (resid  113 and  name HN   )(resid   92 and  name HG#  ) 4.5 3.0 1.5
assign (resid  113 and  name HN   )(resid   91 and  name HB1  ) 3.0 1.2 0.5
assign (resid  113 and  name HN   )(resid   91 and  name HB2  ) 3.0 1.2 0.5
assign (resid  113 and  name HN   )(resid    3 and  name HZ   ) 3.0 1.2 0.5
!T114
assign (resid  114 and  name HN   )(resid  114 and  name HG2# ) 2.5 1.7 1.4
assign (resid  114 and  name HN   )(resid  113 and  name HA   ) 2.5 0.7 0.2
assign (resid  114 and  name HN   )(resid  113 and  name HB2  ) 4.0 2.2 1.0
assign (resid  114 and  name HN   )(resid  113 and  name HB1  ) 3.0 1.2 0.5
assign (resid  114 and  name HN   )(resid  113 and  name HD2# ) 2.5 1.7 1.4
assign (resid  114 and  name HN   )(resid  113 and  name HG   ) 4.0 2.2 1.0
assign (resid  114 and  name HN   )(resid  118 and  name HB1  ) 4.0 2.2 1.0
assign (resid  114 and  name HN   )(resid  118 and  name HB2  ) 4.0 2.2 1.0
assign (resid  114 and  name HN   )(resid  119 and  name HA   ) 3.0 1.2 0.5
!N115
assign (resid  115 and  name HA   )(resid  115 and  name HB#  ) 2.5 0.7 0.2
assign (resid  115 and  name HA   )(resid  113 and  name HD1# ) 4.0 3.0 2.0
assign (resid  115 and  name HN   )(resid  115 and  name HB#  ) 3.0 1.8 1.3
assign (resid  115 and  name HN   )(resid  115 and  name HA   ) 3.0 1.2 0.5      
!D116
assign (resid  116 and  name HA   )(resid  116 and  name HB#  ) 2.5 0.7 0.2
assign (resid  116 and  name HA   )(resid  115 and  name HB#  ) 4.0 3.0 2.0
assign (resid  116 and  name HN   )(resid  116 and  name HB#  ) 2.5 1.3 0.8
assign (resid  116 and  name HN   )(resid  115 and  name HB#  ) 3.0 2.2 1.5
assign (resid  116 and  name HN   )(resid  115 and  name HA   ) 3.0 1.2 0.5
assign (resid  116 and  name HN   )(resid  117 and  name HA1  ) 4.0 2.0 1.0
assign (resid  116 and  name HN   )(resid  117 and  name HA2  ) 4.0 2.0 1.0
assign (resid  116 and  name HN   )(resid  118 and  name HB2  ) 4.5 2.0 0.7
assign (resid  116 and  name HN   )(resid  114 and  name HG2# ) 4.0 3.0 2.0
!G117
assign (resid  117 and  name HA1  )(resid  113 and  name HD1# ) 4.0 3.0 2.3
assign (resid  117 and  name HA1  )(resid  113 and  name HD2# ) 4.0 3.0 2.3
assign (resid  117 and  name HA2  )(resid  113 and  name HD1# ) 4.0 3.0 2.3
assign (resid  117 and  name HA2  )(resid  113 and  name HD2# ) 4.0 3.0 2.3
assign (resid  117 and  name HN   )(resid  117 and  name HA1  ) 2.5 0.7 0.4
assign (resid  117 and  name HN   )(resid  117 and  name HA2  ) 2.5 0.7 0.4
assign (resid  117 and  name HN   )(resid  116 and  name HA   ) 4.0 2.0 1.0
assign (resid  117 and  name HN   )(resid  116 and  name HB#  ) 3.0 2.2 1.5
assign (resid  117 and  name HN   )(resid  114 and  name HA   ) 4.0 2.0 1.0
assign (resid  117 and  name HN   )(resid  118 and  name HA   ) 4.5 2.0 0.7
assign (resid  117 and  name HN   )(resid  118 and  name HB2  ) 4.0 2.0 1.0
assign (resid  117 and  name HN   )(resid  113 and  name HD1# ) 4.0 3.0 2.3
assign (resid  117 and  name HN   )(resid  113 and  name HD2# ) 4.0 3.0 2.3
!E118
assign (resid  118 and  name HA   )(resid  118 and  name HB1  ) 2.5 0.7 0.2
assign (resid  118 and  name HA   )(resid  118 and  name HB2  ) 3.0 1.2 0.3
assign (resid  118 and  name HA   )(resid  118 and  name HG1  ) 3.0 1.2 0.5
assign (resid  118 and  name HA   )(resid  118 and  name HG2  ) 3.0 1.2 0.3
assign (resid  118 and  name HN   )(resid  114 and  name HG2# ) 4.0 3.0 2.0
!assign (resid  118 and  name HN   )(resid  113 and  name HN   ) 4.0 2.2 1.0
assign (resid  118 and  name HN   )(resid  118 and  name HB1  ) 3.0 1.2 1.0
assign (resid  118 and  name HN   )(resid  118 and  name HB2  ) 2.5 0.7 0.4
assign (resid  118 and  name HN   )(resid  117 and  name HA#  ) 2.5 1.7 1.4
assign (resid  118 and  name HN   )(resid  116 and  name HB1  ) 4.0 2.2 1.0
!assign (resid  118 and  name HN   )(resid  116 and  name HB2  ) 4.5 2.0 0.7
!L119
assign (resid  119 and  name HA   )(resid  119 and  name HG   ) 3.0 1.2 0.3
assign (resid  119 and  name HA   )(resid  119 and  name HD1# ) 3.0 2.2 1.3
assign (resid  119 and  name HA   )(resid  119 and  name HD2# ) 4.0 3.0 2.0
assign (resid  119 and  name HA   )(resid  113 and  name HD2# ) 3.0 2.2 1.6
assign (resid  119 and  name HA   )(resid  113 and  name HD1# ) 4.0 3.0 2.0
assign (resid  119 and  name HN   )(resid  119 and  name HB#  ) 2.5 1.3 1.0
assign (resid  119 and  name HN   )(resid  119 and  name HG   ) 4.0 2.2 1.0
assign (resid  119 and  name HN   )(resid  113 and  name HD2# ) 4.0 3.0 2.0
assign (resid  119 and  name HN   )(resid  135 and  name HA   ) 4.0 2.2 1.0
assign (resid  119 and  name HN   )(resid  135 and  name HG2# ) 3.0 2.2 1.8
assign (resid  119 and  name HN   )(resid    7 and  name HE3  ) 4.0 2.2 1.0
assign (resid  119 and  name HN   )(resid    7 and  name HH2  ) 3.0 1.2 0.5
assign (resid  119 and  name HN   )(resid    7 and  name HZ3  ) 4.0 2.2 1.0
assign (resid  119 and  name HN   )(resid  118 and  name HA   ) 2.3 0.7 0.2
assign (resid  119 and  name HN   )(resid  118 and  name HB2  ) 3.0 1.2 0.5
assign (resid  119 and  name HN   )(resid  118 and  name HB1  ) 3.0 1.2 0.5
assign (resid  119 and  name HN   )(resid  134 and  name HB2  ) 4.0 2.2 1.0
assign (resid  119 and  name HN   )(resid  134 and  name HB1  ) 4.0 2.2 1.0
assign (resid  119 and  name HB1  )(resid  119 and  name HD1# ) 3.0 2.2 1.5
assign (resid  119 and  name HB1  )(resid  119 and  name HD2# ) 3.0 2.2 1.5
assign (resid  119 and  name HB2  )(resid  119 and  name HD1# ) 2.5 1.7 1.4
assign (resid  119 and  name HG   )(resid  113 and  name HD2# ) 3.0 2.2 1.5
assign (resid  119 and  name HG   )(resid  113 and  name HD1# ) 4.0 3.0 2.0
assign (resid  119 and  name HG   )(resid  119 and  name HB2  ) 2.5 0.7 0.2
assign (resid  119 and  name HG   )(resid  119 and  name HB1  ) 4.0 2.0 1.0
!I120
assign (resid  120 and  name HA   )(resid  120 and  name HB   ) 2.5 0.7 0.2
assign (resid  120 and  name HA   )(resid  120 and  name HG1# ) 2.5 1.3 0.8
assign (resid  120 and  name HA   )(resid  120 and  name HG2# ) 3.0 2.0 1.3
assign (resid  120 and  name HA   )(resid  121 and  name HB#  ) 4.0 3.0 2.0
assign (resid  120 and  name HN   )(resid  120 and  name HB   ) 3.0 1.2 0.5
assign (resid  120 and  name HN   )(resid  120 and  name HG1# ) 3.0 2.2 1.5
assign (resid  120 and  name HN   )(resid  120 and  name HG2# ) 2.5 1.7 1.2
assign (resid  120 and  name HN   )(resid  114 and  name HG2# ) 4.5 3.0 1.7
assign (resid  120 and  name HN   )(resid  119 and  name HA   ) 2.3 0.7 0.2
assign (resid  120 and  name HN   )(resid  119 and  name HG   ) 3.0 1.2 0.5
assign (resid  120 and  name HN   )(resid  112 and  name HB#  ) 4.0 3.0 2.0
assign (resid  120 and  name HN   )(resid  112 and  name HG#  ) 4.5 3.0 1.5
assign (resid  120 and  name HN   )(resid  113 and  name HA   ) 3.0 1.2 0.5
assign (resid  120 and  name HN   )(resid  113 and  name HD2# ) 4.5 3.0 1.5
!assign (resid  120 and  name HN   )(resid  121 and  name HD2# ) 4.5 3.0 1.7
!L121
assign (resid  121 and  name HA   )(resid  121 and  name HB1  ) 3.0 1.2 0.3
assign (resid  121 and  name HA   )(resid  121 and  name HB2  ) 3.0 1.2 0.3
assign (resid  121 and  name HA   )(resid  121 and  name HG   ) 4.5 2.0 0.5
assign (resid  121 and  name HA   )(resid  121 and  name HD1# ) 3.0 2.2 1.3
assign (resid  121 and  name HA   )(resid  121 and  name HD2# ) 3.0 2.2 1.3
assign (resid  121 and  name HA   )(resid  111 and  name HB#  ) 3.0 2.2 1.5
assign (resid  121 and  name HA   )(resid  120 and  name HG1# ) 4.0 3.0 2.0
!assign (resid  121 and  name HB   )(resid  121 and  name HD2# ) 3.0 2.2 1.3
assign (resid  121 and  name HN   )(resid  121 and  name HB1  ) 2.5 0.7 0.4
assign (resid  121 and  name HN   )(resid  121 and  name HB2  ) 3.0 1.2 0.5
assign (resid  121 and  name HN   )(resid  121 and  name HD1# ) 3.0 2.2 2.5
assign (resid  121 and  name HN   )(resid  121 and  name HD2# ) 4.0 3.0 2.0
assign (resid  121 and  name HN   )(resid  134 and  name HD1  ) 4.0 2.0 1.0
assign (resid  121 and  name HN   )(resid  120 and  name HG2# ) 3.0 2.2 1.8
assign (resid  121 and  name HN   )(resid  120 and  name HD1# ) 3.0 2.2 1.8
assign (resid  121 and  name HN   )(resid  120 and  name HA   ) 2.3 0.7 0.2
assign (resid  121 and  name HN   )(resid  131 and  name HG2# ) 4.0 3.0 2.0
assign (resid  121 and  name HN   )(resid  133 and  name HA   ) 4.0 2.0 1.0
assign (resid  121 and  name HN   )(resid  131 and  name HA   ) 4.0 2.0 1.0
assign (resid  121 and  name HN   )(resid  134 and  name HE1  ) 4.5 2.5 0.7
!T122
assign (resid  122 and  name HA   )(resid  122 and  name HB   ) 2.5 0.7 0.4
assign (resid  122 and  name HA   )(resid  122 and  name HG2# ) 2.5 1.3 0.8
assign (resid  122 and  name HA   )(resid  131 and  name HG2# ) 4.0 3.2 2.0
assign (resid  122 and  name HA   )(resid  121 and  name HD2# ) 3.0 2.2 1.8
assign (resid  122 and  name HA   )(resid  129 and  name HG1# ) 3.0 2.2 1.8
assign (resid  122 and  name HA   )(resid  123 and  name HB2  ) 4.0 2.2 1.0
assign (resid  122 and  name HN   )(resid  122 and  name HG2# ) 3.0 2.2 1.5
assign (resid  122 and  name HN   )(resid  122 and  name HB   ) 4.0 2.2 1.0
assign (resid  122 and  name HN   )(resid  121 and  name HA   ) 2.3 0.7 0.2
assign (resid  122 and  name HN   )(resid  111 and  name HA   ) 3.0 1.2 0.5
assign (resid  122 and  name HN   )(resid  121 and  name HB1  ) 4.0 2.2 1.0
assign (resid  122 and  name HN   )(resid  121 and  name HB2  ) 4.0 2.2 1.0
assign (resid  122 and  name HN   )(resid  121 and  name HG   ) 4.0 2.2 1.0
assign (resid  122 and  name HN   )(resid  121 and  name HD1# ) 3.0 2.2 1.5
assign (resid  122 and  name HN   )(resid  121 and  name HD2# ) 4.0 3.2 2.0
!assign (resid  122 and  name HB   )(resid  129 and  name HG2# ) 3.0 1.7 1.3
assign (resid  122 and  name HB   )(resid  129 and  name HG2# ) 4.0 3.2 2.0
assign (resid  122 and  name HB   )(resid  129 and  name HG1# ) 3.0 1.7 1.3
!M123
assign (resid  123 and  name HA   )(resid  123 and  name HB#  ) 2.5 0.7 0.2
assign (resid  123 and  name HA   )(resid  123 and  name HG1  ) 4.0 2.2 1.0
assign (resid  123 and  name HA   )(resid  123 and  name HG2  ) 3.0 1.2 0.3
assign (resid  123 and  name HA   )(resid  109 and  name HB1  ) 4.0 2.2 1.0
assign (resid  123 and  name HA   )(resid  109 and  name HB2  ) 4.0 2.2 1.0
assign (resid  123 and  name HA   )(resid  123 and  name HE#  ) 3.0 2.2 1.8
assign (resid  123 and  name HN   )(resid  123 and  name HB#  ) 3.0 2.2 1.5
assign (resid  123 and  name HN   )(resid  123 and  name HG#  ) 3.0 2.2 1.5
assign (resid  123 and  name HN   )(resid  130 and  name HB1  ) 4.0 2.2 1.0
assign (resid  123 and  name HN   )(resid  131 and  name HA   ) 3.0 1.2 0.5
assign (resid  123 and  name HN   )(resid  122 and  name HA   ) 2.3 0.7 0.2
assign (resid  123 and  name HN   )(resid  122 and  name HB   ) 3.0 1.2 0.5
assign (resid  123 and  name HN   )(resid  122 and  name HG2# ) 2.5 1.7 1.4
assign (resid  123 and  name HN   )(resid  129 and  name HG1# ) 3.0 2.2 1.5
assign (resid  123 and  name HN   )(resid  109 and  name HA   ) 4.0 2.2 1.0
!T124
assign (resid  124 and  name HA   )(resid  129 and  name HB   ) 4.0 2.0 1.0
assign (resid  124 and  name HA   )(resid  123 and  name HB#  ) 4.0 3.0 2.0
assign (resid  124 and  name HA   )(resid  124 and  name HB   ) 2.5 0.7 0.4
assign (resid  124 and  name HA   )(resid  124 and  name HG2# ) 2.5 1.3 0.8
assign (resid  124 and  name HA   )(resid  125 and  name HB#  ) 4.0 3.0 2.0
assign (resid  124 and  name HA   )(resid  129 and  name HG2# ) 2.5 1.7 1.2
assign (resid  124 and  name HA   )(resid  129 and  name HG1# ) 3.0 2.2 2.0
assign (resid  124 and  name HA   )(resid  18  and  name HD1# ) 4.0 3.0 2.0
assign (resid  124 and  name HN   )(resid  124 and  name HB   ) 3.0 1.2 0.5
assign (resid  124 and  name HN   )(resid  124 and  name HG2# ) 3.0 2.2 1.8
assign (resid  124 and  name HN   )(resid  109 and  name HA   ) 3.0 1.2 0.5
assign (resid  124 and  name HN   )(resid  109 and  name HB1  ) 4.0 2.0 1.0
assign (resid  124 and  name HN   )(resid  109 and  name HB2  ) 4.0 2.0 1.0
assign (resid  124 and  name HN   )(resid  123 and  name HA   ) 2.3 0.7 0.2
assign (resid  124 and  name HN   )(resid  123 and  name HB#  ) 4.0 3.0 2.0
assign (resid  124 and  name HN   )(resid  123 and  name HG#  ) 4.0 3.0 2.0
assign (resid  124 and  name HN   )(resid  129 and  name HG2# ) 4.0 3.0 2.0
assign (resid  124 and  name HN   )(resid  123 and  name HE#  ) 4.0 3.0 2.3
!A125
assign (resid  125 and  name HA   )(resid  107 and  name HB   ) 4.0 2.2 1.0
assign (resid  125 and  name HA   )(resid  124 and  name HB   ) 4.5 1.5 0.5
assign (resid  125 and  name HA   )(resid  124 and  name HG2# ) 4.0 3.0 2.0
assign (resid  125 and  name HA   )(resid  107 and  name HG2# ) 2.5 1.7 1.2
assign (resid  125 and  name HN   )(resid  125 and  name HA   ) 3.0 1.2 0.5
assign (resid  125 and  name HN   )(resid  129 and  name HA   ) 3.0 1.2 0.5
assign (resid  125 and  name HN   )(resid  129 and  name HB   ) 4.0 2.2 1.5
assign (resid  125 and  name HN   )(resid  129 and  name HG2# ) 3.0 2.2 1.5
assign (resid  125 and  name HN   )(resid  128 and  name HB   ) 4.0 2.2 1.2
assign (resid  125 and  name HN   )(resid  128 and  name HG2# ) 2.5 1.7 1.4
assign (resid  125 and  name HN   )(resid  124 and  name HA   ) 2.3 0.7 0.4
assign (resid  125 and  name HN   )(resid  124 and  name HB   ) 3.0 1.2 0.5
assign (resid  125 and  name HN   )(resid  124 and  name HG2# ) 2.5 1.7 1.2
!D126
assign (resid  126 and  name HA   )(resid  126 and  name HB#  ) 2.5 1.3 0.8
assign (resid  126 and  name HN   )(resid  126 and  name HB#  ) 2.5 1.3 1.0
assign (resid  126 and  name HN   )(resid  127 and  name HA   ) 4.0 2.0 1.0
assign (resid  126 and  name HN   )(resid  125 and  name HA   ) 2.5 0.7 0.2
assign (resid  126 and  name HN   )(resid  124 and  name HG2# ) 3.0 2.2 1.5
assign (resid  126 and  name HN   )(resid  107 and  name HG2# ) 4.0 3.2 2.0
assign (resid  126 and  name HN   )(resid  106 and  name HB#  ) 2.5 1.7 1.4
assign (resid  126 and  name HN   )(resid  106 and  name HG#  ) 3.0 2.2 1.5
assign (resid  126 and  name HN   )(resid  105 and  name HB#  ) 4.0 3.2 2.0
!D127
assign (resid  127 and  name HA   )(resid  127 and  name HB#  ) 2.5 0.7 0.2
assign (resid  127 and  name HA   )(resid  126 and  name HB#  ) 4.0 2.0 1.0
assign (resid  127 and  name HA   )(resid  124 and  name HG2# ) 3.0 1.8 1.3
assign (resid  127 and  name HN   )(resid  127 and  name HA   ) 2.5 0.7 0.4
assign (resid  127 and  name HN   )(resid  127 and  name HB#  ) 2.5 1.3 1.0
assign (resid  127 and  name HN   )(resid  126 and  name HA   ) 3.0 1.2 0.5
assign (resid  127 and  name HN   )(resid  126 and  name HB#  ) 3.0 2.2 1.5
assign (resid  127 and  name HN   )(resid  128 and  name HB   ) 4.5 2.0 0.7
assign (resid  127 and  name HN   )(resid  128 and  name HG2# ) 2.5 1.7 1.4
assign (resid  127 and  name HN   )(resid   21 and  name HG2# ) 4.0 2.0 2.0 
!V128
assign (resid  128 and  name HA   )(resid  128 and  name HG1# ) 2.5 1.0 0.8
!assign (resid  128 and  name HA   )(resid  128 and  name HG2# ) 2.5 1.3 0.8
assign (resid  128 and  name HA   )(resid  128 and  name HG2# ) 3.0 1.8 0.9 
assign (resid  128 and  name HA   )(resid  128 and  name HB   ) 2.5 0.7 0.4
assign (resid  128 and  name HA   )(resid  129 and  name HB   ) 3.0 1.2 1.0
assign (resid  128 and  name HN   )(resid  127 and  name HA   ) 2.5 0.7 0.4
assign (resid  128 and  name HN   )(resid  127 and  name HB#  ) 3.0 2.2 1.5
assign (resid  128 and  name HN   )(resid  129 and  name HG2# ) 4.5 3.0 1.5
assign (resid  128 and  name HN   )(resid  128 and  name HG1# ) 2.5 1.7 1.7
assign (resid  128 and  name HN   )(resid  128 and  name HG2# ) 2.5 1.7 1.4
assign (resid  128 and  name HN   )(resid  128 and  name HA   ) 2.5 0.7 0.4
assign (resid  128 and  name HN   )(resid  128 and  name HB   ) 3.0 1.2 0.8
assign (resid  128 and  name HN   )(resid  126 and  name HA   ) 4.0 2.2 1.0
assign (resid  128 and  name HN   )(resid  126 and  name HB#  ) 2.5 1.7 1.4
!V129
assign (resid  129 and  name HA   )(resid  129 and  name HB   ) 2.5 0.7 0.4
assign (resid  129 and  name HA   )(resid  124 and  name HB   ) 4.0 2.0 1.0
assign (resid  129 and  name HA   )(resid  129 and  name HG2# ) 2.5 1.3 0.8
assign (resid  129 and  name HA   )(resid  129 and  name HG1# ) 3.0 1.8 0.9
assign (resid  129 and  name HN   )(resid  129 and  name HB   ) 2.5 0.7 0.4
assign (resid  129 and  name HN   )(resid  129 and  name HG1# ) 3.0 2.2 1.5
assign (resid  129 and  name HN   )(resid  129 and  name HG2# ) 3.0 2.2 1.5
assign (resid  129 and  name HN   )(resid  128 and  name HA   ) 2.3 0.7 0.2
assign (resid  129 and  name HN   )(resid  128 and  name HB   ) 3.0 1.2 0.5
assign (resid  129 and  name HN   )(resid  128 and  name HG2# ) 2.5 1.7 1.2
assign (resid  129 and  name HN   )(resid  124 and  name HA   ) 4.0 2.0 1.0  
!C130
assign (resid  130 and  name HA   )(resid  130 and  name HB1  ) 2.5 0.7 0.4
assign (resid  130 and  name HA   )(resid  130 and  name HB2  ) 2.5 0.7 0.2
assign (resid  130 and  name HA   )(resid   14 and  name HB1  ) 3.0 1.2 0.3
assign (resid  130 and  name HA   )(resid   14 and  name HB2  ) 2.5 0.7 0.2
assign (resid  130 and  name HN   )(resid  130 and  name HB1  ) 2.5 0.7 0.4
assign (resid  130 and  name HN   )(resid  130 and  name HB2  ) 3.0 1.2 0.5
assign (resid  130 and  name HN   )(resid  129 and  name HA   ) 2.3 0.7 0.2
assign (resid  130 and  name HN   )(resid  129 and  name HB   ) 4.0 2.0 1.0
assign (resid  130 and  name HN   )(resid  129 and  name HG1# ) 3.5 2.2 1.5
assign (resid  130 and  name HN   )(resid  129 and  name HG2# ) 4.0 3.0 2.0
assign (resid  130 and  name HN   )(resid  125 and  name HB#  ) 4.0 3.0 2.0
assign (resid  130 and  name HN   )(resid  123 and  name HB#  ) 4.0 3.0 2.0
assign (resid  130 and  name HN   )(resid  128 and  name HG2# ) 3.0 1.7 2.0
assign (resid  130 and  name HN   )(resid  124 and  name HA   ) 3.0 1.2 0.5
assign (resid  130 and  name HN   )(resid  130 and  name HA   ) 3.0 1.2 0.5
assign (resid  130 and  name HN   )(resid  123 and  name HG#  ) 4.0 3.0 2.0
assign (resid  130 and  name HN   )(resid   18 and  name HD1# ) 3.0 2.2 1.5
!T131
assign (resid  131 and  name HA   )(resid  131 and  name HB   ) 3.0 1.2 0.3
assign (resid  131 and  name HA   )(resid  122 and  name HB   ) 4.0 2.2 1.0
assign (resid  131 and  name HA   )(resid  123 and  name HG1  ) 4.5 2.0 0.5
assign (resid  131 and  name HA   )(resid  123 and  name HG2  ) 4.5 2.0 0.5
assign (resid  131 and  name HA   )(resid  123 and  name HB#  ) 3.0 2.3 2.0
assign (resid  131 and  name HA   )(resid  132 and  name HB#  ) 4.0 3.2 2.0
assign (resid  131 and  name HA   )(resid  122 and  name HG2# ) 2.5 1.7 1.2
assign (resid  131 and  name HN   )(resid  131 and  name HA   ) 3.0 1.2 0.5
assign (resid  131 and  name HN   )(resid  131 and  name HB   ) 3.0 1.2 0.3
assign (resid  131 and  name HN   )(resid  131 and  name HG2# ) 3.0 2.2 1.5
assign (resid  131 and  name HN   )(resid   13 and  name HB#  ) 4.0 2.2 2.0
assign (resid  131 and  name HN   )(resid   13 and  name HG#  ) 3.0 2.2 1.5
assign (resid  131 and  name HN   )(resid   14 and  name HB2  ) 4.0 2.2 1.0
assign (resid  131 and  name HN   )(resid   14 and  name HB1  ) 4.0 2.2 1.0
assign (resid  131 and  name HN   )(resid  130 and  name HA   ) 2.3 0.7 0.2
assign (resid  131 and  name HN   )(resid  130 and  name HB1  ) 4.0 2.2 1.0
assign (resid  131 and  name HN   )(resid  130 and  name HB2  ) 4.0 2.2 1.0
assign (resid  131 and  name HN   )(resid  123 and  name HG#  ) 4.0 3.0 2.0
assign (resid  131 and  name HN   )(resid  129 and  name HG1# ) 4.0 3.0 2.0
!R132
assign (resid  132 and  name HA   )(resid   12 and  name HB1  ) 4.0 2.0 1.0
assign (resid  132 and  name HA   )(resid   12 and  name HB2  ) 4.0 2.0 1.0
assign (resid  132 and  name HA   )(resid  132 and  name HG#  ) 4.0 3.0 2.0
assign (resid  132 and  name HA   )(resid   11 and  name HB#  ) 4.0 3.0 2.0
assign (resid  132 and  name HA   )(resid    9 and  name HG1# ) 3.0 2.2 1.3
assign (resid  132 and  name HA   )(resid    9 and  name HD1# ) 3.0 2.2 1.8
assign (resid  132 and  name HE   )(resid  132 and  name HB#  ) 4.0 3.0 2.0
assign (resid  132 and  name HE   )(resid  121 and  name HD2# ) 4.5 3.0 1.5
assign (resid  132 and  name HE   )(resid    9 and  name HD1# ) 4.0 3.0 2.0
assign (resid  132 and  name HN   )(resid  132 and  name HG#  ) 3.0 2.2 1.5
assign (resid  132 and  name HN   )(resid  132 and  name HB#  ) 3.0 1.8 0.9
assign (resid  132 and  name HN   )(resid  131 and  name HA   ) 2.3 0.7 0.2
assign (resid  132 and  name HN   )(resid  131 and  name HB   ) 4.5 2.0 0.7
assign (resid  132 and  name HN   )(resid  131 and  name HG2# ) 2.5 1.7 1.2
assign (resid  132 and  name HN   )(resid  121 and  name HB1  ) 4.0 2.2 1.0
assign (resid  132 and  name HN   )(resid  122 and  name HA   ) 3.0 1.2 0.5
assign (resid  132 and  name HN   )(resid   12 and  name HA   ) 4.5 2.0 0.7
assign (resid  132 and  name HN   )(resid  134 and  name HE1  ) 4.5 2.0 0.7
!V133
assign (resid  133 and  name HA   )(resid  133 and  name HB   ) 2.5 0.7 0.4
assign (resid  133 and  name HA   )(resid  133 and  name HG2# ) 2.5 1.3 0.8
assign (resid  133 and  name HA   )(resid  133 and  name HG1# ) 2.5 1.3 0.8
assign (resid  133 and  name HA   )(resid  120 and  name HB   ) 3.0 1.2 0.3
assign (resid  133 and  name HA   )(resid  120 and  name HG2# ) 4.0 3.2 2.0
assign (resid  133 and  name HN   )(resid  133 and  name HB   ) 2.5 0.7 0.2
assign (resid  133 and  name HN   )(resid  133 and  name HG2# ) 2.5 1.7 1.4
assign (resid  133 and  name HN   )(resid  133 and  name HG1# ) 3.0 2.2 1.5
assign (resid  133 and  name HN   )(resid  132 and  name HA   ) 2.3 0.7 0.2
assign (resid  133 and  name HN   )(resid  132 and  name HB#  ) 4.0 3.2 2.0
assign (resid  133 and  name HN   )(resid  131 and  name HG2# ) 4.0 3.2 2.0
assign (resid  133 and  name HN   )(resid    9 and  name HA   ) 4.0 2.2 1.0
assign (resid  133 and  name HN   )(resid    9 and  name HD1# ) 4.0 3.0 2.0
assign (resid  133 and  name HN   )(resid   11 and  name HB#  ) 4.0 3.0 2.0
!Y134
assign (resid  134 and  name HA   )(resid    9 and  name HG1# ) 3.0 2.2 1.5
assign (resid  134 and  name HA   )(resid  133 and  name HG1# ) 4.0 3.0 2.0
assign (resid  134 and  name HN   )(resid  134 and  name HB#  ) 3.0 1.8 0.9
assign (resid  134 and  name HN   )(resid  133 and  name HA   ) 2.3 0.7 0.2
assign (resid  134 and  name HN   )(resid  133 and  name HB   ) 4.0 2.2 1.0
assign (resid  134 and  name HN   )(resid  133 and  name HG1# ) 3.0 2.2 1.5
assign (resid  134 and  name HN   )(resid  133 and  name HG2# ) 3.0 2.2 1.8 
assign (resid  134 and  name HN   )(resid  120 and  name HA   ) 3.0 1.2 0.5
assign (resid  134 and  name HN   )(resid  120 and  name HG2# ) 4.0 3.0 2.0
assign (resid  134 and  name HN   )(resid  119 and  name HA   ) 4.5 2.0 0.7
assign (resid  134 and  name HN   )(resid  119 and  name HD2# ) 4.0 3.0 2.0
assign (resid  134 and  name HN   )(resid  134 and  name HD1  ) 3.0 1.2 0.3               
!V135
assign (resid  135 and  name HA   )(resid  135 and  name HB   ) 2.5 0.7 0.4
assign (resid  135 and  name HA   )(resid  135 and  name HG2# ) 2.5 1.3 0.8
assign (resid  135 and  name HA   )(resid  135 and  name HG1# ) 3.0 1.8 0.9
assign (resid  135 and  name HN   )(resid  135 and  name HB   ) 4.0 2.2 1.0
assign (resid  135 and  name HN   )(resid  135 and  name HG2# ) 3.0 1.2 1.5
assign (resid  135 and  name HN   )(resid  135 and  name HG1# ) 2.5 1.7 1.4
assign (resid  135 and  name HN   )(resid  134 and  name HA   ) 2.3 0.7 0.2
assign (resid  135 and  name HN   )(resid  134 and  name HB#  ) 3.0 2.2 1.3
assign (resid  135 and  name HN   )(resid    9 and  name HA   ) 3.0 1.2 0.5
assign (resid  135 and  name HN   )(resid    9 and  name HB   ) 4.0 2.0 1.5
assign (resid  135 and  name HN   )(resid    7 and  name HA   ) 4.0 2.0 1.0
assign (resid  135 and  name HN   )(resid    7 and  name HE3  ) 3.0 1.2 0.3
assign (resid  135 and  name HN   )(resid    7 and  name HZ3  ) 4.0 2.0 1.0
!R136
assign (resid  136 and  name HA   )(resid  136 and  name HB1  ) 2.5 0.7 0.2
assign (resid  136 and  name HA   )(resid  136 and  name HB2  ) 3.0 1.2 0.3
assign (resid  136 and  name HA   )(resid  136 and  name HG#  ) 3.0 1.8 0.9
assign (resid  136 and  name HA   )(resid  136 and  name HD#  ) 4.5 3.0 1.5
assign (resid  136 and  name HE   )(resid  136 and  name HB1  ) 4.5 2.5 0.6
assign (resid  136 and  name HE   )(resid  136 and  name HB2  ) 4.0 2.2 1.0
assign (resid  136 and  name HE   )(resid  136 and  name HG1  ) 4.0 2.2 1.0
assign (resid  136 and  name HE   )(resid  136 and  name HG2  ) 4.0 2.2 1.0
assign (resid  136 and  name HE   )(resid  135 and  name HG1# ) 4.0 3.0 2.5
assign (resid  136 and  name HE   )(resid  135 and  name HG2# ) 4.0 3.0 2.0
assign (resid  136 and  name HE   )(resid  136 and  name HD1  ) 3.0 1.2 0.3
assign (resid  136 and  name HE   )(resid  136 and  name HD2  ) 3.0 1.2 0.3
assign (resid  136 and  name HE   )(resid    5 and  name HA1  ) 4.5 2.0 0.7
assign (resid  136 and  name HE   )(resid  136 and  name HA   ) 4.5 2.0 0.7
assign (resid  136 and  name HN   )(resid  136 and  name HB1  ) 3.0 1.2 0.5
assign (resid  136 and  name HN   )(resid  136 and  name HB2  ) 2.5 0.7 0.4
assign (resid  136 and  name HN   )(resid  136 and  name HG1  ) 3.0 1.2 0.5
assign (resid  136 and  name HN   )(resid  136 and  name HG2  ) 4.0 2.2 1.0
assign (resid  136 and  name HN   )(resid  135 and  name HA   ) 2.3 0.7 0.2
assign (resid  136 and  name HN   )(resid  135 and  name HB   ) 4.0 2.2 1.0
assign (resid  136 and  name HN   )(resid  135 and  name HG1# ) 2.5 1.7 1.4
assign (resid  136 and  name HN   )(resid  118 and  name HA   ) 4.0 2.2 1.0
assign (resid  136 and  name HN   )(resid    7 and  name HZ3  ) 4.0 2.2 1.0
assign (resid  136 and  name HN   )(resid    7 and  name HE3  ) 3.0 1.2 0.5
assign (resid  136 and  name HN   )(resid    7 and  name HH2  ) 3.0 1.2 0.5                                                                                                                                                                                                                                            
!E137
assign (resid  137 and  name HA   )(resid  137 and  name HB2  ) 2.5 0.7 0.2
assign (resid  137 and  name HA   )(resid  137 and  name HB1  ) 3.0 1.2 0.3
assign (resid  137 and  name HA   )(resid  137 and  name HG#  ) 2.5 1.7 1.2
assign (resid  137 and  name HA   )(resid  136 and  name HB#  ) 4.5 3.0 1.5
assign (resid  137 and  name HA   )(resid    8 and  name HG#  ) 3.0 1.7 1.5
assign (resid  137 and  name HN   )(resid  137 and  name HA   ) 2.5 0.7 0.2
assign (resid  137 and  name HN   )(resid    7 and  name HA   ) 2.5 0.7 0.4
assign (resid  137 and  name HN   )(resid    7 and  name HZ3  ) 4.5 2.0 1.0
assign (resid  137 and  name HN   )(resid    7 and  name HE3  ) 4.5 2.0 0.7
assign (resid  137 and  name HN   )(resid    6 and  name HB2  ) 3.0 0.7 0.4
assign (resid  137 and  name HN   )(resid    6 and  name HB1  ) 4.0 2.2 1.0
assign (resid  137 and  name HN   )(resid  137 and  name HG#  ) 3.0 2.2 1.3
assign (resid  137 and  name HN   )(resid  136 and  name HA   ) 2.5 0.7 0.2
assign (resid  137 and  name HN   )(resid  136 and  name HB1  ) 3.0 1.2 0.5
assign (resid  137 and  name HN   )(resid    8 and  name HB2  ) 4.0 2.0 1.0
assign (resid  137 and  name HN   )(resid  136 and  name HB2  ) 4.0 2.0 1.0
assign (resid  137 and  name HN   )(resid  136 and  name HG1  ) 3.0 1.2 0.7
assign (resid  137 and  name HN   )(resid  136 and  name HG2  ) 3.0 1.2 0.5
assign (resid  137 and  name HA   )(resid  135 and  name HG1# ) 4.0 3.0 2.0
assign (resid  137 and  name HN   )(resid  137 and  name HB2  ) 2.5 0.7 0.2
assign (resid  137 and  name HN   )(resid  137 and  name HB1  ) 3.0 1.2 0.5
!Tyr-51
assign (resid   51 and  name HD2  )(resid   64 and  name HA   ) 4.0 2.2 1.0
assign (resid   51 and  name HD2  )(resid   64 and  name HB2  ) 4.0 2.2 1.0
assign (resid   51 and  name HD2  )(resid   64 and  name HD2# ) 3.0 2.2 1.7
assign (resid   51 and  name HD1  )(resid   43 and  name HA   ) 4.0 2.2 1.0
assign (resid   51 and  name HD1  )(resid   51 and  name HA   ) 3.0 1.2 0.5
assign (resid   51 and  name HD2  )(resid   51 and  name HA   ) 3.0 1.2 0.5
assign (resid   51 and  name HD1  )(resid   52 and  name HA   ) 4.0 2.2 1.0
assign (resid   51 and  name HD1  )(resid   52 and  name HB   ) 4.0 2.2 1.0
!assign (resid   51 and  name HD#  )(resid   63 and  name HB   ) 3.0 2.2 2.5
assign (resid   51 and  name HD1  )(resid   53 and  name HB2  ) 4.0 3.2 3.0
assign (resid   51 and  name HE1  )(resid   53 and  name HB1  ) 3.0 3.2 2.5
assign (resid   51 and  name HE1  )(resid   53 and  name HB2  ) 2.5 2.2 2.5
assign (resid   51 and  name HE1  )(resid   44 and  name HE1  ) 4.0 2.2 1.0
assign (resid   51 and  name HE1  )(resid   44 and  name HE2  ) 4.0 2.2 1.0
assign (resid   51 and  name HD1  )(resid   44 and  name HG1  ) 3.0 1.2 0.3
assign (resid   51 and  name HE1  )(resid   44 and  name HG1  ) 4.0 2.2 1.0
assign (resid   51 and  name HE1  )(resid   44 and  name HG2  ) 4.0 2.2 1.0
assign (resid   51 and  name HE1  )(resid   62 and  name HA   ) 3.0 1.2 0.5
assign (resid   51 and  name HE1  )(resid   62 and  name HB#  ) 3.0 2.2 1.3
assign (resid   51 and  name HE1  )(resid   62 and  name HG1  ) 3.0 1.2 0.8
!Tyr-134
assign (resid  134 and  name HD1  )(resid  134 and  name HA   ) 3.0 1.2 0.8
assign (resid  134 and  name HD2  )(resid  134 and  name HA   ) 3.0 1.2 0.5
!assign (resid  134 and  name HD2  )(resid  135 and  name HA   ) 4.5 2.0 1.0
assign (resid  134 and  name HD2  )(resid    9 and  name HA   ) 3.0 1.2 0.5
assign (resid  134 and  name HD2  )(resid  134 and  name HB1  ) 3.0 1.2 0.3 
assign (resid  134 and  name HD1  )(resid  134 and  name HB2  ) 3.0 1.2 0.3 
assign (resid  134 and  name HD2  )(resid    8 and  name HA   ) 3.0 1.2 0.3
assign (resid  134 and  name HD1  )(resid  132 and  name HA   ) 4.5 2.0 0.7
assign (resid  134 and  name HD1  )(resid  132 and  name HB2  ) 3.0 1.2 0.5
assign (resid  134 and  name HD1  )(resid  132 and  name HG#  ) 4.0 3.0 2.0
assign (resid  134 and  name HD2  )(resid    7 and  name HB1  ) 3.0 1.2 0.3
assign (resid  134 and  name HD2  )(resid    7 and  name HB2  ) 3.0 1.2 0.3
assign (resid  134 and  name HD1  )(resid  133 and  name HA   ) 3.0 1.2 0.8
assign (resid  134 and  name HD1  )(resid  119 and  name HD2# ) 4.0 3.0 2.0
assign (resid  134 and  name HE2  )(resid    8 and  name HA   ) 3.0 1.2 0.5
assign (resid  134 and  name HE2  )(resid   40 and  name HA   ) 3.0 1.2 0.3
assign (resid  134 and  name HE2  )(resid   41 and  name HB   ) 4.0 2.2 1.0
assign (resid  134 and  name HE2  )(resid   41 and  name HG2# ) 3.0 2.2 1.3
assign (resid  134 and  name HE2  )(resid    7 and  name HB1  ) 4.0 2.2 1.0
assign (resid  134 and  name HE2  )(resid    9 and  name HA   ) 4.0 2.0 1.0
assign (resid  134 and  name HE1  )(resid  134 and  name HB2  ) 4.5 2.5 0.5
assign (resid  134 and  name HE2  )(resid  134 and  name HB1  ) 4.5 2.5 0.5
assign (resid  134 and  name HE1  )(resid  132 and  name HA   ) 4.5 2.0 0.7
assign (resid  134 and  name HE1  )(resid  132 and  name HB1  ) 4.0 2.2 1.0
assign (resid  134 and  name HE1  )(resid  132 and  name HB2  ) 2.5 0.7 0.2
assign (resid  134 and  name HE1  )(resid  132 and  name HG#  ) 3.0 2.2 1.3
assign (resid  134 and  name HE1  )(resid  132 and  name HD#  ) 4.0 3.0 2.0
assign (resid  134 and  name HE1  )(resid  121 and  name HB1  ) 3.0 1.2 0.5
assign (resid  134 and  name HE1  )(resid  121 and  name HD1# ) 4.0 3.0 2.0
assign (resid  134 and  name HE1  )(resid  121 and  name HD2# ) 3.0 2.2 2.0
!Phe-3
assign (resid   3  and  name HD1  )(resid    2 and  name HA   ) 4.0 2.2 1.0
assign (resid   3  and  name HD1  )(resid    3 and  name HA   ) 4.0 2.2 1.0
assign (resid   3  and  name HD1  )(resid  113 and  name HG   ) 4.0 2.2 1.0
assign (resid   3  and  name HD1  )(resid  113 and  name HB2  ) 4.0 2.2 1.0
assign (resid   3  and  name HD1  )(resid  113 and  name HD1# ) 4.0 3.0 2.0
assign (resid   3  and  name HD1  )(resid  113 and  name HD2# ) 3.0 2.2 1.3
assign (resid   3  and  name HD2  )(resid  113 and  name HD2# ) 3.0 2.2 1.3
assign (resid   3  and  name HD2  )(resid  119 and  name HG   ) 2.5 0.7 0.2
assign (resid   3  and  name HD2  )(resid  119 and  name HD2# ) 4.0 3.0 2.0
assign (resid   3  and  name HD2  )(resid  111 and  name HB#  ) 4.0 3.0 2.0
assign (resid   3  and  name HZ   )(resid  112 and  name HA   ) 3.0 1.2 0.3
assign (resid   3  and  name HZ   )(resid   92 and  name HA   ) 3.0 1.2 0.3
assign (resid   3  and  name HZ   )(resid   91 and  name HA   ) 4.0 2.2 1.0
assign (resid   3  and  name HE1  )(resid   91 and  name HA   ) 3.0 1.2 0.5
assign (resid   3  and  name HZ   )(resid  112 and  name HB#  ) 4.0 2.7 2.0
assign (resid   3  and  name HZ   )(resid  113 and  name HB1  ) 4.0 2.2 1.0
assign (resid   3  and  name HZ   )(resid  113 and  name HD2# ) 4.0 3.0 2.0
assign (resid   3  and  name HE2  )(resid  112 and  name HA   ) 4.0 2.2 1.0
assign (resid   3  and  name HE2  )(resid   92 and  name HA   ) 4.0 2.2 1.0
assign (resid   3  and  name HE1  )(resid  113 and  name HG   ) 2.7 1.7 2.3
assign (resid   3  and  name HE1  )(resid  113 and  name HD2# ) 3.0 2.2 1.3
assign (resid   3  and  name HE2  )(resid  113 and  name HD2# ) 3.0 2.2 1.3
assign (resid   3  and  name HE2  )(resid  119 and  name HD2# ) 4.0 3.0 2.0
assign (resid   3  and  name HE2  )(resid  119 and  name HD1# ) 4.0 3.0 2.0
assign (resid   3  and  name HE2  )(resid  111 and  name HB#  ) 2.5 0.7 1.2
assign (resid   3  and  name HE2  )(resid  111 and  name HG#  ) 2.5 0.7 1.2
!Phe-71
assign (resid  71  and  name HD1  )(resid   71 and  name HA   ) 4.0 2.2 1.0
assign (resid  71  and  name HD2  )(resid   71 and  name HA   ) 4.0 2.2 1.0
assign (resid  71  and  name HD2  )(resid   70 and  name HA   ) 3.0 1.2 0.3
assign (resid  71  and  name HD1  )(resid   82 and  name HA   ) 4.0 2.2 1.0
assign (resid  71  and  name HD2  )(resid   84 and  name HA   ) 4.0 2.2 1.0
assign (resid  71  and  name HD1  )(resid   65 and  name HB#  ) 3.0 2.2 1.3
assign (resid  71  and  name HD2  )(resid   65 and  name HB#  ) 3.0 2.2 1.3
assign (resid  71  and  name HD2  )(resid   65 and  name HD1  ) 4.0 2.2 1.0
assign (resid  71  and  name HD1  )(resid   65 and  name HD2  ) 4.0 2.2 1.0
assign (resid  71  and  name HD1  )(resid   63 and  name HB   ) 4.5 2.0 0.7
!assign (resid  71  and  name HD2  )(resid   85 and  name HB   ) 4.5 2.0 0.7
assign (resid  71  and  name HE2  )(resid   85 and  name HB   ) 4.0 2.2 1.0
assign (resid  71  and  name HE2  )(resid   70 and  name HA   ) 4.0 2.2 1.0
assign (resid  71  and  name HE2  )(resid   84 and  name HA   ) 4.0 2.2 1.0
!assign (resid  71  and  name HE1  )(resid   82 and  name HA   ) 4.5 2.0 0.7
assign (resid  71  and  name HE1  )(resid   83 and  name HB#  ) 4.0 3.0 2.0
assign (resid  71  and  name HE1  )(resid   63 and  name HD1# ) 4.0 3.0 2.0
assign (resid  71  and  name HE2  )(resid   65 and  name HD1  ) 3.0 1.2 0.5
assign (resid  71  and  name HE1  )(resid   65 and  name HD2  ) 3.0 1.2 0.5
assign (resid  71  and  name HZ   )(resid   83 and  name HB#  ) 4.0 3.0 2.0
!assign (resid  71  and  name HZ   )(resid   85 and  name HG2# ) 2.5 1.7 2.5
assign (resid  71  and  name HZ   )(resid   85 and  name HG2# ) 3.0 2.2 1.5
!assign (resid  71  and  name HZ   )(resid   85 and  name HG2# ) 4.0 3.0 2.0
assign (resid  71  and  name HZ   )(resid   63 and  name HD1# ) 4.0 3.0 2.0
assign (resid  71  and  name HZ   )(resid  109 and  name HZ2  ) 3.0 1.2 0.3
!Phe-15
assign (resid  15  and  name HD#  )(resid   15 and  name HA   ) 2.5 1.7 2.2
assign (resid  15  and  name HD2  )(resid   15 and  name HB1  ) 3.0 1.2 0.3
assign (resid  15  and  name HD1  )(resid   15 and  name HB2  ) 3.0 1.2 0.3
assign (resid  15  and  name HD1  )(resid   36 and  name HB#  ) 3.0 2.2 1.5
!assign (resid  15  and  name HD2  )(resid   16 and  name HB#  ) 3.0 2.2 1.3
assign (resid  15  and  name HD1  )(resid   33 and  name HA   ) 3.3 1.2 0.5
assign (resid  15  and  name HD2  )(resid   33 and  name HA   ) 4.5 2.0 0.7
assign (resid  15  and  name HD2  )(resid   16 and  name HA   ) 4.0 2.2 1.0
!assign (resid  15  and  name HD2  )(resid   33 and  name HB   ) 3.0 1.2 0.5
assign (resid  15  and  name HD1  )(resid   33 and  name HG1# ) 2.5 1.7 1.7
assign (resid  15  and  name HD2  )(resid   33 and  name HG2# ) 3.0 2.2 1.8
assign (resid  15  and  name HZ   )(resid   36 and  name HB#  ) 3.0 2.2 1.5
assign (resid  15  and  name HZ   )(resid   33 and  name HG1# ) 4.0 3.0 2.5
assign (resid  15  and  name HZ   )(resid   33 and  name HG2# ) 4.0 3.0 2.0
assign (resid  15  and  name HZ   )(resid   19 and  name HG   ) 4.0 2.0 1.3
assign (resid  15  and  name HZ   )(resid   19 and  name HD1# ) 3.0 2.2 1.5
assign (resid  15  and  name HZ   )(resid   19 and  name HD2# ) 3.0 2.2 2.1
assign (resid  15  and  name HE1  )(resid   33 and  name HA   ) 3.0 1.2 0.3
assign (resid  15  and  name HE2  )(resid   15 and  name HB1  ) 4.5 2.0 0.7
assign (resid  15  and  name HE1  )(resid   15 and  name HB2  ) 4.5 2.0 0.5
assign (resid  15  and  name HE1  )(resid   36 and  name HB#  ) 2.0 1.7 1.2
assign (resid  15  and  name HE2  )(resid   36 and  name HB#  ) 3.0 2.2 1.8
assign (resid  15  and  name HE2  )(resid   19 and  name HG   ) 3.0 1.2 0.3
assign (resid  15  and  name HE2  )(resid   19 and  name HD1# ) 3.0 2.2 1.5
assign (resid  15  and  name HE2  )(resid   19 and  name HD2# ) 3.0 2.2 1.5
assign (resid  15  and  name HE1  )(resid   33 and  name HG2# ) 4.0 3.0 2.0
assign (resid  15  and  name HE2  )(resid   33 and  name HG2# ) 3.0 2.2 1.8
!Phe-50
!assign (resid  50  and  name HE#  )(resid   51 and  name HA   ) 4.5 3.2 2.7
assign (resid  50  and  name HZ   )(resid   48 and  name HA   ) 3.0 1.2 0.5
assign (resid  50  and  name HZ   )(resid    3 and  name HD1  ) 4.0 2.0 1.0
!assign (resid  50  and  name HD2  )(resid   49 and  name HB   ) 4.0 2.2 1.0
assign (resid  50  and  name HD2  )(resid   43 and  name HG2# ) 3.0 2.2 1.5
!assign (resid  50  and  name HD2  )(resid   43 and  name HD1# ) 4.5 2.5 1.7
assign (resid  50  and  name HD2  )(resid   45 and  name HG#  ) 3.0 2.2 1.5
assign (resid  50  and  name HD1  )(resid   66 and  name HA   ) 4.0 2.2 1.0
assign (resid  50  and  name HD1  )(resid   48 and  name HA   ) 4.0 2.2 1.0
assign (resid  50  and  name HD1  )(resid   49 and  name HA   ) 4.0 2.2 1.0
assign (resid  50  and  name HD1  )(resid   50 and  name HA   ) 4.0 2.2 1.0
assign (resid  50  and  name HD1  )(resid   65 and  name HZ   ) 3.0 1.2 0.5
assign (resid  50  and  name HD2  )(resid   50 and  name HA   ) 3.0 1.2 0.5
assign (resid  50  and  name HD2  )(resid    3 and  name HB#  ) 4.0 3.0 2.0
assign (resid  50  and  name HD2  )(resid    3 and  name HD1  ) 4.0 2.2 1.0
assign (resid  50  and  name HE1  )(resid   48 and  name HA   ) 2.5 0.7 0.2
assign (resid  50  and  name HE2  )(resid    3 and  name HD1  ) 3.0 1.2 0.5
!Phe-65
assign (resid  65  and  name HD2  )(resid   63 and  name HB   ) 4.0 2.2 1.0
assign (resid  65  and  name HD2  )(resid   63 and  name HD1# ) 3.0 2.2 1.3
assign (resid  65  and  name HD2  )(resid   63 and  name HG1# ) 4.0 3.0 2.0
assign (resid  65  and  name HD1  )(resid   66 and  name HA   ) 4.0 2.2 1.0
assign (resid  65  and  name HD1  )(resid   66 and  name HG#  ) 3.0 2.2 1.3
assign (resid  65  and  name HD#  )(resid   65 and  name HA   ) 3.0 2.2 1.3
assign (resid  65  and  name HD1  )(resid   67 and  name HA   ) 3.0 1.2 0.5
assign (resid  65  and  name HD1  )(resid   67 and  name HG1# ) 4.0 3.0 2.0
assign (resid  65  and  name HD2  )(resid   64 and  name HA   ) 4.0 2.2 1.0
assign (resid  65  and  name HD2  )(resid   52 and  name HD1# ) 4.0 3.0 2.0
assign (resid  65  and  name HD1  )(resid   85 and  name HB   ) 3.0 1.2 0.3
assign (resid  65  and  name HD1  )(resid   85 and  name HG1# ) 4.0 3.0 2.0
assign (resid  65  and  name HD1  )(resid   85 and  name HG2# ) 4.0 3.0 2.0
assign (resid  65  and  name HZ   )(resid   63 and  name HD1# ) 4.0 3.0 2.0
!assign (resid  65  and  name HZ   )(resid   67 and  name HA   ) 4.5 2.5 0.7
!assign (resid  65  and  name HZ   )(resid   67 and  name HG1# ) 3.0 2.2 1.3
assign (resid  65  and  name HZ   )(resid   67 and  name HG1# ) 4.0 3.0 2.0
assign (resid  65  and  name HZ   )(resid   93 and  name HE#  ) 4.0 3.0 2.0
assign (resid  65  and  name HZ   )(resid   52 and  name HD1# ) 3.0 2.2 1.5
assign (resid  65  and  name HZ   )(resid   85 and  name HG1# ) 4.0 3.0 2.0
assign (resid  65  and  name HZ   )(resid   85 and  name HG2# ) 4.0 3.0 2.0
assign (resid  65  and  name HE1  )(resid   67 and  name HA   ) 3.0 1.2 0.3
assign (resid  65  and  name HE1  )(resid   67 and  name HG1# ) 3.0 2.2 1.3
assign (resid  65  and  name HE1  )(resid   85 and  name HG1# ) 3.0 2.2 1.3
assign (resid  65  and  name HE1  )(resid   85 and  name HG2# ) 2.5 1.7 1.2
assign (resid  65  and  name HE2  )(resid   63 and  name HD1# ) 3.0 2.2 1.3
assign (resid  65  and  name HE2  )(resid   52 and  name HD1# ) 2.5 1.7 1.2
!Trp-87
assign (resid   87 and  name HE3  )(resid   87 and  name HA   ) 2.5 0.7 0.2
assign (resid   87 and  name HE3  )(resid   91 and  name HA   ) 4.0 2.2 1.0
assign (resid   87 and  name HE3  )(resid   93 and  name HA   ) 3.0 1.2 0.3
assign (resid   87 and  name HE3  )(resid   90 and  name HA   ) 4.0 2.2 1.0
assign (resid   87 and  name HE3  )(resid   87 and  name HB1  ) 3.0 1.2 0.3
assign (resid   87 and  name HE3  )(resid   87 and  name HB2  ) 4.0 2.2 1.0
assign (resid   87 and  name HE3  )(resid   93 and  name HG#  ) 4.0 2.2 2.0
assign (resid   87 and  name HE3  )(resid   93 and  name HB#  ) 4.0 3.0 2.0
assign (resid   87 and  name HE3  )(resid   67 and  name HG1# ) 4.0 3.0 2.0
assign (resid   87 and  name HZ2  )(resid   48 and  name HA   ) 3.0 1.2 0.3
assign (resid   87 and  name HZ2  )(resid   67 and  name HG1# ) 4.0 3.0 2.0
assign (resid   87 and  name HZ2  )(resid   67 and  name HG2# ) 3.0 2.2 1.3
assign (resid   87 and  name HZ2  )(resid   50 and  name HE1  ) 3.0 1.2 0.5
assign (resid   87 and  name HZ2  )(resid   50 and  name HD1  ) 4.0 2.0 1.0
assign (resid   87 and  name HZ2  )(resid   50 and  name HZ   ) 3.0 1.2 0.5
assign (resid   87 and  name HD1  )(resid   87 and  name HA   ) 4.0 2.2 1.0
assign (resid   87 and  name HD1  )(resid   86 and  name HA   ) 4.0 2.2 1.0
assign (resid   87 and  name HD1  )(resid   87 and  name HB1  ) 3.0 1.2 0.5
assign (resid   87 and  name HD1  )(resid   87 and  name HB2  ) 2.5 0.7 0.3
assign (resid   87 and  name HD1  )(resid   67 and  name HB   ) 3.0 1.2 0.3
assign (resid   87 and  name HD1  )(resid   67 and  name HG1# ) 3.0 2.2 1.3
assign (resid   87 and  name HD1  )(resid   67 and  name HG2# ) 3.0 2.2 1.5
assign (resid   87 and  name HH2  )(resid   93 and  name HG#  ) 4.0 2.2 2.0
assign (resid   87 and  name HH2  )(resid   93 and  name HE#  ) 3.0 2.2 1.8
assign (resid   87 and  name HH2  )(resid   50 and  name HD1  ) 4.0 2.0 1.0
assign (resid   87 and  name HH2  )(resid   50 and  name HZ   ) 3.0 1.2 0.5
assign (resid   87 and  name HZ3  )(resid   87 and  name HA   ) 4.0 2.2 1.0
assign (resid   87 and  name HZ3  )(resid   93 and  name HG#  ) 4.0 2.2 2.0
assign (resid   87 and  name HZ3  )(resid   93 and  name HB#  ) 4.0 2.2 2.0
assign (resid   87 and  name HZ3  )(resid   93 and  name HE#  ) 3.0 2.2 1.8
assign (resid   87 and  name HZ3  )(resid   67 and  name HG1# ) 4.0 3.0 2.3 
assign (resid   87 and  name HZ3  )(resid    3 and  name HZ   ) 3.0 1.2 0.3
assign (resid   87 and  name HE1  )(resid   67 and  name HG1# ) 2.5 1.7 1.4
assign (resid   87 and  name HE1  )(resid   67 and  name HG2# ) 2.5 1.7 1.4
assign (resid   87 and  name HE1  )(resid   50 and  name HE1  ) 4.0 2.0 1.0
assign (resid   87 and  name HE1  )(resid   67 and  name HB   ) 3.0 1.2 0.5
assign (resid   87 and  name HE1  )(resid   87 and  name HB1  ) 4.0 2.2 1.0
assign (resid   87 and  name HE1  )(resid   87 and  name HB2  ) 4.0 2.2 1.0
assign (resid   87 and  name HE1  )(resid   48 and  name HB1  ) 4.0 2.2 1.0
!Trp-7
assign (resid    7 and  name HZ3  )(resid  135 and  name HA   ) 2.5 0.7 0.2
assign (resid    7 and  name HZ3  )(resid  118 and  name HA   ) 2.5 0.7 0.2
!assign (resid    7 and  name HD1  )(resid    3 and  name HA   ) 4.0 2.2 1.0
!assign (resid    7 and  name HZ3  )(resid  136 and  name HB2  ) 2.5 0.7 0.3
assign (resid    7 and  name HZ3  )(resid  136 and  name HB2  ) 3.0 1.2 0.5
assign (resid    7 and  name HZ3  )(resid  136 and  name HB1  ) 4.0 2.2 1.0
assign (resid    7 and  name HZ3  )(resid  136 and  name HG#  ) 3.0 2.2 1.5
assign (resid    7 and  name HH2  )(resid  119 and  name HG   ) 4.0 2.2 1.0
assign (resid    7 and  name HZ2  )(resid    3 and  name HA   ) 3.0 1.2 0.3
assign (resid    7 and  name HZ2  )(resid  119 and  name HG   ) 4.0 2.2 1.0
assign (resid    7 and  name HZ2  )(resid  113 and  name HD2# ) 3.0 2.2 1.3
assign (resid    7 and  name HZ2  )(resid  113 and  name HD1# ) 4.5 3.5 1.5
assign (resid    7 and  name HE3  )(resid  134 and  name HA   ) 4.0 2.2 1.0
assign (resid    7 and  name HE3  )(resid  135 and  name HA   ) 3.0 1.2 0.3
assign (resid    7 and  name HE3  )(resid    7 and  name HA   ) 3.0 1.2 0.3
assign (resid    7 and  name HE3  )(resid  118 and  name HA   ) 4.0 2.2 1.0
assign (resid    7 and  name HE3  )(resid  136 and  name HA   ) 4.0 2.2 1.0
assign (resid    7 and  name HE3  )(resid  134 and  name HB1  ) 3.0 1.2 0.3
assign (resid    7 and  name HE3  )(resid  134 and  name HB2  ) 3.0 1.2 0.5
assign (resid    7 and  name HE3  )(resid    7 and  name HB1  ) 3.0 1.2 0.3
assign (resid    7 and  name HE3  )(resid    7 and  name HB2  ) 4.0 2.2 1.0
assign (resid    7 and  name HE3  )(resid  136 and  name HB2  ) 4.0 2.2 1.0
assign (resid    7 and  name HE3  )(resid  136 and  name HG#  ) 4.0 3.2 2.0
assign (resid    7 and  name HD1  )(resid   42 and  name HA   ) 3.0 1.2 0.3
assign (resid    7 and  name HD1  )(resid    6 and  name HA   ) 3.0 1.2 0.3
assign (resid    7 and  name HD1  )(resid    7 and  name HA   ) 4.0 2.0 1.0
assign (resid    7 and  name HD1  )(resid    7 and  name HB1  ) 4.0 2.0 1.0
assign (resid    7 and  name HD1  )(resid    7 and  name HB2  ) 3.0 1.2 0.3
assign (resid    7 and  name HD1  )(resid  136 and  name HA   ) 4.0 2.2 1.2
assign (resid    7 and  name HD1  )(resid    3 and  name HB1  ) 4.0 2.5 2.0
assign (resid    7 and  name HD1  )(resid   41 and  name HG1# ) 3.0 2.2 1.8
assign (resid    7 and  name HE1  )(resid    5 and  name HA1  ) 3.0 1.2 1.0
assign (resid    7 and  name HE1  )(resid    5 and  name HA2  ) 4.0 2.2 1.0
assign (resid    7 and  name HE1  )(resid    5 and  name HN   ) 2.5 0.7 0.4
assign (resid    7 and  name HE1  )(resid    4 and  name HA   ) 4.0 2.2 1.0
assign (resid    7 and  name HE1  )(resid    3 and  name HA   ) 4.5 2.0 0.5
assign (resid    7 and  name HE1  )(resid    3 and  name HB1  ) 4.0 2.2 1.0
assign (resid    7 and  name HE1  )(resid  136 and  name HD#  ) 4.0 2.2 2.0
assign (resid    7 and  name HE1  )(resid   43 and  name HD1# ) 2.5 1.7 1.4
assign (resid    7 and  name HE1  )(resid   43 and  name HG2# ) 2.5 1.7 1.9
assign (resid    7 and  name HE1  )(resid   43 and  name HB   ) 2.5 0.7 0.2
assign (resid    7 and  name HE1  )(resid   43 and  name HG1# ) 4.5 3.0 1.5
assign (resid    7 and  name HE1  )(resid   41 and  name HG1# ) 4.0 3.2 2.0
assign (resid    7 and  name HE1  )(resid  119 and  name HD1# ) 3.0 2.2 2.0
!Trp-109
assign (resid  109 and  name HE3  )(resid  109 and  name HA   ) 4.0 2.2 1.0
assign (resid  109 and  name HE3  )(resid  110 and  name HA   ) 3.0 1.2 0.3
assign (resid  109 and  name HE3  )(resid   94 and  name HA   ) 4.0 2.2 1.0
assign (resid  109 and  name HE3  )(resid  109 and  name HB1  ) 4.0 2.2 1.0
assign (resid  109 and  name HE3  )(resid  109 and  name HB2  ) 4.0 2.2 1.0
assign (resid  109 and  name HE3  )(resid  111 and  name HG#  ) 3.0 2.2 1.3
assign (resid  109 and  name HD1  )(resid  109 and  name HA   ) 4.0 2.2 1.0
assign (resid  109 and  name HD1  )(resid  123 and  name HA   ) 4.0 2.2 1.0
assign (resid  109 and  name HD1  )(resid  108 and  name HA   ) 4.0 2.2 1.0
assign (resid  109 and  name HD1  )(resid  109 and  name HB1  ) 2.5 0.7 0.2
assign (resid  109 and  name HD1  )(resid  109 and  name HB2  ) 4.0 2.2 1.0
assign (resid  109 and  name HD1  )(resid  108 and  name HB#  ) 4.0 3.0 2.0
assign (resid  109 and  name HE1  )(resid   95 and  name HB1  ) 3.0 1.2 1.0
assign (resid  109 and  name HE1  )(resid   95 and  name HB2  ) 4.0 2.2 1.0
assign (resid  109 and  name HZ2  )(resid   63 and  name HG2# ) 4.0 3.0 2.0
assign (resid  109 and  name HZ2  )(resid   63 and  name HD1# ) 3.0 2.2 1.3
assign (resid  109 and  name HZ2  )(resid   95 and  name HB1  ) 4.0 2.2 1.0
assign (resid  109 and  name HZ2  )(resid   95 and  name HB2  ) 4.0 2.2 1.0
assign (resid  109 and  name HZ2  )(resid   85 and  name HG2# ) 3.0 2.2 1.3
assign (resid  109 and  name HH2  )(resid   65 and  name HZ   ) 3.0 1.2 0.5
assign (resid  109 and  name HH2  )(resid   85 and  name HG2# ) 2.5 1.7 1.4
assign (resid  109 and  name HH2  )(resid   85 and  name HG1# ) 3.0 2.2 1.3
assign (resid  109 and  name HZ3  )(resid   85 and  name HG1# ) 4.0 3.0 2.0
assign (resid  109 and  name HH2  )(resid   52 and  name HD1# ) 4.0 3.0 2.0
assign (resid  109 and  name HZ3  )(resid   52 and  name HD1# ) 4.0 3.0 2.0
assign (resid  109 and  name HZ3  )(resid  111 and  name HG#  ) 3.0 2.2 1.3
assign (resid  109 and  name HZ2  )(resid   65 and  name HD2  ) 4.0 2.2 1.0
assign (resid  109 and  name HZ2  )(resid   65 and  name HZ   ) 4.0 2.2 1.0
assign (resid  109 and  name HH2  )(resid   65 and  name HE2  ) 3.0 1.2 0.3
!hbonds
assign (resid    8 and  name N    )(resid  135 and  name O    ) 3.3 0.8 0.2
assign (resid  121 and  name N    )(resid  132 and  name O    ) 3.3 0.8 0.2
assign (resid  134 and  name N    )(resid  119 and  name O    ) 3.3 0.8 0.2
assign (resid  130 and  name N    )(resid  123 and  name O    ) 3.3 0.8 0.2
assign (resid   44 and  name N    )(resid   51 and  name O    ) 3.3 0.8 0.2
assign (resid  110 and  name N    )(resid  122 and  name O    ) 3.3 0.8 0.2
assign (resid  132 and  name N    )(resid  121 and  name O    ) 3.3 0.8 0.2
assign (resid  120 and  name N    )(resid  112 and  name O    ) 3.3 0.8 0.2
assign (resid    7 and  name N    )(resid   41 and  name O    ) 3.3 0.8 0.2
assign (resid    7 and  name NE1  )(resid    3 and  name O    ) 3.3 0.8 0.2
assign (resid   53 and  name N    )(resid   42 and  name O    ) 3.3 0.8 0.2
assign (resid   43 and  name N    )(resid    5 and  name O    ) 3.3 0.8 0.2
assign (resid  123 and  name N    )(resid  130 and  name O    ) 3.3 0.8 0.2
assign (resid  135 and  name N    )(resid    8 and  name O    ) 3.3 0.8 0.2
assign (resid   42 and  name N    )(resid   53 and  name O    ) 3.3 0.8 0.2
assign (resid   50 and  name N    )(resid   65 and  name O    ) 3.3 0.8 0.2
assign (resid  112 and  name N    )(resid  120 and  name O    ) 3.3 0.8 0.2
assign (resid  122 and  name N    )(resid  110 and  name O    ) 3.3 0.8 0.2
assign (resid   94 and  name N    )(resid   86 and  name O    ) 3.3 0.8 0.2
assign (resid  111 and  name N    )(resid   93 and  name O    ) 3.3 0.8 0.2
assign (resid   93 and  name N    )(resid  111 and  name O    ) 3.3 0.8 0.2
assign (resid  125 and  name N    )(resid  128 and  name O    ) 3.3 0.8 0.2
assign (resid   86 and  name N    )(resid   94 and  name O    ) 3.3 0.8 0.2
assign (resid   51 and  name N    )(resid   44 and  name O    ) 3.3 0.8 0.2
assign (resid   65 and  name N    )(resid   50 and  name O    ) 3.3 0.8 0.2
assign (resid  109 and  name N    )(resid   95 and  name O    ) 3.3 0.8 0.2
assign (resid   95 and  name N    )(resid  109 and  name O    ) 3.3 0.8 0.2
assign (resid  113 and  name N    )(resid   91 and  name O    ) 3.3 0.8 0.2
assign (resid   92 and  name N    )(resid   89 and  name OG   ) 3.3 0.8 0.2
assign (resid   41 and  name N    )(resid    7 and  name O    ) 3.3 0.8 0.2
assign (resid   18 and  name N    )(resid   14 and  name O    ) 3.3 0.8 0.2
assign (resid   19 and  name N    )(resid   15 and  name O    ) 3.3 0.8 0.2
assign (resid   20 and  name N    )(resid   16 and  name O    ) 3.3 0.8 0.2
assign (resid   21 and  name N    )(resid   17 and  name O    ) 3.3 0.8 0.2
assign (resid   52 and  name N    )(resid   63 and  name O    ) 3.3 0.8 0.2
assign (resid   63 and  name N    )(resid   52 and  name O    ) 3.3 0.8 0.2
assign (resid  124 and  name N    )(resid  108 and  name O    ) 3.3 0.8 0.2
assign (resid  108 and  name N    )(resid  124 and  name O    ) 3.3 0.8 0.2
assign (resid   83 and  name N    )(resid   71 and  name O    ) 3.3 0.8 0.2
assign (resid   71 and  name N    )(resid   83 and  name O    ) 3.3 0.8 0.2
assign (resid   10 and  name N    )(resid  133 and  name O    ) 3.3 0.8 0.2
assign (resid   96 and  name N    )(resid   84 and  name O    ) 3.3 0.8 0.2
assign (resid   84 and  name N    )(resid   96 and  name O    ) 3.3 0.8 0.2
assign (resid  128 and  name N    )(resid  125 and  name O    ) 3.3 0.8 0.2
assign (resid  107 and  name N    )(resid   97 and  name O    ) 3.3 0.8 0.2
assign (resid   97 and  name N    )(resid  107 and  name O    ) 3.3 0.8 0.2
assign (resid   73 and  name N    )(resid   81 and  name O    ) 3.3 0.8 0.2
assign (resid   81 and  name N    )(resid   73 and  name O    ) 3.3 0.8 0.2
assign (resid   54 and  name N    )(resid   61 and  name O    ) 3.3 0.8 0.2
assign (resid   61 and  name N    )(resid   54 and  name O    ) 3.3 0.8 0.2
assign (resid  131 and  name N    )(resid   13 and  name O    ) 3.3 0.8 0.2
assign (resid   13 and  name N    )(resid  131 and  name O    ) 3.3 0.8 0.2
assign (resid    8 and  name HN   )(resid  135 and  name O    ) 2.3 0.8 0.2
assign (resid  121 and  name HN   )(resid  132 and  name O    ) 2.3 0.8 0.2
assign (resid  134 and  name HN   )(resid  119 and  name O    ) 2.3 0.8 0.2
assign (resid  130 and  name HN   )(resid  123 and  name O    ) 2.3 0.8 0.2
assign (resid   44 and  name HN   )(resid   51 and  name O    ) 2.3 0.8 0.2
assign (resid  110 and  name HN   )(resid  122 and  name O    ) 2.3 0.8 0.2
assign (resid  132 and  name HN   )(resid  121 and  name O    ) 2.3 0.8 0.2
assign (resid  120 and  name HN   )(resid  112 and  name O    ) 2.3 0.8 0.2
assign (resid    7 and  name HN   )(resid   41 and  name O    ) 2.3 0.8 0.2
assign (resid    7 and  name HE1  )(resid    3 and  name O    ) 2.3 0.8 0.2
assign (resid   53 and  name HN   )(resid   42 and  name O    ) 2.3 0.8 0.2
assign (resid   43 and  name HN   )(resid    5 and  name O    ) 2.3 0.8 0.2
assign (resid  123 and  name HN   )(resid  130 and  name O    ) 2.3 0.8 0.2
assign (resid  135 and  name HN   )(resid    8 and  name O    ) 2.3 0.8 0.2
assign (resid   42 and  name HN   )(resid   53 and  name O    ) 2.3 0.8 0.2
assign (resid   50 and  name HN   )(resid   65 and  name O    ) 2.3 0.8 0.2
assign (resid  112 and  name HN   )(resid  120 and  name O    ) 2.3 0.8 0.2
assign (resid  122 and  name HN   )(resid  110 and  name O    ) 2.3 0.8 0.2
assign (resid   94 and  name HN   )(resid   86 and  name O    ) 2.3 0.8 0.2
assign (resid  111 and  name HN   )(resid   93 and  name O    ) 2.3 0.8 0.2
assign (resid   93 and  name HN   )(resid  111 and  name O    ) 2.3 0.8 0.2
assign (resid  125 and  name HN   )(resid  128 and  name O    ) 2.3 0.8 0.2
assign (resid  128 and  name HN   )(resid  125 and  name O    ) 2.3 0.8 0.2
assign (resid   86 and  name HN   )(resid   94 and  name O    ) 2.3 0.8 0.2
assign (resid   51 and  name HN   )(resid   44 and  name O    ) 2.3 0.8 0.2
assign (resid   65 and  name HN   )(resid   50 and  name O    ) 2.3 0.8 0.2
assign (resid  109 and  name HN   )(resid   95 and  name O    ) 2.3 0.8 0.2
assign (resid   95 and  name HN   )(resid  109 and  name O    ) 2.3 0.8 0.2
assign (resid  113 and  name HN   )(resid   91 and  name O    ) 2.3 0.8 0.2
assign (resid   92 and  name HN   )(resid   89 and  name OG   ) 2.3 0.8 0.2
assign (resid   41 and  name HN   )(resid    7 and  name O    ) 2.3 0.8 0.2
assign (resid   18 and  name HN   )(resid   14 and  name O    ) 2.3 0.8 0.2
assign (resid   19 and  name HN   )(resid   15 and  name O    ) 2.3 0.8 0.2
assign (resid   20 and  name HN   )(resid   16 and  name O    ) 2.3 0.8 0.2
assign (resid   21 and  name HN   )(resid   17 and  name O    ) 2.3 0.8 0.2
assign (resid   52 and  name HN   )(resid   63 and  name O    ) 2.3 0.8 0.2
assign (resid   63 and  name HN   )(resid   52 and  name O    ) 2.3 0.8 0.2
assign (resid  124 and  name HN   )(resid  108 and  name O    ) 2.3 0.8 0.2
assign (resid  108 and  name HN   )(resid  124 and  name O    ) 2.3 0.8 0.2
assign (resid   83 and  name HN   )(resid   71 and  name O    ) 2.3 0.8 0.2
assign (resid   71 and  name HN   )(resid   83 and  name O    ) 2.3 0.8 0.2
assign (resid   10 and  name HN   )(resid  133 and  name O    ) 2.3 0.8 0.2
assign (resid   96 and  name HN   )(resid   84 and  name O    ) 2.3 0.8 0.2
assign (resid   84 and  name HN   )(resid   96 and  name O    ) 2.3 0.8 0.2
assign (resid  107 and  name HN   )(resid   97 and  name O    ) 2.3 0.8 0.2
assign (resid   97 and  name HN   )(resid  107 and  name O    ) 2.3 0.8 0.2
assign (resid   73 and  name HN   )(resid   81 and  name O    ) 2.3 0.8 0.2
assign (resid   81 and  name HN   )(resid   73 and  name O    ) 2.3 0.8 0.2
assign (resid   54 and  name HN   )(resid   61 and  name O    ) 2.3 0.8 0.2
assign (resid   61 and  name HN   )(resid   54 and  name O    ) 2.3 0.8 0.2
set message=on echo=on end

  Entry H atom name         Submitted Coord H atom name

  Start of MODEL    1
    1   1H    PRO   1          1H        PRO   1  16.593   7.409   7.409
    2   2H    PRO   1          2H        PRO   1  16.147   6.714   6.714
    3    HA   PRO   1           HA       PRO   1  16.667   4.699   4.699
    4   1HB   PRO   1          2HB       PRO   1  19.310   5.043   5.043
    5   2HB   PRO   1          1HB       PRO   1  18.843   4.332   4.332
    6   1HG   PRO   1          2HG       PRO   1  20.085   6.869   6.869
    7   2HG   PRO   1          1HG       PRO   1  19.609   6.157   6.157
    8   1HD   PRO   1          1HD       PRO   1  18.371   8.336   8.336
    9   2HD   PRO   1          2HD       PRO   1  17.904   7.623   7.623
   10    H    ASN   2           H        ASN   2  15.317   6.338   6.338
   11    HA   ASN   2           HA       ASN   2  15.943   4.938   4.938
   12   1HB   ASN   2          2HB       ASN   2  16.682   7.810   7.810
   13   2HB   ASN   2          1HB       ASN   2  16.006   7.335   7.335
   14   1HD2  ASN   2          2HD2      ASN   2  19.781   6.817   6.817
   15   2HD2  ASN   2          1HD2      ASN   2  18.818   8.143   8.143
   16    H    PHE   3           H        PHE   3  13.988   4.481   4.481
   17    HA   PHE   3           HA       PHE   3  11.664   6.178   6.178
   18   1HB   PHE   3          2HB       PHE   3  11.849   3.432   3.432
   19   2HB   PHE   3          1HB       PHE   3  10.353   4.256   4.256
   20    HD1  PHE   3           HD1      PHE   3  13.603   3.487   3.487
   21    HD2  PHE   3           HD2      PHE   3   9.313   3.521   3.521
   22    HE1  PHE   3           HE1      PHE   3  13.696   2.541   2.541
   23    HE2  PHE   3           HE2      PHE   3   9.412   2.566   2.566
   24    HZ   PHE   3           HZ       PHE   3  11.604   2.071   2.071
   25    H    SER   4           H        SER   4  13.867   5.710   5.710
   26    HA   SER   4           HA       SER   4  12.177   5.888   5.888
   27   1HB   SER   4          2HB       SER   4  14.577   5.191   5.191
   28   2HB   SER   4          1HB       SER   4  15.030   6.866   6.866
   29    HG   SER   4           HG       SER   4  14.471   7.383   7.383
   30    H    GLY   5           H        GLY   5  10.878   7.536   7.536
   31   1HA   GLY   5          2HA       GLY   5  11.576  10.115  10.115
   32   2HA   GLY   5          1HA       GLY   5  11.248  10.214  10.214
   33    H    ASN   6           H        ASN   6   9.465  11.672  11.672
   34    HA   ASN   6           HA       ASN   6   7.146  10.085  10.085
   35   1HB   ASN   6          2HB       ASN   6   7.827  13.023  13.023
   36   2HB   ASN   6          1HB       ASN   6   6.138  12.523  12.523
   37   1HD2  ASN   6          2HD2      ASN   6   6.821  10.759  10.759
   38   2HD2  ASN   6          1HD2      ASN   6   6.168  10.350  10.350
   39    H    TRP   7           H        TRP   7   5.005  10.761  10.761
   40    HA   TRP   7           HA       TRP   7   5.524  11.463  11.463
   41   1HB   TRP   7          2HB       TRP   7   4.426   8.790   8.790
   42   2HB   TRP   7          1HB       TRP   7   4.405   9.373   9.373
   43    HD1  TRP   7           HD1      TRP   7   6.620   7.762   7.762
   44    HE1  TRP   7           HE1      TRP   7   9.024   7.541   7.541
   45    HE3  TRP   7           HE3      TRP   7   6.178  10.683  10.683
   46    HZ2  TRP   7           HZ2      TRP   7  10.549   8.517   8.517
   47    HZ3  TRP   7           HZ3      TRP   7   8.111  11.056  11.056
   48    HH2  TRP   7           HH2      TRP   7  10.284   9.975   9.975
   49    H    LYS   8           H        LYS   8   4.027  12.852  12.852
   50    HA   LYS   8           HA       LYS   8   1.272  12.557  12.557
   51   1HB   LYS   8          2HB       LYS   8   2.781  15.026  15.026
   52   2HB   LYS   8          1HB       LYS   8   1.044  15.015  15.015
   53   1HG   LYS   8          2HG       LYS   8   1.768  13.918  13.918
   54   2HG   LYS   8          1HG       LYS   8   3.304  14.712  14.712
   55   1HD   LYS   8          2HD       LYS   8   2.463  16.773  16.773
   56   2HD   LYS   8          1HD       LYS   8   0.975  16.442  16.442
   57   1HE   LYS   8          2HE       LYS   8   0.337  14.950  14.950
   58   2HE   LYS   8          1HE       LYS   8   1.626  15.794  15.794
   59   1HZ   LYS   8          3HZ       LYS   8  -0.553  17.203  17.203
   60   2HZ   LYS   8          2HZ       LYS   8  -0.643  16.792  16.792
   61   3HZ   LYS   8          1HZ       LYS   8   0.561  17.859  17.859
   62    H    ILE   9           H        ILE   9   0.016  11.655  11.655
   63    HA   ILE   9           HA       ILE   9   0.676  11.338  11.338
   64    HB   ILE   9           HB       ILE   9  -1.011   9.973   9.973
   65   1HG1  ILE   9          2HG1      ILE   9  -2.266  11.738  11.738
   66   2HG1  ILE   9          1HG1      ILE   9  -1.228  10.347  10.347
   67   1HG2  ILE   9          2HG2      ILE   9  -2.487  12.594  12.594
   68   2HG2  ILE   9          1HG2      ILE   9  -3.271  11.025  11.025
   69   3HG2  ILE   9          3HG2      ILE   9  -1.962  11.491  11.491
   70   1HD1  ILE   9          2HD1      ILE   9  -3.289   9.510   9.510
   71   2HD1  ILE   9          1HD1      ILE   9  -4.052  10.377  10.377
   72   3HD1  ILE   9          3HD1      ILE   9  -3.016   8.990   8.990
   73    H    ILE  10           H        ILE  10  -0.169  12.319  12.319
   74    HA   ILE  10           HA       ILE  10  -1.223  15.091  15.091
   75    HB   ILE  10           HB       ILE  10   0.193  15.789  15.789
   76   1HG1  ILE  10          2HG1      ILE  10   2.207  13.946  13.946
   77   2HG1  ILE  10          1HG1      ILE  10   0.810  12.892  12.892
   78   1HG2  ILE  10          1HG2      ILE  10   1.480  14.643  14.643
   79   2HG2  ILE  10          3HG2      ILE  10   2.435  15.493  15.493
   80   3HG2  ILE  10          2HG2      ILE  10   1.128  16.330  16.330
   81   1HD1  ILE  10          3HD1      ILE  10  -0.325  14.275  14.275
   82   2HD1  ILE  10          2HD1      ILE  10   1.270  14.952  14.952
   83   3HD1  ILE  10          1HD1      ILE  10   0.990  13.221  13.221
   84    H    ARG  11           H        ARG  11  -1.031  12.147  12.147
   85    HA   ARG  11           HA       ARG  11  -3.567  12.946  12.946
   86   1HB   ARG  11          2HB       ARG  11  -0.954  12.399  12.399
   87   2HB   ARG  11          1HB       ARG  11  -2.339  11.577  11.577
   88   1HG   ARG  11          2HG       ARG  11  -3.465  13.961  13.961
   89   2HG   ARG  11          1HG       ARG  11  -1.790  14.514  14.514
   90   1HD   ARG  11          2HD       ARG  11  -1.544  12.912  12.912
   91   2HD   ARG  11          1HD       ARG  11  -3.295  13.100  13.100
   92    HE   ARG  11           HE       ARG  11  -1.666  15.573  15.573
   93   1HH1  ARG  11          2HH1      ARG  11  -3.905  16.613  16.613
   94   2HH1  ARG  11          1HH1      ARG  11  -4.067  16.273  16.273
   95   1HH2  ARG  11          1HH2      ARG  11  -1.727  13.715  13.715
   96   2HH2  ARG  11          2HH2      ARG  11  -2.835  14.632  14.632
   97    H    SER  12           H        SER  12  -4.574  10.926  10.926
   98    HA   SER  12           HA       SER  12  -3.711   8.295   8.295
   99   1HB   SER  12          2HB       SER  12  -3.953   8.636   8.636
  100   2HB   SER  12          1HB       SER  12  -5.372   9.657   9.657
  101    HG   SER  12           HG       SER  12  -6.321   7.815   7.815
  102    H    GLU  13           H        GLU  13  -5.273   6.722   6.722
  103    HA   GLU  13           HA       GLU  13  -7.914   7.684   7.684
  104   1HB   GLU  13          2HB       GLU  13  -7.524   6.670   6.670
  105   2HB   GLU  13          1HB       GLU  13  -6.529   8.092   8.092
  106   1HG   GLU  13          2HG       GLU  13  -5.091   5.841   5.841
  107   2HG   GLU  13          1HG       GLU  13  -5.678   5.420   5.420
  108    H    ASN  14           H        ASN  14  -9.179   5.712   5.712
  109    HA   ASN  14           HA       ASN  14 -10.035   3.567   3.567
  110   1HB   ASN  14          2HB       ASN  14  -7.198   2.845   2.845
  111   2HB   ASN  14          1HB       ASN  14  -8.461   1.751   1.751
  112   1HD2  ASN  14          2HD2      ASN  14  -6.177   3.375   3.375
  113   2HD2  ASN  14          1HD2      ASN  14  -5.751   3.223   3.223
  114    H    PHE  15           H        PHE  15  -9.871   5.509   5.509
  115    HA   PHE  15           HA       PHE  15  -9.135   4.056   4.056
  116   1HB   PHE  15          2HB       PHE  15  -9.245   6.605   6.605
  117   2HB   PHE  15          1HB       PHE  15 -10.990   6.433   6.433
  118    HD1  PHE  15           HD2      PHE  15 -10.125   3.853   3.853
  119    HD2  PHE  15           HD1      PHE  15  -9.693   8.123   8.123
  120    HE1  PHE  15           HE2      PHE  15  -9.954   3.860   3.860
  121    HE2  PHE  15           HE1      PHE  15  -9.516   8.118   8.118
  122    HZ   PHE  15           HZ       PHE  15  -9.650   5.976   5.976
  123    H    GLU  16           H        GLU  16 -12.344   5.215   5.215
  124    HA   GLU  16           HA       GLU  16 -13.836   3.673   3.673
  125   1HB   GLU  16          2HB       GLU  16 -14.592   5.608   5.608
  126   2HB   GLU  16          1HB       GLU  16 -14.874   4.329   4.329
  127   1HG   GLU  16          2HG       GLU  16 -16.639   3.448   3.448
  128   2HG   GLU  16          1HG       GLU  16 -15.940   3.861   3.861
  129    H    GLU  17           H        GLU  17 -12.642   2.862   2.862
  130    HA   GLU  17           HA       GLU  17 -14.137   0.424   0.424
  131   1HB   GLU  17          2HB       GLU  17 -12.499  -0.187  -0.187
  132   2HB   GLU  17          1HB       GLU  17 -13.210   1.410   1.410
  133   1HG   GLU  17          2HG       GLU  17 -11.254   2.491   2.491
  134   2HG   GLU  17          1HG       GLU  17 -10.562   0.952   0.952
  135    H    LEU  18           H        LEU  18 -11.106   1.261   1.261
  136    HA   LEU  18           HA       LEU  18 -10.312  -1.521  -1.521
  137   1HB   LEU  18          2HB       LEU  18  -8.622   0.304   0.304
  138   2HB   LEU  18          1HB       LEU  18  -9.318   1.003   1.003
  139    HG   LEU  18           HG       LEU  18  -8.877  -1.197  -1.197
  140   1HD1  LEU  18          2HD1      LEU  18  -7.784  -1.768  -1.768
  141   2HD1  LEU  18          1HD1      LEU  18  -6.888  -2.401  -2.401
  142   3HD1  LEU  18          3HD1      LEU  18  -8.577  -2.851  -2.851
  143   1HD2  LEU  18          3HD2      LEU  18  -7.204   0.959   0.959
  144   2HD2  LEU  18          2HD2      LEU  18  -6.906  -0.330  -0.330
  145   3HD2  LEU  18          1HD2      LEU  18  -6.187  -0.412  -0.412
  146    H    LEU  19           H        LEU  19 -12.356   0.774   0.774
  147    HA   LEU  19           HA       LEU  19 -12.302  -0.743  -0.743
  148   1HB   LEU  19          2HB       LEU  19 -14.206   1.508   1.508
  149   2HB   LEU  19          1HB       LEU  19 -13.643   0.996   0.996
  150    HG   LEU  19           HG       LEU  19 -12.191   2.595   2.595
  151   1HD1  LEU  19          3HD1      LEU  19 -13.429   3.179   3.179
  152   2HD1  LEU  19          2HD1      LEU  19 -11.709   3.164   3.164
  153   3HD1  LEU  19          1HD1      LEU  19 -12.315   4.220   4.220
  154   1HD2  LEU  19          3HD2      LEU  19 -11.025   0.576   0.576
  155   2HD2  LEU  19          2HD2      LEU  19 -10.394   1.201   1.201
  156   3HD2  LEU  19          1HD2      LEU  19 -10.218   2.140   2.140
  157    H    LYS  20           H        LYS  20 -14.034  -0.657  -0.657
  158    HA   LYS  20           HA       LYS  20 -16.445  -1.956  -1.956
  159   1HB   LYS  20          2HB       LYS  20 -15.643  -1.768  -1.768
  160   2HB   LYS  20          1HB       LYS  20 -17.264  -1.957  -1.957
  161   1HG   LYS  20          2HG       LYS  20 -16.130   0.411   0.411
  162   2HG   LYS  20          1HG       LYS  20 -15.875   0.465   0.465
  163   1HD   LYS  20          2HD       LYS  20 -18.530  -0.069  -0.069
  164   2HD   LYS  20          1HD       LYS  20 -18.050   1.466   1.466
  165   1HE   LYS  20          2HE       LYS  20 -17.547  -0.409  -0.409
  166   2HE   LYS  20          1HE       LYS  20 -19.072  -0.937  -0.937
  167   1HZ   LYS  20          1HZ       LYS  20 -18.478   1.819   1.819
  168   2HZ   LYS  20          3HZ       LYS  20 -19.402   0.678   0.678
  169   3HZ   LYS  20          2HZ       LYS  20 -19.955   1.278   1.278
  170    H    VAL  21           H        VAL  21 -13.410  -2.757  -2.757
  171    HA   VAL  21           HA       VAL  21 -14.077  -5.549  -5.549
  172    HB   VAL  21           HB       VAL  21 -12.339  -4.299  -4.299
  173   1HG1  VAL  21          1HG1      VAL  21 -11.471  -2.977  -2.977
  174   2HG1  VAL  21          3HG1      VAL  21 -10.738  -4.438  -4.438
  175   3HG1  VAL  21          2HG1      VAL  21 -10.192  -3.793  -3.793
  176   1HG2  VAL  21          3HG2      VAL  21 -11.570  -6.753  -6.753
  177   2HG2  VAL  21          2HG2      VAL  21 -12.123  -6.662  -6.662
  178   3HG2  VAL  21          1HG2      VAL  21 -10.510  -6.092  -6.092
  179    H    LEU  22           H        LEU  22 -12.346  -3.682  -3.682
  180    HA   LEU  22           HA       LEU  22 -11.446  -5.860  -5.860
  181   1HB   LEU  22          2HB       LEU  22 -11.725  -2.918  -2.918
  182   2HB   LEU  22          1HB       LEU  22 -11.793  -3.762  -3.762
  183    HG   LEU  22           HG       LEU  22  -9.635  -4.764  -4.764
  184   1HD1  LEU  22          3HD1      LEU  22  -9.922  -5.214  -5.214
  185   2HD1  LEU  22          2HD1      LEU  22  -9.727  -3.495  -3.495
  186   3HD1  LEU  22          1HD1      LEU  22  -8.384  -4.422  -4.422
  187   1HD2  LEU  22          1HD2      LEU  22  -9.962  -2.164  -2.164
  188   2HD2  LEU  22          3HD2      LEU  22  -8.353  -2.846  -2.846
  189   3HD2  LEU  22          2HD2      LEU  22  -9.157  -2.011  -2.011
  190    H    GLY  23           H        GLY  23 -14.214  -3.671  -3.671
  191   1HA   GLY  23          2HA       GLY  23 -15.492  -5.498  -5.498
  192   2HA   GLY  23          1HA       GLY  23 -15.954  -3.820  -3.820
  193    H    VAL  24           H        VAL  24 -18.098  -4.135  -4.135
  194    HA   VAL  24           HA       VAL  24 -18.694  -5.030  -5.030
  195    HB   VAL  24           HB       VAL  24 -20.508  -6.675  -6.675
  196   1HG1  VAL  24          2HG1      VAL  24 -18.351  -7.068  -7.068
  197   2HG1  VAL  24          1HG1      VAL  24 -17.706  -7.747  -7.747
  198   3HG1  VAL  24          3HG1      VAL  24 -19.159  -8.436  -8.436
  199   1HG2  VAL  24          3HG2      VAL  24 -19.832  -6.117  -6.117
  200   2HG2  VAL  24          2HG2      VAL  24 -19.762  -7.840  -7.840
  201   3HG2  VAL  24          1HG2      VAL  24 -18.278  -6.888  -6.888
  202    H    ASN  25           H        ASN  25 -19.844  -4.023  -4.023
  203    HA   ASN  25           HA       ASN  25 -22.501  -3.289  -3.289
  204   1HB   ASN  25          2HB       ASN  25 -21.152  -3.345  -3.345
  205   2HB   ASN  25          1HB       ASN  25 -21.020  -1.627  -1.627
  206   1HD2  ASN  25          2HD2      ASN  25 -24.292  -1.002  -1.002
  207   2HD2  ASN  25          1HD2      ASN  25 -22.719  -0.423  -0.423
  208    H    VAL  26           H        VAL  26 -22.594  -0.513  -0.513
  209    HA   VAL  26           HA       VAL  26 -21.194   0.715   0.715
  210    HB   VAL  26           HB       VAL  26 -23.267   2.389   2.389
  211   1HG1  VAL  26          3HG1      VAL  26 -22.853  -0.114  -0.114
  212   2HG1  VAL  26          2HG1      VAL  26 -24.475   0.578   0.578
  213   3HG1  VAL  26          1HG1      VAL  26 -23.095   1.538   1.538
  214   1HG2  VAL  26          2HG2      VAL  26 -24.280  -0.290  -0.290
  215   2HG2  VAL  26          1HG2      VAL  26 -24.326   1.250   1.250
  216   3HG2  VAL  26          3HG2      VAL  26 -25.327   1.008   1.008
  217    H    MET  27           H        MET  27 -22.655   1.422   1.422
  218    HA   MET  27           HA       MET  27 -21.316   3.971   3.971
  219   1HB   MET  27          2HB       MET  27 -23.361   2.841   2.841
  220   2HB   MET  27          1HB       MET  27 -22.055   2.393   2.393
  221   1HG   MET  27          2HG       MET  27 -21.599   4.580   4.580
  222   2HG   MET  27          1HG       MET  27 -22.120   5.209   5.209
  223   1HE   MET  27          1HE       MET  27 -22.514   6.119   6.119
  224   2HE   MET  27          3HE       MET  27 -23.374   7.192   7.192
  225   3HE   MET  27          2HE       MET  27 -24.204   6.523   6.523
  226    H    LEU  28           H        LEU  28 -20.435   0.662   0.662
  227    HA   LEU  28           HA       LEU  28 -18.304   0.947   0.947
  228   1HB   LEU  28          2HB       LEU  28 -19.295  -1.034  -1.034
  229   2HB   LEU  28          1HB       LEU  28 -17.546  -1.085  -1.085
  230    HG   LEU  28           HG       LEU  28 -18.702  -2.558  -2.558
  231   1HD1  LEU  28          2HD1      LEU  28 -16.572  -1.027  -1.027
  232   2HD1  LEU  28          1HD1      LEU  28 -17.656  -0.300  -0.300
  233   3HD1  LEU  28          3HD1      LEU  28 -17.280  -2.021  -2.021
  234   1HD2  LEU  28          3HD2      LEU  28 -20.760  -1.111  -1.111
  235   2HD2  LEU  28          2HD2      LEU  28 -20.128  -1.620  -1.620
  236   3HD2  LEU  28          1HD2      LEU  28 -19.827   0.017   0.017
  237    H    ARG  29           H        ARG  29 -18.496   1.653   1.653
  238    HA   ARG  29           HA       ARG  29 -15.571   1.898   1.898
  239   1HB   ARG  29          2HB       ARG  29 -17.669   2.750   2.750
  240   2HB   ARG  29          1HB       ARG  29 -15.975   2.375   2.375
  241   1HG   ARG  29          2HG       ARG  29 -16.540   0.232   0.232
  242   2HG   ARG  29          1HG       ARG  29 -17.097   0.103   0.103
  243   1HD   ARG  29          2HD       ARG  29 -18.842  -0.453  -0.453
  244   2HD   ARG  29          1HD       ARG  29 -19.319   0.785   0.785
  245    HE   ARG  29           HE       ARG  29 -18.131   2.089   2.089
  246   1HH1  ARG  29          1HH2      ARG  29 -20.268  -0.388  -0.388
  247   2HH1  ARG  29          2HH2      ARG  29 -21.564   0.569   0.569
  248   1HH2  ARG  29          2HH1      ARG  29 -20.070   3.596   3.596
  249   2HH2  ARG  29          1HH1      ARG  29 -21.454   2.825   2.825
  250    H    LYS  30           H        LYS  30 -18.405   4.059   4.059
  251    HA   LYS  30           HA       LYS  30 -16.968   6.473   6.473
  252   1HB   LYS  30          2HB       LYS  30 -19.538   6.004   6.004
  253   2HB   LYS  30          1HB       LYS  30 -19.455   6.377   6.377
  254   1HG   LYS  30          2HG       LYS  30 -18.788   8.588   8.588
  255   2HG   LYS  30          1HG       LYS  30 -18.183   8.233   8.233
  256   1HD   LYS  30          2HD       LYS  30 -20.269   8.364   8.364
  257   2HD   LYS  30          1HD       LYS  30 -21.088   7.779   7.779
  258   1HE   LYS  30          2HE       LYS  30 -21.535   9.890   9.890
  259   2HE   LYS  30          1HE       LYS  30 -19.818  10.290  10.290
  260   1HZ   LYS  30          3HZ       LYS  30 -21.502  10.192  10.192
  261   2HZ   LYS  30          2HZ       LYS  30 -21.281  11.611  11.611
  262   3HZ   LYS  30          1HZ       LYS  30 -19.951  10.858  10.858
  263    H    ILE  31           H        ILE  31 -17.379   4.551   4.551
  264    HA   ILE  31           HA       ILE  31 -16.627   6.706   6.706
  265    HB   ILE  31           HB       ILE  31 -16.677   3.692   3.692
  266   1HG1  ILE  31          2HG1      ILE  31 -18.555   5.773   5.773
  267   2HG1  ILE  31          1HG1      ILE  31 -18.852   5.006   5.006
  268   1HG2  ILE  31          3HG2      ILE  31 -16.141   5.976   5.976
  269   2HG2  ILE  31          2HG2      ILE  31 -16.687   4.394   4.394
  270   3HG2  ILE  31          1HG2      ILE  31 -15.148   4.547   4.547
  271   1HD1  ILE  31          3HD1      ILE  31 -18.396   3.462   3.462
  272   2HD1  ILE  31          2HD1      ILE  31 -19.994   3.866   3.866
  273   3HD1  ILE  31          1HD1      ILE  31 -18.924   2.814   2.814
  274    H    ALA  32           H        ALA  32 -14.974   4.258   4.258
  275    HA   ALA  32           HA       ALA  32 -12.405   4.679   4.679
  276   1HB   ALA  32          2HB       ALA  32 -13.318   3.069   3.069
  277   2HB   ALA  32          1HB       ALA  32 -11.602   3.284   3.284
  278   3HB   ALA  32          3HB       ALA  32 -12.646   2.494   2.494
  279    H    VAL  33           H        VAL  33 -14.143   5.953   5.953
  280    HA   VAL  33           HA       VAL  33 -11.830   7.186   7.186
  281    HB   VAL  33           HB       VAL  33 -14.728   7.995   7.995
  282   1HG1  VAL  33          2HG1      VAL  33 -12.659   9.231   9.231
  283   2HG1  VAL  33          1HG1      VAL  33 -12.600   7.853   7.853
  284   3HG1  VAL  33          3HG1      VAL  33 -14.039   8.871   8.871
  285   1HG2  VAL  33          3HG2      VAL  33 -13.765   5.393   5.393
  286   2HG2  VAL  33          2HG2      VAL  33 -15.226   6.058   6.058
  287   3HG2  VAL  33          1HG2      VAL  33 -13.708   6.078   6.078
  288    H    ALA  34           H        ALA  34 -14.345   8.082   8.082
  289    HA   ALA  34           HA       ALA  34 -13.503  10.869  10.869
  290   1HB   ALA  34          1HB       ALA  34 -15.847  10.153  10.153
  291   2HB   ALA  34          3HB       ALA  34 -15.249   9.267   9.267
  292   3HB   ALA  34          2HB       ALA  34 -15.115  11.024  11.024
  293    H    ALA  35           H        ALA  35 -12.920   7.862   7.862
  294    HA   ALA  35           HA       ALA  35 -11.558   8.945   8.945
  295   1HB   ALA  35          3HB       ALA  35 -11.264   6.262   6.262
  296   2HB   ALA  35          2HB       ALA  35 -10.595   6.651   6.651
  297   3HB   ALA  35          1HB       ALA  35 -12.342   6.623   6.623
  298    H    ALA  36           H        ALA  36 -10.471   7.910   7.910
  299    HA   ALA  36           HA       ALA  36  -7.671   8.211   8.211
  300   1HB   ALA  36          1HB       ALA  36  -9.472   7.886   7.886
  301   2HB   ALA  36          3HB       ALA  36  -8.118   8.951   8.951
  302   3HB   ALA  36          2HB       ALA  36  -7.816   7.314   7.314
  303    H    SER  37           H        SER  37  -9.726  10.461  10.461
  304    HA   SER  37           HA       SER  37  -9.446  12.778  12.778
  305   1HB   SER  37          2HB       SER  37 -10.334  12.343  12.343
  306   2HB   SER  37          1HB       SER  37  -8.805  13.125  13.125
  307    HG   SER  37           HG       SER  37 -10.572  14.600  14.600
  308    H    LYS  38           H        LYS  38  -7.120  11.447  11.447
  309    HA   LYS  38           HA       LYS  38  -4.846  11.894  11.894
  310   1HB   LYS  38          2HB       LYS  38  -5.240  14.468  14.468
  311   2HB   LYS  38          1HB       LYS  38  -4.013  14.117  14.117
  312   1HG   LYS  38          2HG       LYS  38  -6.204  13.652  13.652
  313   2HG   LYS  38          1HG       LYS  38  -6.882  14.828  14.828
  314   1HD   LYS  38          2HD       LYS  38  -4.561  16.073  16.073
  315   2HD   LYS  38          1HD       LYS  38  -4.784  15.188  15.188
  316   1HE   LYS  38          2HE       LYS  38  -7.211  16.096  16.096
  317   2HE   LYS  38          1HE       LYS  38  -6.597  17.245  17.245
  318   1HZ   LYS  38          1HZ       LYS  38  -5.350  16.835  16.835
  319   2HZ   LYS  38          3HZ       LYS  38  -6.532  18.015  18.015
  320   3HZ   LYS  38          2HZ       LYS  38  -5.042  18.084  18.084
  321    HA   PRO  39           HA       PRO  39  -4.226  10.506  10.506
  322   1HB   PRO  39          2HB       PRO  39  -3.382   7.979   7.979
  323   2HB   PRO  39          1HB       PRO  39  -5.073   8.407   8.407
  324   1HG   PRO  39          2HG       PRO  39  -3.710   7.898   7.898
  325   2HG   PRO  39          1HG       PRO  39  -5.413   7.682   7.682
  326   1HD   PRO  39          2HD       PRO  39  -4.367   9.840   9.840
  327   2HD   PRO  39          1HD       PRO  39  -5.964   9.795   9.795
  328    H    ALA  40           H        ALA  40  -2.140  10.054  10.054
  329    HA   ALA  40           HA       ALA  40   0.148  10.886  10.886
  330   1HB   ALA  40          2HB       ALA  40  -0.254  10.815  10.815
  331   2HB   ALA  40          1HB       ALA  40   1.290  11.200  11.200
  332   3HB   ALA  40          3HB       ALA  40  -0.108  12.241  12.241
  333    H    VAL  41           H        VAL  41   2.299   9.811   9.811
  334    HA   VAL  41           HA       VAL  41   2.030   7.040   7.040
  335    HB   VAL  41           HB       VAL  41   2.660   7.788   7.788
  336   1HG1  VAL  41          3HG1      VAL  41   3.481   5.264   5.264
  337   2HG1  VAL  41          2HG1      VAL  41   3.488   5.442   5.442
  338   3HG1  VAL  41          1HG1      VAL  41   4.556   6.435   6.435
  339   1HG2  VAL  41          3HG2      VAL  41   0.802   5.913   5.913
  340   2HG2  VAL  41          2HG2      VAL  41   0.418   7.133   7.133
  341   3HG2  VAL  41          1HG2      VAL  41   1.215   5.633   5.633
  342    H    GLU  42           H        GLU  42   4.198   6.059   6.059
  343    HA   GLU  42           HA       GLU  42   6.487   7.931   7.931
  344   1HB   GLU  42          2HB       GLU  42   5.558   8.376   8.376
  345   2HB   GLU  42          1HB       GLU  42   5.571   6.653   6.653
  346   1HG   GLU  42          2HG       GLU  42   8.033   6.626   6.626
  347   2HG   GLU  42          1HG       GLU  42   8.010   8.354   8.354
  348    H    ILE  43           H        ILE  43   7.928   6.712   6.712
  349    HA   ILE  43           HA       ILE  43   7.947   3.777   3.777
  350    HB   ILE  43           HB       ILE  43   9.066   5.533   5.533
  351   1HG1  ILE  43          2HG1      ILE  43   7.467   3.261   3.261
  352   2HG1  ILE  43          1HG1      ILE  43   6.602   4.186   4.186
  353   1HG2  ILE  43          1HG2      ILE  43   9.841   2.806   2.806
  354   2HG2  ILE  43          3HG2      ILE  43   9.448   2.971   2.971
  355   3HG2  ILE  43          2HG2      ILE  43  10.713   3.970   3.970
  356   1HD1  ILE  43          2HD1      ILE  43   7.912   5.878   5.878
  357   2HD1  ILE  43          1HD1      ILE  43   6.693   4.804   4.804
  358   3HD1  ILE  43          3HD1      ILE  43   6.255   5.926   5.926
  359    H    LYS  44           H        LYS  44   9.660   2.752   2.752
  360    HA   LYS  44           HA       LYS  44  12.032   4.414   4.414
  361   1HB   LYS  44          2HB       LYS  44  11.780   1.942   1.942
  362   2HB   LYS  44          1HB       LYS  44  11.933   3.595   3.595
  363   1HG   LYS  44          2HG       LYS  44   9.539   3.950   3.950
  364   2HG   LYS  44          1HG       LYS  44   9.328   2.414   2.414
  365   1HD   LYS  44          2HD       LYS  44   9.699   1.160   1.160
  366   2HD   LYS  44          1HD       LYS  44  10.605   2.455   2.455
  367   1HE   LYS  44          2HE       LYS  44   7.946   3.391   3.391
  368   2HE   LYS  44          1HE       LYS  44   7.845   1.856   1.856
  369   1HZ   LYS  44          2HZ       LYS  44   9.423   2.769   2.769
  370   2HZ   LYS  44          1HZ       LYS  44   9.358   4.268   4.268
  371   3HZ   LYS  44          3HZ       LYS  44   7.965   3.638   3.638
  372    H    GLN  45           H        GLN  45  13.655   3.876   3.876
  373    HA   GLN  45           HA       GLN  45  13.698   1.107   1.107
  374   1HB   GLN  45          2HB       GLN  45  13.821   2.944   2.944
  375   2HB   GLN  45          1HB       GLN  45  15.273   3.560   3.560
  376   1HG   GLN  45          2HG       GLN  45  16.468   1.485   1.485
  377   2HG   GLN  45          1HG       GLN  45  15.015   0.800   0.800
  378   1HE2  GLN  45          2HE2      GLN  45  16.440   2.003   2.003
  379   2HE2  GLN  45          1HE2      GLN  45  16.191   0.624   0.624
  380    H    GLU  46           H        GLU  46  15.036  -0.353  -0.353
  381    HA   GLU  46           HA       GLU  46  17.581   0.595   0.595
  382   1HB   GLU  46          2HB       GLU  46  15.579  -1.449  -1.449
  383   2HB   GLU  46          1HB       GLU  46  17.270  -1.544  -1.544
  384   1HG   GLU  46          2HG       GLU  46  17.040   0.925   0.925
  385   2HG   GLU  46          1HG       GLU  46  15.300   0.686   0.686
  386    H    GLY  47           H        GLY  47  17.473  -0.066  -0.066
  387   1HA   GLY  47          2HA       GLY  47  19.097  -1.351  -1.351
  388   2HA   GLY  47          1HA       GLY  47  19.008  -2.619  -2.619
  389    H    ASP  48           H        ASP  48  18.147  -4.398  -4.398
  390    HA   ASP  48           HA       ASP  48  16.187  -4.157  -4.157
  391   1HB   ASP  48          2HB       ASP  48  16.000  -6.700  -6.700
  392   2HB   ASP  48          1HB       ASP  48  17.539  -6.088  -6.088
  393    H    THR  49           H        THR  49  15.889  -3.701  -3.701
  394    HA   THR  49           HA       THR  49  13.232  -5.003  -5.003
  395    HB   THR  49           HB       THR  49  15.192  -3.907  -3.907
  396    HG1  THR  49           HG1      THR  49  15.328  -5.962  -5.962
  397   1HG2  THR  49          3HG2      THR  49  12.208  -3.974  -3.974
  398   2HG2  THR  49          2HG2      THR  49  13.208  -4.380  -4.380
  399   3HG2  THR  49          1HG2      THR  49  13.365  -2.800  -2.800
  400    H    PHE  50           H        PHE  50  11.386  -3.791  -3.791
  401    HA   PHE  50           HA       PHE  50  11.693  -0.829  -0.829
  402   1HB   PHE  50          2HB       PHE  50  10.068  -2.406  -2.406
  403   2HB   PHE  50          1HB       PHE  50  10.006  -0.650  -0.650
  404    HD1  PHE  50           HD2      PHE  50  11.975   0.744   0.744
  405    HD2  PHE  50           HD1      PHE  50  11.996  -3.500  -3.500
  406    HE1  PHE  50           HE2      PHE  50  14.032   0.954   0.954
  407    HE2  PHE  50           HE1      PHE  50  14.056  -3.293  -3.293
  408    HZ   PHE  50           HZ       PHE  50  15.080  -1.070  -1.070
  409    H    TYR  51           H        TYR  51  10.500  -0.088  -0.088
  410    HA   TYR  51           HA       TYR  51   8.077  -1.582  -1.582
  411   1HB   TYR  51          2HB       TYR  51   9.890  -1.070  -1.070
  412   2HB   TYR  51          1HB       TYR  51   9.609   0.642   0.642
  413    HD1  TYR  51           HD1      TYR  51   7.054   1.389   1.389
  414    HD2  TYR  51           HD2      TYR  51   8.764  -2.107  -2.107
  415    HE1  TYR  51           HE1      TYR  51   5.229   1.354   1.354
  416    HE2  TYR  51           HE2      TYR  51   6.945  -2.131  -2.131
  417    HH   TYR  51           HH       TYR  51   5.294   0.020   0.020
  418    H    ILE  52           H        ILE  52   6.051  -0.437  -0.437
  419    HA   ILE  52           HA       ILE  52   6.122   2.360   2.360
  420    HB   ILE  52           HB       ILE  52   4.111   0.501   0.501
  421   1HG1  ILE  52          2HG1      ILE  52   7.028   0.656   0.656
  422   2HG1  ILE  52          1HG1      ILE  52   6.219  -0.764  -0.764
  423   1HG2  ILE  52          1HG2      ILE  52   4.726   3.151   3.151
  424   2HG2  ILE  52          3HG2      ILE  52   5.665   2.428   2.428
  425   3HG2  ILE  52          2HG2      ILE  52   3.922   2.173   2.173
  426   1HD1  ILE  52          1HD1      ILE  52   4.554  -0.393  -0.393
  427   2HD1  ILE  52          3HD1      ILE  52   5.896   0.516   0.516
  428   3HD1  ILE  52          2HD1      ILE  52   6.102  -1.187  -1.187
  429    H    LYS  53           H        LYS  53   5.100   3.418   3.418
  430    HA   LYS  53           HA       LYS  53   2.661   2.164   2.164
  431   1HB   LYS  53          2HB       LYS  53   4.621   2.966   2.966
  432   2HB   LYS  53          1HB       LYS  53   4.105   4.599   4.599
  433   1HG   LYS  53          2HG       LYS  53   1.739   3.291   3.291
  434   2HG   LYS  53          1HG       LYS  53   2.927   2.717   2.717
  435   1HD   LYS  53          2HD       LYS  53   3.565   5.338   5.338
  436   2HD   LYS  53          1HD       LYS  53   1.852   5.458   5.458
  437   1HE   LYS  53          2HE       LYS  53   1.169   4.562   4.562
  438   2HE   LYS  53          1HE       LYS  53   2.661   3.647   3.647
  439   1HZ   LYS  53          3HZ       LYS  53   3.789   5.856   5.856
  440   2HZ   LYS  53          2HZ       LYS  53   2.244   6.557   6.557
  441   3HZ   LYS  53          1HZ       LYS  53   2.738   5.420   5.420
  442    H    THR  54           H        THR  54   0.786   2.893   2.893
  443    HA   THR  54           HA       THR  54   0.712   5.681   5.681
  444    HB   THR  54           HB       THR  54  -1.249   3.409   3.409
  445    HG1  THR  54           HG1      THR  54   0.112   2.746   2.746
  446   1HG2  THR  54          2HG2      THR  54  -1.433   6.188   6.188
  447   2HG2  THR  54          1HG2      THR  54  -1.128   5.453   5.453
  448   3HG2  THR  54          3HG2      THR  54  -2.509   4.931   4.931
  449    H    SER  55           H        SER  55  -0.882   7.123   7.123
  450    HA   SER  55           HA       SER  55  -2.707   6.141   6.141
  451   1HB   SER  55          2HB       SER  55  -1.999   8.513   8.513
  452   2HB   SER  55          1HB       SER  55  -1.190   7.002   7.002
  453    HG   SER  55           HG       SER  55   0.278   8.664   8.664
  454    H    THR  56           H        THR  56  -4.698   7.072   7.072
  455    HA   THR  56           HA       THR  56  -5.092   9.195   9.195
  456    HB   THR  56           HB       THR  56  -7.601   8.413   8.413
  457    HG1  THR  56           HG1      THR  56  -7.661   6.614   6.614
  458   1HG2  THR  56          2HG2      THR  56  -5.530   7.109   7.109
  459   2HG2  THR  56          1HG2      THR  56  -7.207   6.562   6.562
  460   3HG2  THR  56          3HG2      THR  56  -6.820   8.220   8.220
  461    H    THR  57           H        THR  57  -6.846   8.296   8.296
  462    HA   THR  57           HA       THR  57  -6.266  10.669  10.669
  463    HB   THR  57           HB       THR  57  -7.665  11.773  11.773
  464    HG1  THR  57           HG1      THR  57  -9.368  12.443  12.443
  465   1HG2  THR  57          1HG2      THR  57  -8.873   9.587   9.587
  466   2HG2  THR  57          3HG2      THR  57  -9.915   9.930   9.930
  467   3HG2  THR  57          2HG2      THR  57  -9.857  11.051  11.051
  468    H    VAL  58           H        VAL  58  -8.596   8.159   8.159
  469    HA   VAL  58           HA       VAL  58  -8.948   7.607   7.607
  470    HB   VAL  58           HB       VAL  58 -10.783   6.831   6.831
  471   1HG1  VAL  58          2HG1      VAL  58 -10.566   6.013   6.013
  472   2HG1  VAL  58          1HG1      VAL  58 -12.069   6.912   6.912
  473   3HG1  VAL  58          3HG1      VAL  58 -11.742   5.497   5.497
  474   1HG2  VAL  58          2HG2      VAL  58 -10.458   9.343   9.343
  475   2HG2  VAL  58          1HG2      VAL  58 -11.522   8.963   8.963
  476   3HG2  VAL  58          3HG2      VAL  58 -12.058   8.664   8.664
  477    H    ARG  59           H        ARG  59  -7.542   6.527   6.527
  478    HA   ARG  59           HA       ARG  59  -7.331   3.759   3.759
  479   1HB   ARG  59          2HB       ARG  59  -8.654   3.794   3.794
  480   2HB   ARG  59          1HB       ARG  59  -7.314   4.594   4.594
  481   1HG   ARG  59          2HG       ARG  59  -5.897   2.700   2.700
  482   2HG   ARG  59          1HG       ARG  59  -6.948   1.957   1.957
  483   1HD   ARG  59          2HD       ARG  59  -7.921   2.516   2.516
  484   2HD   ARG  59          1HD       ARG  59  -7.076   1.021   1.021
  485    HE   ARG  59           HE       ARG  59  -9.033   1.097   1.097
  486   1HH1  ARG  59          2HH1      ARG  59  -8.802   0.024   0.024
  487   2HH1  ARG  59          1HH1      ARG  59 -10.491   0.100   0.100
  488   1HH2  ARG  59          1HH2      ARG  59 -11.318   1.862   1.862
  489   2HH2  ARG  59          2HH2      ARG  59 -11.916   1.140   1.140
  490    H    THR  60           H        THR  60  -5.266   2.674   2.674
  491    HA   THR  60           HA       THR  60  -3.058   4.309   4.309
  492    HB   THR  60           HB       THR  60  -2.967   3.395   3.395
  493    HG1  THR  60           HG1      THR  60  -3.796   5.240   5.240
  494   1HG2  THR  60          1HG2      THR  60  -1.138   4.835   4.835
  495   2HG2  THR  60          3HG2      THR  60  -1.086   5.261   5.261
  496   3HG2  THR  60          2HG2      THR  60  -0.759   3.603   3.603
  497    H    THR  61           H        THR  61  -2.425   2.658   2.658
  498    HA   THR  61           HA       THR  61  -2.081  -0.067  -0.067
  499    HB   THR  61           HB       THR  61  -1.647  -0.584  -0.584
  500    HG1  THR  61           HG1      THR  61  -2.180   0.951   0.951
  501   1HG2  THR  61          3HG2      THR  61  -4.243   0.103   0.103
  502   2HG2  THR  61          2HG2      THR  61  -4.244  -0.380  -0.380
  503   3HG2  THR  61          1HG2      THR  61  -3.614  -1.477  -1.477
  504    H    GLU  62           H        GLU  62  -0.082  -1.239  -1.239
  505    HA   GLU  62           HA       GLU  62   2.207   0.312   0.312
  506   1HB   GLU  62          2HB       GLU  62   3.494   0.363   0.363
  507   2HB   GLU  62          1HB       GLU  62   1.900   0.958   0.958
  508   1HG   GLU  62          2HG       GLU  62   1.492  -1.648  -1.648
  509   2HG   GLU  62          1HG       GLU  62   3.241  -1.608  -1.608
  510    H    ILE  63           H        ILE  63   3.449  -1.097  -1.097
  511    HA   ILE  63           HA       ILE  63   3.301  -3.994  -3.994
  512    HB   ILE  63           HB       ILE  63   3.771  -4.454  -4.454
  513   1HG1  ILE  63          2HG1      ILE  63   3.293  -1.488  -1.488
  514   2HG1  ILE  63          1HG1      ILE  63   4.904  -2.204  -2.204
  515   1HG2  ILE  63          3HG2      ILE  63   1.404  -3.974  -3.974
  516   2HG2  ILE  63          2HG2      ILE  63   1.422  -2.598  -2.598
  517   3HG2  ILE  63          1HG2      ILE  63   1.550  -4.238  -4.238
  518   1HD1  ILE  63          1HD1      ILE  63   3.719  -3.872  -3.872
  519   2HD1  ILE  63          3HD1      ILE  63   2.796  -2.404  -2.404
  520   3HD1  ILE  63          2HD1      ILE  63   4.551  -2.397  -2.397
  521    H    ASN  64           H        ASN  64   5.363  -5.190  -5.190
  522    HA   ASN  64           HA       ASN  64   7.794  -3.587  -3.587
  523   1HB   ASN  64          2HB       ASN  64   8.849  -4.527  -4.527
  524   2HB   ASN  64          1HB       ASN  64   7.505  -3.443  -3.443
  525   1HD2  ASN  64          2HD2      ASN  64   5.309  -6.131  -6.131
  526   2HD2  ASN  64          1HD2      ASN  64   5.284  -4.667  -4.667
  527    H    PHE  65           H        PHE  65   9.234  -4.816  -4.816
  528    HA   PHE  65           HA       PHE  65   9.335  -7.738  -7.738
  529   1HB   PHE  65          2HB       PHE  65   8.621  -8.269  -8.269
  530   2HB   PHE  65          1HB       PHE  65   7.338  -7.393  -7.393
  531    HD1  PHE  65           HD2      PHE  65   6.992  -4.950  -4.950
  532    HD2  PHE  65           HD1      PHE  65   9.759  -7.321  -7.321
  533    HE1  PHE  65           HE2      PHE  65   7.090  -3.175  -3.175
  534    HE2  PHE  65           HE1      PHE  65   9.862  -5.547  -5.547
  535    HZ   PHE  65           HZ       PHE  65   8.529  -3.472  -3.472
  536    H    LYS  66           H        LYS  66  10.573  -8.578  -8.578
  537    HA   LYS  66           HA       LYS  66  12.862  -6.734  -6.734
  538   1HB   LYS  66          2HB       LYS  66  14.280  -8.881  -8.881
  539   2HB   LYS  66          1HB       LYS  66  13.785  -8.294  -8.294
  540   1HG   LYS  66          2HG       LYS  66  11.846  -9.862  -9.862
  541   2HG   LYS  66          1HG       LYS  66  12.447 -10.495 -10.495
  542   1HD   LYS  66          2HD       LYS  66  13.284 -11.987 -11.987
  543   2HD   LYS  66          1HD       LYS  66  14.650 -10.954 -10.954
  544   1HE   LYS  66          2HE       LYS  66  13.946  -9.462  -9.462
  545   2HE   LYS  66          1HE       LYS  66  12.878 -10.776 -10.776
  546   1HZ   LYS  66          1HZ       LYS  66  14.989 -12.204 -12.204
  547   2HZ   LYS  66          3HZ       LYS  66  15.821 -10.729 -10.729
  548   3HZ   LYS  66          2HZ       LYS  66  14.809 -11.221 -11.221
  549    H    VAL  67           H        VAL  67  13.838  -7.089  -7.089
  550    HA   VAL  67           HA       VAL  67  11.860  -8.066  -8.066
  551    HB   VAL  67           HB       VAL  67  14.542  -7.382  -7.382
  552   1HG1  VAL  67          2HG1      VAL  67  11.698  -6.479  -6.479
  553   2HG1  VAL  67          1HG1      VAL  67  13.093  -5.897  -5.897
  554   3HG1  VAL  67          3HG1      VAL  67  12.653  -7.604  -7.604
  555   1HG2  VAL  67          1HG2      VAL  67  13.008  -5.522  -5.522
  556   2HG2  VAL  67          3HG2      VAL  67  14.753  -5.722  -5.722
  557   3HG2  VAL  67          2HG2      VAL  67  13.839  -4.867  -4.867
  558    H    GLY  68           H        GLY  68  11.811 -10.356 -10.356
  559   1HA   GLY  68          2HA       GLY  68  13.241 -12.034 -12.034
  560   2HA   GLY  68          1HA       GLY  68  14.359 -11.836 -11.836
  561    H    GLU  69           H        GLU  69  12.036 -11.588 -11.588
  562    HA   GLU  69           HA       GLU  69  11.214 -14.468 -14.468
  563   1HB   GLU  69          2HB       GLU  69  11.997 -12.761 -12.761
  564   2HB   GLU  69          1HB       GLU  69  11.366 -14.405 -14.405
  565   1HG   GLU  69          2HG       GLU  69  13.312 -14.996 -14.996
  566   2HG   GLU  69          1HG       GLU  69  14.005 -13.465 -13.465
  567    H    GLU  70           H        GLU  70   9.175 -14.897 -14.897
  568    HA   GLU  70           HA       GLU  70   7.231 -12.731 -12.731
  569   1HB   GLU  70          2HB       GLU  70   6.748 -15.545 -15.545
  570   2HB   GLU  70          1HB       GLU  70   5.542 -14.434 -14.434
  571   1HG   GLU  70          2HG       GLU  70   6.465 -14.559 -14.559
  572   2HG   GLU  70          1HG       GLU  70   7.931 -15.348 -15.348
  573    H    PHE  71           H        PHE  71   5.519 -12.403 -12.403
  574    HA   PHE  71           HA       PHE  71   6.359 -12.906 -12.906
  575   1HB   PHE  71          2HB       PHE  71   6.516 -10.484 -10.484
  576   2HB   PHE  71          1HB       PHE  71   7.794 -10.998 -10.998
  577    HD1  PHE  71           HD2      PHE  71   7.424 -10.651 -10.651
  578    HD2  PHE  71           HD1      PHE  71   5.031  -8.753  -8.753
  579    HE1  PHE  71           HE2      PHE  71   6.663  -8.969  -8.969
  580    HE2  PHE  71           HE1      PHE  71   4.270  -7.072  -7.072
  581    HZ   PHE  71           HZ       PHE  71   5.085  -7.178  -7.178
  582    H    GLU  72           H        GLU  72   4.843 -11.470 -11.470
  583    HA   GLU  72           HA       GLU  72   2.127 -11.627 -11.627
  584   1HB   GLU  72          2HB       GLU  72   2.517 -11.378 -11.378
  585   2HB   GLU  72          1HB       GLU  72   1.237 -12.192 -12.192
  586   1HG   GLU  72          2HG       GLU  72   2.884 -13.917 -13.917
  587   2HG   GLU  72          1HG       GLU  72   4.096 -13.149 -13.149
  588    H    GLU  73           H        GLU  73   0.796  -9.818  -9.818
  589    HA   GLU  73           HA       GLU  73   1.562  -7.448  -7.448
  590   1HB   GLU  73          2HB       GLU  73   1.765  -5.998  -5.998
  591   2HB   GLU  73          1HB       GLU  73   3.085  -7.156  -7.156
  592   1HG   GLU  73          2HG       GLU  73   2.436  -8.364  -8.364
  593   2HG   GLU  73          1HG       GLU  73   0.720  -8.112  -8.112
  594    H    GLN  74           H        GLN  74   0.080  -5.540  -5.540
  595    HA   GLN  74           HA       GLN  74  -2.659  -6.737  -6.737
  596   1HB   GLN  74          2HB       GLN  74  -1.550  -4.051  -4.051
  597   2HB   GLN  74          1HB       GLN  74  -3.243  -4.184  -4.184
  598   1HG   GLN  74          2HG       GLN  74  -3.182  -6.254  -6.254
  599   2HG   GLN  74          1HG       GLN  74  -1.848  -5.339  -5.339
  600   1HE2  GLN  74          2HE2      GLN  74  -5.661  -3.852  -3.852
  601   2HE2  GLN  74          1HE2      GLN  74  -5.321  -5.121  -5.121
  602    H    THR  75           H        THR  75  -4.180  -5.991  -5.991
  603    HA   THR  75           HA       THR  75  -2.832  -5.322  -5.322
  604    HB   THR  75           HB       THR  75  -4.535  -7.190  -7.190
  605    HG1  THR  75           HG1      THR  75  -5.050  -6.864  -6.864
  606   1HG2  THR  75          3HG2      THR  75  -6.107  -5.052  -5.052
  607   2HG2  THR  75          2HG2      THR  75  -6.874  -5.623  -5.623
  608   3HG2  THR  75          1HG2      THR  75  -6.538  -6.752  -6.752
  609    H    VAL  76           H        VAL  76  -5.470  -4.073  -4.073
  610    HA   VAL  76           HA       VAL  76  -4.900  -1.376  -1.376
  611    HB   VAL  76           HB       VAL  76  -6.285  -2.062  -2.062
  612   1HG1  VAL  76          1HG1      VAL  76  -5.292   0.462   0.462
  613   2HG1  VAL  76          3HG1      VAL  76  -5.423   0.356   0.356
  614   3HG1  VAL  76          2HG1      VAL  76  -6.856   0.147   0.147
  615   1HG2  VAL  76          1HG2      VAL  76  -3.552  -2.389  -2.389
  616   2HG2  VAL  76          3HG2      VAL  76  -4.271  -2.437  -2.437
  617   3HG2  VAL  76          2HG2      VAL  76  -3.649  -0.917  -0.917
  618    H    ASP  77           H        ASP  77  -7.361  -3.794  -3.794
  619    HA   ASP  77           HA       ASP  77  -9.526  -1.883  -1.883
  620   1HB   ASP  77          2HB       ASP  77  -9.512  -4.246  -4.246
  621   2HB   ASP  77          1HB       ASP  77 -10.041  -4.779  -4.779
  622    H    GLY  78           H        GLY  78  -7.846  -4.552  -4.552
  623   1HA   GLY  78          2HA       GLY  78  -7.406  -3.799  -3.799
  624   2HA   GLY  78          1HA       GLY  78  -9.166  -3.805  -3.805
  625    H    ARG  79           H        ARG  79  -7.096  -6.086  -6.086
  626    HA   ARG  79           HA       ARG  79  -8.006  -8.235  -8.235
  627   1HB   ARG  79          2HB       ARG  79  -8.107  -8.042  -8.042
  628   2HB   ARG  79          1HB       ARG  79  -7.887  -9.617  -9.617
  629   1HG   ARG  79          2HG       ARG  79 -10.008  -7.966  -7.966
  630   2HG   ARG  79          1HG       ARG  79 -10.325  -8.450  -8.450
  631   1HD   ARG  79          2HD       ARG  79  -9.369 -10.470 -10.470
  632   2HD   ARG  79          1HD       ARG  79 -11.076 -10.046 -10.046
  633    HE   ARG  79           HE       ARG  79  -9.841 -10.778 -10.778
  634   1HH1  ARG  79          1HH2      ARG  79 -10.049 -12.796 -12.796
  635   2HH1  ARG  79          2HH2      ARG  79 -11.365 -13.762 -13.762
  636   1HH2  ARG  79          2HH1      ARG  79 -12.200 -11.574 -11.574
  637   2HH2  ARG  79          1HH1      ARG  79 -12.583 -13.071 -13.071
  638    HA   PRO  80           HA       PRO  80  -3.712  -9.266  -9.266
  639   1HB   PRO  80          2HB       PRO  80  -3.906 -11.906 -11.906
  640   2HB   PRO  80          1HB       PRO  80  -4.155 -10.548 -10.548
  641   1HG   PRO  80          2HG       PRO  80  -6.174 -12.368 -12.368
  642   2HG   PRO  80          1HG       PRO  80  -6.258 -11.458 -11.458
  643   1HD   PRO  80          2HD       PRO  80  -7.512 -10.743 -10.743
  644   2HD   PRO  80          1HD       PRO  80  -7.314  -9.694  -9.694
  645    H    CYS  81           H        CYS  81  -2.213 -10.064 -10.064
  646    HA   CYS  81           HA       CYS  81  -2.812 -12.340 -12.340
  647   1HB   CYS  81          2HB       CYS  81  -2.518 -11.018 -11.018
  648   2HB   CYS  81          1HB       CYS  81  -4.015 -10.654 -10.654
  649    HG   CYS  81           HG       CYS  81  -2.032  -8.701  -8.701
  650    H    LYS  82           H        LYS  82  -0.910 -13.184 -13.184
  651    HA   LYS  82           HA       LYS  82   1.592 -12.046 -12.046
  652   1HB   LYS  82          2HB       LYS  82   1.385 -14.438 -14.438
  653   2HB   LYS  82          1HB       LYS  82   0.946 -14.589 -14.589
  654   1HG   LYS  82          2HG       LYS  82   3.115 -14.889 -14.889
  655   2HG   LYS  82          1HG       LYS  82   3.434 -13.242 -13.242
  656   1HD   LYS  82          2HD       LYS  82   4.865 -14.583 -14.583
  657   2HD   LYS  82          1HD       LYS  82   3.493 -14.227 -14.227
  658   1HE   LYS  82          2HE       LYS  82   2.694 -16.384 -16.384
  659   2HE   LYS  82          1HE       LYS  82   3.301 -16.662 -16.662
  660   1HZ   LYS  82          1HZ       LYS  82   5.180 -16.292 -16.292
  661   2HZ   LYS  82          3HZ       LYS  82   4.458 -17.805 -17.805
  662   3HZ   LYS  82          2HZ       LYS  82   5.415 -17.103 -17.103
  663    H    SER  83           H        SER  83   2.627 -10.531 -10.531
  664    HA   SER  83           HA       SER  83   2.129 -10.418 -10.418
  665   1HB   SER  83          2HB       SER  83   1.790  -8.277  -8.277
  666   2HB   SER  83          1HB       SER  83   3.019  -8.457  -8.457
  667    HG   SER  83           HG       SER  83   3.604  -7.079  -7.079
  668    H    LEU  84           H        LEU  84   4.066  -9.837  -9.837
  669    HA   LEU  84           HA       LEU  84   6.671 -10.754 -10.754
  670   1HB   LEU  84          2HB       LEU  84   5.681 -12.805 -12.805
  671   2HB   LEU  84          1HB       LEU  84   5.329 -11.964 -11.964
  672    HG   LEU  84           HG       LEU  84   7.712 -11.648 -11.648
  673   1HD1  LEU  84          3HD1      LEU  84   7.967 -12.001 -12.001
  674   2HD1  LEU  84          2HD1      LEU  84   8.761 -13.400 -13.400
  675   3HD1  LEU  84          1HD1      LEU  84   9.274 -11.772 -11.772
  676   1HD2  LEU  84          3HD2      LEU  84   6.603 -14.357 -14.357
  677   2HD2  LEU  84          2HD2      LEU  84   7.169 -13.668 -13.668
  678   3HD2  LEU  84          1HD2      LEU  84   8.332 -14.250 -14.250
  679    H    VAL  85           H        VAL  85   8.457  -9.970  -9.970
  680    HA   VAL  85           HA       VAL  85   7.578  -8.115  -8.115
  681    HB   VAL  85           HB       VAL  85   9.268  -7.198  -7.198
  682   1HG1  VAL  85          3HG1      VAL  85   8.945  -6.212  -6.212
  683   2HG1  VAL  85          2HG1      VAL  85   8.081  -5.110  -5.110
  684   3HG1  VAL  85          1HG1      VAL  85   9.791  -5.446  -5.446
  685   1HG2  VAL  85          2HG2      VAL  85   6.355  -6.797  -6.797
  686   2HG2  VAL  85          1HG2      VAL  85   7.027  -7.441  -7.441
  687   3HG2  VAL  85          3HG2      VAL  85   7.215  -5.732  -5.732
  688    H    LYS  86           H        LYS  86   8.927  -8.174  -8.174
  689    HA   LYS  86           HA       LYS  86  11.760  -8.999  -8.999
  690   1HB   LYS  86          2HB       LYS  86  11.385  -9.630  -9.630
  691   2HB   LYS  86          1HB       LYS  86  11.143 -10.788 -10.788
  692   1HG   LYS  86          2HG       LYS  86   8.733 -10.152 -10.152
  693   2HG   LYS  86          1HG       LYS  86   9.005  -9.087  -9.087
  694   1HD   LYS  86          2HD       LYS  86  10.041 -11.270 -11.270
  695   2HD   LYS  86          1HD       LYS  86   9.024 -12.082 -12.082
  696   1HE   LYS  86          2HE       LYS  86   7.045 -10.936 -10.936
  697   2HE   LYS  86          1HE       LYS  86   8.033 -10.005 -10.005
  698   1HZ   LYS  86          1HZ       LYS  86   7.895 -12.968 -12.968
  699   2HZ   LYS  86          3HZ       LYS  86   6.926 -11.986 -11.986
  700   3HZ   LYS  86          2HZ       LYS  86   8.614 -11.969 -11.969
  701    H    TRP  87           H        TRP  87  13.259  -7.950  -7.950
  702    HA   TRP  87           HA       TRP  87  12.438  -5.176  -5.176
  703   1HB   TRP  87          2HB       TRP  87  14.992  -6.724  -6.724
  704   2HB   TRP  87          1HB       TRP  87  14.817  -5.083  -5.083
  705    HD1  TRP  87           HD1      TRP  87  15.623  -7.029  -7.029
  706    HE1  TRP  87           HE1      TRP  87  15.841  -5.498  -5.498
  707    HE3  TRP  87           HE3      TRP  87  13.617  -2.750  -2.750
  708    HZ2  TRP  87           HZ2      TRP  87  15.241  -2.802  -2.802
  709    HZ3  TRP  87           HZ3      TRP  87  13.433  -0.714  -0.714
  710    HH2  TRP  87           HH2      TRP  87  14.241  -0.741  -0.741
  711    H    GLU  88           H        GLU  88  12.909  -4.156  -4.156
  712    HA   GLU  88           HA       GLU  88  12.346  -5.975  -5.975
  713   1HB   GLU  88          2HB       GLU  88  10.348  -4.575  -4.575
  714   2HB   GLU  88          1HB       GLU  88  11.205  -3.191  -3.191
  715   1HG   GLU  88          2HG       GLU  88   9.846  -3.824  -3.824
  716   2HG   GLU  88          1HG       GLU  88  11.365  -4.639  -4.639
  717    H    SER  89           H        SER  89  13.447  -2.847  -2.847
  718    HA   SER  89           HA       SER  89  15.528  -2.810  -2.810
  719   1HB   SER  89          2HB       SER  89  15.110  -0.482  -0.482
  720   2HB   SER  89          1HB       SER  89  13.561  -1.311  -1.311
  721    HG   SER  89           HG       SER  89  13.835   0.741   0.741
  722    H    GLU  90           H        GLU  90  16.453  -0.185  -0.185
  723    HA   GLU  90           HA       GLU  90  17.936  -1.168  -1.168
  724   1HB   GLU  90          2HB       GLU  90  17.996   1.670   1.670
  725   2HB   GLU  90          1HB       GLU  90  19.279   0.776   0.776
  726   1HG   GLU  90          2HG       GLU  90  19.104  -0.840  -0.840
  727   2HG   GLU  90          1HG       GLU  90  18.311   0.526   0.526
  728    H    ASN  91           H        ASN  91  15.052   0.669   0.669
  729    HA   ASN  91           HA       ASN  91  14.832   1.022   1.022
  730   1HB   ASN  91          2HB       ASN  91  14.253   3.341   3.341
  731   2HB   ASN  91          1HB       ASN  91  14.370   3.349   3.349
  732   1HD2  ASN  91          2HD2      ASN  91  17.663   4.077   4.077
  733   2HD2  ASN  91          1HD2      ASN  91  16.091   4.133   4.133
  734    H    LYS  92           H        LYS  92  13.448  -0.601  -0.601
  735    HA   LYS  92           HA       LYS  92  10.703   0.333   0.333
  736   1HB   LYS  92          2HB       LYS  92  11.100   1.044   1.044
  737   2HB   LYS  92          1HB       LYS  92  11.662  -0.569  -0.569
  738   1HG   LYS  92          2HG       LYS  92   9.372  -1.428  -1.428
  739   2HG   LYS  92          1HG       LYS  92   8.863   0.258   0.258
  740   1HD   LYS  92          2HD       LYS  92   9.628   0.521   0.521
  741   2HD   LYS  92          1HD       LYS  92   9.887  -1.223  -1.223
  742   1HE   LYS  92          2HE       LYS  92   7.425  -1.363  -1.363
  743   2HE   LYS  92          1HE       LYS  92   7.301   0.292   0.292
  744   1HZ   LYS  92          1HZ       LYS  92   8.372  -0.714  -0.714
  745   2HZ   LYS  92          3HZ       LYS  92   7.798  -2.188  -2.188
  746   3HZ   LYS  92          2HZ       LYS  92   6.709  -0.928  -0.928
  747    H    MET  93           H        MET  93  10.020  -1.283  -1.283
  748    HA   MET  93           HA       MET  93  10.638  -4.091  -4.091
  749   1HB   MET  93          2HB       MET  93   9.999  -4.487  -4.487
  750   2HB   MET  93          1HB       MET  93  11.624  -3.978  -3.978
  751   1HG   MET  93          2HG       MET  93  11.319  -1.826  -1.826
  752   2HG   MET  93          1HG       MET  93   9.581  -1.855  -1.855
  753   1HE   MET  93          3HE       MET  93  11.963  -4.303  -4.303
  754   2HE   MET  93          2HE       MET  93  12.493  -2.964  -2.964
  755   3HE   MET  93          1HE       MET  93  11.645  -4.327  -4.327
  756    H    VAL  94           H        VAL  94   8.958  -5.623  -5.623
  757    HA   VAL  94           HA       VAL  94   6.222  -4.448  -4.448
  758    HB   VAL  94           HB       VAL  94   6.790  -7.272  -7.272
  759   1HG1  VAL  94          1HG1      VAL  94   4.890  -5.072  -5.072
  760   2HG1  VAL  94          3HG1      VAL  94   5.146  -6.425  -6.425
  761   3HG1  VAL  94          2HG1      VAL  94   4.530  -6.716  -6.716
  762   1HG2  VAL  94          2HG2      VAL  94   7.810  -4.817  -4.817
  763   2HG2  VAL  94          1HG2      VAL  94   8.518  -6.431  -6.431
  764   3HG2  VAL  94          3HG2      VAL  94   7.160  -6.114  -6.114
  765    H    CYS  95           H        CYS  95   4.494  -6.105  -6.105
  766    HA   CYS  95           HA       CYS  95   5.545  -7.663  -7.663
  767   1HB   CYS  95          2HB       CYS  95   5.136  -5.400  -5.400
  768   2HB   CYS  95          1HB       CYS  95   3.477  -5.473  -5.473
  769    HG   CYS  95           HG       CYS  95   2.931  -7.284  -7.284
  770    H    GLU  96           H        GLU  96   4.282  -9.382  -9.382
  771    HA   GLU  96           HA       GLU  96   1.727  -9.732  -9.732
  772   1HB   GLU  96          2HB       GLU  96   3.379 -11.895 -11.895
  773   2HB   GLU  96          1HB       GLU  96   2.063 -12.113 -12.113
  774   1HG   GLU  96          2HG       GLU  96   4.054 -10.393 -10.393
  775   2HG   GLU  96          1HG       GLU  96   4.836 -11.854 -11.854
  776    H    GLN  97           H        GLN  97   0.006 -10.941 -10.941
  777    HA   GLN  97           HA       GLN  97   0.391 -10.785 -10.785
  778   1HB   GLN  97          2HB       GLN  97  -0.252  -8.438  -8.438
  779   2HB   GLN  97          1HB       GLN  97  -1.868  -9.109  -9.109
  780   1HG   GLN  97          2HG       GLN  97  -1.099  -9.678  -9.678
  781   2HG   GLN  97          1HG       GLN  97   0.194  -8.518  -8.518
  782   1HE2  GLN  97          2HE2      GLN  97  -1.898  -5.717  -5.717
  783   2HE2  GLN  97          1HE2      GLN  97  -0.322  -6.312  -6.312
  784    H    LYS  98           H        LYS  98  -0.936 -12.151 -12.151
  785    HA   LYS  98           HA       LYS  98  -3.494 -13.000 -13.000
  786   1HB   LYS  98          2HB       LYS  98  -2.931 -15.394 -15.394
  787   2HB   LYS  98          1HB       LYS  98  -1.836 -14.638 -14.638
  788   1HG   LYS  98          2HG       LYS  98  -0.157 -14.322 -14.322
  789   2HG   LYS  98          1HG       LYS  98  -1.249 -15.059 -15.059
  790   1HD   LYS  98          2HD       LYS  98  -1.279 -17.120 -17.120
  791   2HD   LYS  98          1HD       LYS  98   0.027 -16.381 -16.381
  792   1HE   LYS  98          2HE       LYS  98   1.408 -16.244 -16.244
  793   2HE   LYS  98          1HE       LYS  98   0.103 -16.972 -16.972
  794   1HZ   LYS  98          1HZ       LYS  98   1.119 -18.348 -18.348
  795   2HZ   LYS  98          3HZ       LYS  98   1.990 -18.450 -18.450
  796   3HZ   LYS  98          2HZ       LYS  98   0.383 -19.000 -19.000
  797    H    LEU  99           H        LEU  99  -5.019 -13.613 -13.613
  798    HA   LEU  99           HA       LEU  99  -4.671 -12.531 -12.531
  799   1HB   LEU  99          2HB       LEU  99  -6.534 -14.700 -14.700
  800   2HB   LEU  99          1HB       LEU  99  -6.653 -13.942 -13.942
  801    HG   LEU  99           HG       LEU  99  -6.516 -12.132 -12.132
  802   1HD1  LEU  99          3HD1      LEU  99  -8.974 -13.732 -13.732
  803   2HD1  LEU  99          2HD1      LEU  99  -8.959 -12.383 -12.383
  804   3HD1  LEU  99          1HD1      LEU  99  -8.092 -13.870 -13.870
  805   1HD2  LEU  99          1HD2      LEU  99  -7.900 -12.233 -12.233
  806   2HD2  LEU  99          3HD2      LEU  99  -6.674 -11.090 -11.090
  807   3HD2  LEU  99          2HD2      LEU  99  -8.308 -11.016 -11.016
  808    H    LEU 100           H        LEU 100  -4.841 -13.818 -13.818
  809    HA   LEU 100           HA       LEU 100  -2.931 -16.093 -16.093
  810   1HB   LEU 100          2HB       LEU 100  -3.777 -14.174 -14.174
  811   2HB   LEU 100          1HB       LEU 100  -2.864 -15.646 -15.646
  812    HG   LEU 100           HG       LEU 100  -1.972 -13.529 -13.529
  813   1HD1  LEU 100          1HD1      LEU 100  -2.116 -12.962 -12.962
  814   2HD1  LEU 100          3HD1      LEU 100  -0.686 -13.989 -13.989
  815   3HD1  LEU 100          2HD1      LEU 100  -0.665 -12.545 -12.545
  816   1HD2  LEU 100          2HD2      LEU 100  -0.902 -16.133 -16.133
  817   2HD2  LEU 100          1HD2      LEU 100  -0.799 -15.429 -15.429
  818   3HD2  LEU 100          3HD2      LEU 100   0.254 -14.841 -14.841
  819    H    LYS 101           H        LYS 101  -6.192 -15.431 -15.431
  820    HA   LYS 101           HA       LYS 101  -6.815 -18.145 -18.145
  821   1HB   LYS 101          2HB       LYS 101  -6.916 -16.202 -16.202
  822   2HB   LYS 101          1HB       LYS 101  -8.542 -16.066 -16.066
  823   1HG   LYS 101          2HG       LYS 101  -8.475 -18.715 -18.715
  824   2HG   LYS 101          1HG       LYS 101  -7.268 -18.363 -18.363
  825   1HD   LYS 101          2HD       LYS 101  -9.097 -16.589 -16.589
  826   2HD   LYS 101          1HD       LYS 101 -10.186 -17.712 -17.712
  827   1HE   LYS 101          2HE       LYS 101  -8.133 -18.722 -18.722
  828   2HE   LYS 101          1HE       LYS 101  -9.685 -18.103 -18.103
  829   1HZ   LYS 101          2HZ       LYS 101  -9.455 -20.173 -20.173
  830   2HZ   LYS 101          1HZ       LYS 101  -9.580 -20.556 -20.556
  831   3HZ   LYS 101          3HZ       LYS 101 -10.839 -19.723 -19.723
  832    H    GLY 102           H        GLY 102  -8.838 -18.868 -18.868
  833   1HA   GLY 102          2HA       GLY 102 -10.606 -18.896 -18.896
  834   2HA   GLY 102          1HA       GLY 102 -10.790 -17.172 -17.172
  835    H    GLU 103           H        GLU 103 -11.231 -17.050 -17.050
  836    HA   GLU 103           HA       GLU 103  -8.978 -16.060 -16.060
  837   1HB   GLU 103          2HB       GLU 103  -8.324 -18.433 -18.433
  838   2HB   GLU 103          1HB       GLU 103  -9.889 -18.829 -18.829
  839   1HG   GLU 103          2HG       GLU 103  -9.417 -17.650 -17.650
  840   2HG   GLU 103          1HG       GLU 103  -8.088 -16.760 -16.760
  841    H    GLY 104           H        GLY 104  -9.671 -14.946 -14.946
  842   1HA   GLY 104          2HA       GLY 104 -12.168 -15.559 -15.559
  843   2HA   GLY 104          1HA       GLY 104 -12.285 -14.120 -14.120
  844    HA   PRO 105           HA       PRO 105 -10.343 -11.893 -11.893
  845   1HB   PRO 105          2HB       PRO 105  -9.483  -9.712  -9.712
  846   2HB   PRO 105          1HB       PRO 105 -11.182  -9.991  -9.991
  847   1HG   PRO 105          2HG       PRO 105  -9.844 -10.253 -10.253
  848   2HG   PRO 105          1HG       PRO 105 -11.557  -9.996  -9.996
  849   1HD   PRO 105          2HD       PRO 105 -10.313 -12.468 -12.468
  850   2HD   PRO 105          1HD       PRO 105 -11.990 -12.237 -12.237
  851    H    LYS 106           H        LYS 106  -8.124 -10.496 -10.496
  852    HA   LYS 106           HA       LYS 106  -5.922 -11.904 -11.904
  853   1HB   LYS 106          2HB       LYS 106  -6.101 -13.063 -13.063
  854   2HB   LYS 106          1HB       LYS 106  -6.234 -11.538 -11.538
  855   1HG   LYS 106          2HG       LYS 106  -3.986 -11.050 -11.050
  856   2HG   LYS 106          1HG       LYS 106  -3.826 -11.981 -11.981
  857   1HD   LYS 106          2HD       LYS 106  -3.769 -14.046 -14.046
  858   2HD   LYS 106          1HD       LYS 106  -4.403 -13.324 -13.324
  859   1HE   LYS 106          2HE       LYS 106  -1.695 -12.707 -12.707
  860   2HE   LYS 106          1HE       LYS 106  -1.968 -13.755 -13.755
  861   1HZ   LYS 106          2HZ       LYS 106  -3.185 -11.717 -11.717
  862   2HZ   LYS 106          1HZ       LYS 106  -2.318 -10.838 -10.838
  863   3HZ   LYS 106          3HZ       LYS 106  -1.486 -11.730 -11.730
  864    H    THR 107           H        THR 107  -4.255 -10.471 -10.471
  865    HA   THR 107           HA       THR 107  -4.532  -7.709  -7.709
  866    HB   THR 107           HB       THR 107  -3.197  -7.344  -7.344
  867    HG1  THR 107           HG1      THR 107  -3.727  -9.614  -9.614
  868   1HG2  THR 107          1HG2      THR 107  -5.183  -6.132  -6.132
  869   2HG2  THR 107          3HG2      THR 107  -6.208  -7.364  -7.364
  870   3HG2  THR 107          2HG2      THR 107  -5.223  -6.313  -6.313
  871    H    SER 108           H        SER 108  -2.704  -6.615  -6.615
  872    HA   SER 108           HA       SER 108  -0.018  -7.605  -7.605
  873   1HB   SER 108          2HB       SER 108  -0.963  -7.622  -7.622
  874   2HB   SER 108          1HB       SER 108   0.605  -8.140  -8.140
  875    HG   SER 108           HG       SER 108  -0.239  -9.995  -9.995
  876    H    TRP 109           H        TRP 109   1.398  -5.814  -5.814
  877    HA   TRP 109           HA       TRP 109   0.449  -3.508  -3.508
  878   1HB   TRP 109          2HB       TRP 109   0.979  -1.957  -1.957
  879   2HB   TRP 109          1HB       TRP 109  -0.430  -2.978  -2.978
  880    HD1  TRP 109           HD1      TRP 109  -0.362  -4.651  -4.651
  881    HE1  TRP 109           HE1      TRP 109   1.366  -5.195  -5.195
  882    HE3  TRP 109           HE3      TRP 109   3.670  -2.077  -2.077
  883    HZ2  TRP 109           HZ2      TRP 109   4.095  -4.616  -4.616
  884    HZ3  TRP 109           HZ3      TRP 109   5.812  -2.095  -2.095
  885    HH2  TRP 109           HH2      TRP 109   6.035  -3.355  -3.355
  886    H    THR 110           H        THR 110   2.210  -1.703  -1.703
  887    HA   THR 110           HA       THR 110   4.929  -2.886  -2.886
  888    HB   THR 110           HB       THR 110   5.511  -2.535  -2.535
  889    HG1  THR 110           HG1      THR 110   4.809  -0.831  -0.831
  890   1HG2  THR 110          1HG2      THR 110   3.415  -4.000  -4.000
  891   2HG2  THR 110          3HG2      THR 110   2.526  -2.585  -2.585
  892   3HG2  THR 110          2HG2      THR 110   3.794  -3.289  -3.289
  893    H    MET 111           H        MET 111   6.598  -1.060  -1.060
  894    HA   MET 111           HA       MET 111   5.659   1.645   1.645
  895   1HB   MET 111          2HB       MET 111   7.199   1.710   1.710
  896   2HB   MET 111          1HB       MET 111   5.743   0.737   0.737
  897   1HG   MET 111          2HG       MET 111   7.074  -1.289  -1.289
  898   2HG   MET 111          1HG       MET 111   8.520  -0.281  -0.281
  899   1HE   MET 111          2HE       MET 111   8.614   1.520   1.520
  900   2HE   MET 111          1HE       MET 111   7.605   1.596   1.596
  901   3HE   MET 111          3HE       MET 111   9.238   0.921   0.921
  902    H    GLU 112           H        GLU 112   6.963   3.025   3.025
  903    HA   GLU 112           HA       GLU 112   9.705   2.054   2.054
  904   1HB   GLU 112          2HB       GLU 112   8.257   2.118   2.118
  905   2HB   GLU 112          1HB       GLU 112   7.815   3.788   3.788
  906   1HG   GLU 112          2HG       GLU 112  10.081   4.540   4.540
  907   2HG   GLU 112          1HG       GLU 112  10.660   2.881   2.881
  908    H    LEU 113           H        LEU 113  11.359   3.675   3.675
  909    HA   LEU 113           HA       LEU 113  10.743   6.141   6.141
  910   1HB   LEU 113          2HB       LEU 113  12.589   4.151   4.151
  911   2HB   LEU 113          1HB       LEU 113  13.560   5.340   5.340
  912    HG   LEU 113           HG       LEU 113  13.496   5.592   5.592
  913   1HD1  LEU 113          1HD1      LEU 113  13.121   7.618   7.618
  914   2HD1  LEU 113          3HD1      LEU 113  12.484   8.152   8.152
  915   3HD1  LEU 113          2HD1      LEU 113  14.165   7.640   7.640
  916   1HD2  LEU 113          1HD2      LEU 113  10.743   5.312   5.312
  917   2HD2  LEU 113          3HD2      LEU 113  11.543   5.775   5.775
  918   3HD2  LEU 113          2HD2      LEU 113  10.959   7.016   7.016
  919    H    THR 114           H        THR 114  11.503   8.141   8.141
  920    HA   THR 114           HA       THR 114  12.158   7.947   7.947
  921    HB   THR 114           HB       THR 114  11.634  10.307  10.307
  922    HG1  THR 114           HG1      THR 114  11.677  11.542  11.542
  923   1HG2  THR 114          1HG2      THR 114   9.747   8.671   8.671
  924   2HG2  THR 114          3HG2      THR 114   9.675   8.966   8.966
  925   3HG2  THR 114          2HG2      THR 114   9.324  10.272  10.272
  926    H    ASN 115           H        ASN 115  13.913   9.344   9.344
  927    HA   ASN 115           HA       ASN 115  16.392   8.878   8.878
  928   1HB   ASN 115          2HB       ASN 115  15.495  10.373  10.373
  929   2HB   ASN 115          1HB       ASN 115  17.042  10.865  10.865
  930   1HD2  ASN 115          1HD2      ASN 115  16.523   9.353   9.353
  931   2HD2  ASN 115          2HD2      ASN 115  17.397   7.906   7.906
  932    H    ASP 116           H        ASP 116  14.052  11.397  11.397
  933    HA   ASP 116           HA       ASP 116  15.976  13.277  13.277
  934   1HB   ASP 116          2HB       ASP 116  13.549  13.607  13.607
  935   2HB   ASP 116          1HB       ASP 116  13.111  13.795  13.795
  936    H    GLY 117           H        GLY 117  13.709  10.811  10.811
  937   1HA   GLY 117          2HA       GLY 117  14.306   9.844   9.844
  938   2HA   GLY 117          1HA       GLY 117  14.255  11.506  11.506
  939    H    GLU 118           H        GLU 118  11.880  11.614  11.614
  940    HA   GLU 118           HA       GLU 118   9.749  11.641  11.641
  941   1HB   GLU 118          2HB       GLU 118   9.601  11.066  11.066
  942   2HB   GLU 118          1HB       GLU 118   8.262  11.595  11.595
  943   1HG   GLU 118          2HG       GLU 118   9.552  13.664  13.664
  944   2HG   GLU 118          1HG       GLU 118  10.797  13.149  13.149
  945    H    LEU 119           H        LEU 119   7.781  10.067  10.067
  946    HA   LEU 119           HA       LEU 119   8.686   7.280   7.280
  947   1HB   LEU 119          2HB       LEU 119   9.110   7.842   7.842
  948   2HB   LEU 119          1HB       LEU 119   7.383   8.138   8.138
  949    HG   LEU 119           HG       LEU 119   8.413   5.521   5.521
  950   1HD1  LEU 119          1HD1      LEU 119   8.266   6.486   6.486
  951   2HD1  LEU 119          3HD1      LEU 119   7.971   4.786   4.786
  952   3HD1  LEU 119          2HD1      LEU 119   9.518   5.522   5.522
  953   1HD2  LEU 119          2HD2      LEU 119   5.846   6.627   6.627
  954   2HD2  LEU 119          1HD2      LEU 119   6.109   5.546   5.546
  955   3HD2  LEU 119          3HD2      LEU 119   6.193   4.920   4.920
  956    H    ILE 120           H        ILE 120   7.199   6.533   6.533
  957    HA   ILE 120           HA       ILE 120   4.352   7.365   7.365
  958    HB   ILE 120           HB       ILE 120   5.183   7.874   7.874
  959   1HG1  ILE 120          2HG1      ILE 120   3.559   5.330   5.330
  960   2HG1  ILE 120          1HG1      ILE 120   2.862   6.849   6.849
  961   1HG2  ILE 120          2HG2      ILE 120   6.267   5.098   5.098
  962   2HG2  ILE 120          1HG2      ILE 120   5.782   5.663   5.663
  963   3HG2  ILE 120          3HG2      ILE 120   7.013   6.540   6.540
  964   1HD1  ILE 120          3HD1      ILE 120   4.433   6.804   6.804
  965   2HD1  ILE 120          2HD1      ILE 120   2.756   6.258   6.258
  966   3HD1  ILE 120          1HD1      ILE 120   3.148   7.905   7.905
  967    H    LEU 121           H        LEU 121   2.725   5.628   5.628
  968    HA   LEU 121           HA       LEU 121   3.850   2.907   2.907
  969   1HB   LEU 121          2HB       LEU 121   3.496   3.869   3.869
  970   2HB   LEU 121          1HB       LEU 121   1.829   4.260   4.260
  971    HG   LEU 121           HG       LEU 121   2.275   1.495   1.495
  972   1HD1  LEU 121          1HD1      LEU 121   4.143   1.840   1.840
  973   2HD1  LEU 121          3HD1      LEU 121   2.881   2.174   2.174
  974   3HD1  LEU 121          2HD1      LEU 121   2.960   0.595   0.595
  975   1HD2  LEU 121          3HD2      LEU 121   0.658   2.973   2.973
  976   2HD2  LEU 121          2HD2      LEU 121   0.104   2.412   2.412
  977   3HD2  LEU 121          1HD2      LEU 121   0.501   1.245   1.245
  978    H    THR 122           H        THR 122   2.707   1.403   1.403
  979    HA   THR 122           HA       THR 122   0.038   2.224   2.224
  980    HB   THR 122           HB       THR 122   0.808  -0.048  -0.048
  981    HG1  THR 122           HG1      THR 122   2.933   0.348   0.348
  982   1HG2  THR 122          2HG2      THR 122   0.027   2.522   2.522
  983   2HG2  THR 122          1HG2      THR 122   1.672   2.514   2.514
  984   3HG2  THR 122          3HG2      THR 122   0.493   1.344   1.344
  985    H    MET 123           H        MET 123  -1.556   0.394   0.394
  986    HA   MET 123           HA       MET 123  -1.001  -1.753  -1.753
  987   1HB   MET 123          2HB       MET 123  -3.411   0.087   0.087
  988   2HB   MET 123          1HB       MET 123  -3.152  -1.313  -1.313
  989   1HG   MET 123          2HG       MET 123  -0.838  -0.071  -0.071
  990   2HG   MET 123          1HG       MET 123  -1.790   1.344   1.344
  991   1HE   MET 123          1HE       MET 123  -0.793  -1.232  -1.232
  992   2HE   MET 123          3HE       MET 123  -1.299  -0.748  -0.748
  993   3HE   MET 123          2HE       MET 123  -2.256  -1.910  -1.910
  994    H    THR 124           H        THR 124  -2.558  -3.510  -3.510
  995    HA   THR 124           HA       THR 124  -4.290  -3.519  -3.519
  996    HB   THR 124           HB       THR 124  -2.467  -5.845  -5.845
  997    HG1  THR 124           HG1      THR 124  -0.881  -4.831  -4.831
  998   1HG2  THR 124          3HG2      THR 124  -4.500  -6.063  -6.063
  999   2HG2  THR 124          2HG2      THR 124  -3.832  -4.818  -4.818
 1000   3HG2  THR 124          1HG2      THR 124  -2.994  -6.360  -6.360
 1001    H    ALA 125           H        ALA 125  -5.938  -5.122  -5.122
 1002    HA   ALA 125           HA       ALA 125  -6.098  -6.839  -6.839
 1003   1HB   ALA 125          3HB       ALA 125  -7.486  -4.255  -4.255
 1004   2HB   ALA 125          2HB       ALA 125  -8.563  -5.607  -5.607
 1005   3HB   ALA 125          1HB       ALA 125  -7.190  -5.275  -5.275
 1006    H    ASP 126           H        ASP 126  -6.267  -8.536  -8.536
 1007    HA   ASP 126           HA       ASP 126  -7.570 -10.120 -10.120
 1008   1HB   ASP 126          2HB       ASP 126  -9.518  -8.531  -8.531
 1009   2HB   ASP 126          1HB       ASP 126  -9.920  -8.459  -8.459
 1010    H    ASP 127           H        ASP 127  -8.891  -7.103  -7.103
 1011    HA   ASP 127           HA       ASP 127  -7.131  -7.353  -7.353
 1012   1HB   ASP 127          2HB       ASP 127  -9.586  -8.577  -8.577
 1013   2HB   ASP 127          1HB       ASP 127  -9.957  -6.974  -6.974
 1014    H    VAL 128           H        VAL 128  -7.795  -5.509  -5.509
 1015    HA   VAL 128           HA       VAL 128  -8.394  -3.066  -3.066
 1016    HB   VAL 128           HB       VAL 128  -9.256  -2.053  -2.053
 1017   1HG1  VAL 128          1HG1      VAL 128 -10.300  -4.807  -4.807
 1018   2HG1  VAL 128          3HG1      VAL 128 -11.089  -3.796  -3.796
 1019   3HG1  VAL 128          2HG1      VAL 128 -10.968  -3.241  -3.241
 1020   1HG2  VAL 128          1HG2      VAL 128  -7.898  -4.392  -4.392
 1021   2HG2  VAL 128          3HG2      VAL 128  -8.176  -2.785  -2.785
 1022   3HG2  VAL 128          2HG2      VAL 128  -9.460  -3.993  -3.993
 1023    H    VAL 129           H        VAL 129  -7.357  -1.099  -1.099
 1024    HA   VAL 129           HA       VAL 129  -4.830  -1.813  -1.813
 1025    HB   VAL 129           HB       VAL 129  -4.984  -0.951  -0.951
 1026   1HG1  VAL 129          2HG1      VAL 129  -2.920   0.055   0.055
 1027   2HG1  VAL 129          1HG1      VAL 129  -2.588  -0.063  -0.063
 1028   3HG1  VAL 129          3HG1      VAL 129  -3.871   0.998   0.998
 1029   1HG2  VAL 129          2HG2      VAL 129  -3.459  -2.844  -2.844
 1030   2HG2  VAL 129          1HG2      VAL 129  -4.178  -3.101  -3.101
 1031   3HG2  VAL 129          3HG2      VAL 129  -2.649  -2.234  -2.234
 1032    H    CYS 130           H        CYS 130  -4.722  -0.383  -0.383
 1033    HA   CYS 130           HA       CYS 130  -5.899   2.323   2.323
 1034   1HB   CYS 130          2HB       CYS 130  -6.304   0.656   0.656
 1035   2HB   CYS 130          1HB       CYS 130  -4.817   1.394   1.394
 1036    HG   CYS 130           HG       CYS 130  -5.972   3.654   3.654
 1037    H    THR 131           H        THR 131  -4.408   3.706   3.706
 1038    HA   THR 131           HA       THR 131  -1.576   3.493   3.493
 1039    HB   THR 131           HB       THR 131  -2.844   5.102   5.102
 1040    HG1  THR 131           HG1      THR 131  -2.753   3.181   3.181
 1041   1HG2  THR 131          3HG2      THR 131   0.028   4.750   4.750
 1042   2HG2  THR 131          2HG2      THR 131  -0.426   5.375   5.375
 1043   3HG2  THR 131          1HG2      THR 131  -0.879   6.258   6.258
 1044    H    ARG 132           H        ARG 132  -0.544   5.244   5.244
 1045    HA   ARG 132           HA       ARG 132  -2.032   7.737   7.737
 1046   1HB   ARG 132          2HB       ARG 132  -1.017   5.976   5.976
 1047   2HB   ARG 132          1HB       ARG 132  -1.737   7.574   7.574
 1048   1HG   ARG 132          2HG       ARG 132  -3.781   6.609   6.609
 1049   2HG   ARG 132          1HG       ARG 132  -3.063   5.026   5.026
 1050   1HD   ARG 132          2HD       ARG 132  -3.235   6.882   6.882
 1051   2HD   ARG 132          1HD       ARG 132  -4.749   6.187   6.187
 1052    HE   ARG 132           HE       ARG 132  -2.627   4.210   4.210
 1053   1HH1  ARG 132          1HH2      ARG 132  -3.571   6.061   6.061
 1054   2HH1  ARG 132          2HH2      ARG 132  -4.557   4.898   4.898
 1055   1HH2  ARG 132          2HH1      ARG 132  -4.601   2.667   2.667
 1056   2HH2  ARG 132          1HH1      ARG 132  -5.140   2.977   2.977
 1057    H    VAL 133           H        VAL 133  -0.507   9.348   9.348
 1058    HA   VAL 133           HA       VAL 133   2.344   8.618   8.618
 1059    HB   VAL 133           HB       VAL 133   1.013  11.277  11.277
 1060   1HG1  VAL 133          3HG1      VAL 133   3.636  10.857  10.857
 1061   2HG1  VAL 133          2HG1      VAL 133   3.672  10.637  10.637
 1062   3HG1  VAL 133          1HG1      VAL 133   3.077  12.148  12.148
 1063   1HG2  VAL 133          2HG2      VAL 133   1.663   8.897   8.897
 1064   2HG2  VAL 133          1HG2      VAL 133   0.287   9.995   9.995
 1065   3HG2  VAL 133          3HG2      VAL 133   1.862  10.495  10.495
 1066    H    TYR 134           H        TYR 134   3.763   9.152   9.152
 1067    HA   TYR 134           HA       TYR 134   2.653  10.835  10.835
 1068   1HB   TYR 134          2HB       TYR 134   4.138   8.231   8.231
 1069   2HB   TYR 134          1HB       TYR 134   4.321   9.381   9.381
 1070    HD1  TYR 134           HD2      TYR 134   2.420  10.029  10.029
 1071    HD2  TYR 134           HD1      TYR 134   1.997   7.133   7.133
 1072    HE1  TYR 134           HE2      TYR 134   0.244   9.313   9.313
 1073    HE2  TYR 134           HE1      TYR 134  -0.183   6.418   6.418
 1074    HH   TYR 134           HH       TYR 134  -1.851   8.210   8.210
 1075    H    VAL 135           H        VAL 135   3.832  12.601  12.601
 1076    HA   VAL 135           HA       VAL 135   6.665  12.610  12.610
 1077    HB   VAL 135           HB       VAL 135   4.566  14.455  14.455
 1078   1HG1  VAL 135          3HG1      VAL 135   5.032  15.381  15.381
 1079   2HG1  VAL 135          2HG1      VAL 135   6.713  15.634  15.634
 1080   3HG1  VAL 135          1HG1      VAL 135   5.429  16.531  16.531
 1081   1HG2  VAL 135          1HG2      VAL 135   7.561  14.520  14.520
 1082   2HG2  VAL 135          3HG2      VAL 135   6.315  14.096  14.096
 1083   3HG2  VAL 135          2HG2      VAL 135   6.489  15.767  15.767
 1084    H    ARG 136           H        ARG 136   8.263  12.893  12.893
 1085    HA   ARG 136           HA       ARG 136   7.872  12.316  12.316
 1086   1HB   ARG 136          2HB       ARG 136  10.019  13.413  13.413
 1087   2HB   ARG 136          1HB       ARG 136   9.920  14.248  14.248
 1088   1HG   ARG 136          2HG       ARG 136  10.303  12.333  12.333
 1089   2HG   ARG 136          1HG       ARG 136   9.665  11.273  11.273
 1090   1HD   ARG 136          2HD       ARG 136  12.345  12.682  12.682
 1091   2HD   ARG 136          1HD       ARG 136  12.043  10.945  10.945
 1092    HE   ARG 136           HE       ARG 136  10.844  11.852  11.852
 1093   1HH1  ARG 136          1HH2      ARG 136  13.590  10.345  10.345
 1094   2HH1  ARG 136          2HH2      ARG 136  14.604  11.220  11.220
 1095   1HH2  ARG 136          2HH1      ARG 136  12.303  13.764  13.764
 1096   2HH2  ARG 136          1HH1      ARG 136  13.876  13.157  13.157
 1097    H    GLU 137           HN       GLU 137   6.911  13.242  13.242
 1098    HA   GLU 137           HA       GLU 137   5.475  14.817  14.817
 1099   1HB   GLU 137          2HB       GLU 137   7.900  15.063  15.063
 1100   2HB   GLU 137          1HB       GLU 137   7.952  16.516  16.516
 1101   1HG   GLU 137          2HG       GLU 137   5.721  17.116  17.116
 1102   2HG   GLU 137          1HG       GLU 137   6.297  15.962  15.962

  Start of MODEL    2
    1   1H    PRO   1          1H        PRO   1  16.826   7.119   7.119
    2   2H    PRO   1          2H        PRO   1  16.286   6.371   6.371
    3    HA   PRO   1           HA       PRO   1  16.575   4.361   4.361
    4   1HB   PRO   1          2HB       PRO   1  19.236   4.472   4.472
    5   2HB   PRO   1          1HB       PRO   1  18.697   3.712   3.712
    6   1HG   PRO   1          2HG       PRO   1  20.210   6.126   6.126
    7   2HG   PRO   1          1HG       PRO   1  19.689   5.349   5.349
    8   1HD   PRO   1          1HD       PRO   1  18.682   7.758   7.758
    9   2HD   PRO   1          2HD       PRO   1  18.138   6.953   6.953
   10    H    ASN   2           H        ASN   2  15.438   6.311   6.311
   11    HA   ASN   2           HA       ASN   2  15.960   5.028   5.028
   12   1HB   ASN   2          2HB       ASN   2  16.599   7.904   7.904
   13   2HB   ASN   2          1HB       ASN   2  16.045   7.448   7.448
   14   1HD2  ASN   2          1HD2      ASN   2  17.429   6.018   6.018
   15   2HD2  ASN   2          2HD2      ASN   2  19.050   5.749   5.749
   16    H    PHE   3           H        PHE   3  14.000   4.605   4.605
   17    HA   PHE   3           HA       PHE   3  11.663   6.218   6.218
   18   1HB   PHE   3          2HB       PHE   3  11.870   3.564   3.564
   19   2HB   PHE   3          1HB       PHE   3  10.367   4.345   4.345
   20    HD1  PHE   3           HD1      PHE   3  13.615   3.450   3.450
   21    HD2  PHE   3           HD2      PHE   3   9.319   3.457   3.457
   22    HE1  PHE   3           HE1      PHE   3  13.693   2.332   2.332
   23    HE2  PHE   3           HE2      PHE   3   9.408   2.327   2.327
   24    HZ   PHE   3           HZ       PHE   3  11.595   1.758   1.758
   25    H    SER   4           H        SER   4  13.821   5.860   5.860
   26    HA   SER   4           HA       SER   4  12.065   6.218   6.218
   27   1HB   SER   4          2HB       SER   4  14.633   5.604   5.604
   28   2HB   SER   4          1HB       SER   4  14.834   7.340   7.340
   29    HG   SER   4           HG       SER   4  14.734   6.478   6.478
   30    H    GLY   5           H        GLY   5  10.812   7.903   7.903
   31   1HA   GLY   5          2HA       GLY   5  11.520  10.494  10.494
   32   2HA   GLY   5          1HA       GLY   5  11.225  10.530  10.530
   33    H    ASN   6           H        ASN   6   9.414  12.038  12.038
   34    HA   ASN   6           HA       ASN   6   7.077  10.416  10.416
   35   1HB   ASN   6          2HB       ASN   6   7.814  13.328  13.328
   36   2HB   ASN   6          1HB       ASN   6   6.101  12.902  12.902
   37   1HD2  ASN   6          2HD2      ASN   6   6.505  11.008  11.008
   38   2HD2  ASN   6          1HD2      ASN   6   5.956  10.653  10.653
   39    H    TRP   7           H        TRP   7   4.981  11.170  11.170
   40    HA   TRP   7           HA       TRP   7   5.612  11.819  11.819
   41   1HB   TRP   7          2HB       TRP   7   4.406   9.189   9.189
   42   2HB   TRP   7          1HB       TRP   7   4.455   9.745   9.745
   43    HD1  TRP   7           HD1      TRP   7   6.568   8.150   8.150
   44    HE1  TRP   7           HE1      TRP   7   8.974   7.797   7.797
   45    HE3  TRP   7           HE3      TRP   7   6.280  10.853  10.853
   46    HZ2  TRP   7           HZ2      TRP   7  10.557   8.597   8.597
   47    HZ3  TRP   7           HZ3      TRP   7   8.240  11.081  11.081
   48    HH2  TRP   7           HH2      TRP   7  10.362   9.953   9.953
   49    H    LYS   8           H        LYS   8   4.088  13.032  13.032
   50    HA   LYS   8           HA       LYS   8   1.321  12.888  12.888
   51   1HB   LYS   8          2HB       LYS   8   2.965  15.272  15.272
   52   2HB   LYS   8          1HB       LYS   8   1.203  15.334  15.334
   53   1HG   LYS   8          2HG       LYS   8   1.149  14.751  14.751
   54   2HG   LYS   8          1HG       LYS   8   2.907  14.614  14.614
   55   1HD   LYS   8          2HD       LYS   8   3.223  16.885  16.885
   56   2HD   LYS   8          1HD       LYS   8   1.793  17.170  17.170
   57   1HE   LYS   8          2HE       LYS   8   1.288  16.122  16.122
   58   2HE   LYS   8          1HE       LYS   8   1.900  17.773  17.773
   59   1HZ   LYS   8          3HZ       LYS   8  -0.399  16.790  16.790
   60   2HZ   LYS   8          2HZ       LYS   8  -0.565  17.562  17.562
   61   3HZ   LYS   8          1HZ       LYS   8   0.114  18.396  18.396
   62    H    ILE   9           H        ILE   9   0.070  11.971  11.971
   63    HA   ILE   9           HA       ILE   9   0.828  11.429  11.429
   64    HB   ILE   9           HB       ILE   9  -0.897  10.179  10.179
   65   1HG1  ILE   9          2HG1      ILE   9  -2.070  11.643  11.643
   66   2HG1  ILE   9          1HG1      ILE   9  -0.983  10.259  10.259
   67   1HG2  ILE   9          1HG2      ILE   9  -2.360  12.824  12.824
   68   2HG2  ILE   9          3HG2      ILE   9  -3.190  11.295  11.295
   69   3HG2  ILE   9          2HG2      ILE   9  -1.943  11.846  11.846
   70   1HD1  ILE   9          2HD1      ILE   9  -3.362   9.879   9.879
   71   2HD1  ILE   9          1HD1      ILE   9  -3.696  10.041  10.041
   72   3HD1  ILE   9          3HD1      ILE   9  -2.617   8.772   8.772
   73    H    ILE  10           H        ILE  10   0.084  12.255  12.255
   74    HA   ILE  10           HA       ILE  10  -0.927  15.063  15.063
   75    HB   ILE  10           HB       ILE  10   0.517  15.565  15.565
   76   1HG1  ILE  10          2HG1      ILE  10   2.459  13.650  13.650
   77   2HG1  ILE  10          1HG1      ILE  10   1.043  12.650  12.650
   78   1HG2  ILE  10          3HG2      ILE  10   1.302  15.936  15.936
   79   2HG2  ILE  10          2HG2      ILE  10   2.101  14.365  14.365
   80   3HG2  ILE  10          1HG2      ILE  10   2.619  15.661  15.661
   81   1HD1  ILE  10          1HD1      ILE  10  -0.073  14.064  14.064
   82   2HD1  ILE  10          3HD1      ILE  10   1.587  14.460  14.460
   83   3HD1  ILE  10          2HD1      ILE  10   1.051  12.780  12.780
   84    H    ARG  11           H        ARG  11  -0.818  11.944  11.944
   85    HA   ARG  11           HA       ARG  11  -3.356  12.673  12.673
   86   1HB   ARG  11          2HB       ARG  11  -0.768  11.965  11.965
   87   2HB   ARG  11          1HB       ARG  11  -2.202  11.172  11.172
   88   1HG   ARG  11          2HG       ARG  11  -3.291  13.400  13.400
   89   2HG   ARG  11          1HG       ARG  11  -1.801  14.160  14.160
   90   1HD   ARG  11          2HD       ARG  11  -0.714  12.720  12.720
   91   2HD   ARG  11          1HD       ARG  11  -2.353  12.746  12.746
   92    HE   ARG  11           HE       ARG  11  -0.898  15.272  15.272
   93   1HH1  ARG  11          1HH2      ARG  11  -3.798  15.230  15.230
   94   2HH1  ARG  11          2HH2      ARG  11  -3.616  15.583  15.583
   95   1HH2  ARG  11          2HH1      ARG  11  -0.220  14.885  14.885
   96   2HH2  ARG  11          1HH1      ARG  11  -1.591  15.389  15.389
   97    H    SER  12           H        SER  12  -4.380  10.579  10.579
   98    HA   SER  12           HA       SER  12  -3.544   7.993   7.993
   99   1HB   SER  12          2HB       SER  12  -3.789   8.627   8.627
  100   2HB   SER  12          1HB       SER  12  -5.314   9.446   9.446
  101    HG   SER  12           HG       SER  12  -6.284   7.486   7.486
  102    H    GLU  13           H        GLU  13  -5.032   6.424   6.424
  103    HA   GLU  13           HA       GLU  13  -7.697   7.332   7.332
  104   1HB   GLU  13          2HB       GLU  13  -7.285   6.154   6.154
  105   2HB   GLU  13          1HB       GLU  13  -6.364   7.641   7.641
  106   1HG   GLU  13          2HG       GLU  13  -5.070   5.149   5.149
  107   2HG   GLU  13          1HG       GLU  13  -5.227   5.312   5.312
  108    H    ASN  14           H        ASN  14  -8.998   5.383   5.383
  109    HA   ASN  14           HA       ASN  14  -9.925   3.294   3.294
  110   1HB   ASN  14          2HB       ASN  14  -7.168   2.378   2.378
  111   2HB   ASN  14          1HB       ASN  14  -8.478   1.413   1.413
  112   1HD2  ASN  14          2HD2      ASN  14  -5.878   3.042   3.042
  113   2HD2  ASN  14          1HD2      ASN  14  -5.610   2.936   2.936
  114    H    PHE  15           H        PHE  15  -9.632   5.300   5.300
  115    HA   PHE  15           HA       PHE  15  -8.939   3.913   3.913
  116   1HB   PHE  15          2HB       PHE  15  -8.908   6.438   6.438
  117   2HB   PHE  15          1HB       PHE  15 -10.659   6.377   6.377
  118    HD1  PHE  15           HD2      PHE  15  -9.875   3.869   3.869
  119    HD2  PHE  15           HD1      PHE  15  -9.564   8.130   8.130
  120    HE1  PHE  15           HE2      PHE  15  -9.850   4.061   4.061
  121    HE2  PHE  15           HE1      PHE  15  -9.524   8.315   8.315
  122    HZ   PHE  15           HZ       PHE  15  -9.667   6.269   6.269
  123    H    GLU  16           H        GLU  16 -12.098   5.218   5.218
  124    HA   GLU  16           HA       GLU  16 -13.650   3.866   3.866
  125   1HB   GLU  16          2HB       GLU  16 -14.315   4.879   4.879
  126   2HB   GLU  16          1HB       GLU  16 -15.532   4.188   4.188
  127   1HG   GLU  16          2HG       GLU  16 -14.994   5.861   5.861
  128   2HG   GLU  16          1HG       GLU  16 -13.742   6.541   6.541
  129    H    GLU  17           H        GLU  17 -12.514   2.748   2.748
  130    HA   GLU  17           HA       GLU  17 -14.203   0.427   0.427
  131   1HB   GLU  17          2HB       GLU  17 -12.773  -0.392  -0.392
  132   2HB   GLU  17          1HB       GLU  17 -13.194   1.302   1.302
  133   1HG   GLU  17          2HG       GLU  17 -11.001   1.713   1.713
  134   2HG   GLU  17          1HG       GLU  17 -10.857   1.403   1.403
  135    H    LEU  18           H        LEU  18 -11.061   1.081   1.081
  136    HA   LEU  18           HA       LEU  18 -10.457  -1.717  -1.717
  137   1HB   LEU  18          2HB       LEU  18  -8.736   0.176   0.176
  138   2HB   LEU  18          1HB       LEU  18  -9.292   0.671   0.671
  139    HG   LEU  18           HG       LEU  18  -8.837  -1.661  -1.661
  140   1HD1  LEU  18          1HD1      LEU  18  -8.033  -1.916  -1.916
  141   2HD1  LEU  18          3HD1      LEU  18  -7.052  -2.766  -2.766
  142   3HD1  LEU  18          2HD1      LEU  18  -8.778  -3.103  -3.103
  143   1HD2  LEU  18          1HD2      LEU  18  -7.053   0.466   0.466
  144   2HD2  LEU  18          3HD2      LEU  18  -6.817  -0.900  -0.900
  145   3HD2  LEU  18          2HD2      LEU  18  -6.176  -0.961  -0.961
  146    H    LEU  19           H        LEU  19 -12.373   0.717   0.717
  147    HA   LEU  19           HA       LEU  19 -12.273  -0.702  -0.702
  148   1HB   LEU  19          2HB       LEU  19 -14.120   1.592   1.592
  149   2HB   LEU  19          1HB       LEU  19 -13.497   1.118   1.118
  150    HG   LEU  19           HG       LEU  19 -12.040   2.516   2.516
  151   1HD1  LEU  19          2HD1      LEU  19 -13.358   3.435   3.435
  152   2HD1  LEU  19          1HD1      LEU  19 -11.661   3.453   3.453
  153   3HD1  LEU  19          3HD1      LEU  19 -12.184   4.330   4.330
  154   1HD2  LEU  19          3HD2      LEU  19 -10.592   0.651   0.651
  155   2HD2  LEU  19          2HD2      LEU  19  -9.935   2.256   2.256
  156   3HD2  LEU  19          1HD2      LEU  19 -10.733   1.379   1.379
  157    H    LYS  20           H        LYS  20 -14.132  -0.735  -0.735
  158    HA   LYS  20           HA       LYS  20 -16.527  -1.884  -1.884
  159   1HB   LYS  20          2HB       LYS  20 -16.047  -2.053  -2.053
  160   2HB   LYS  20          1HB       LYS  20 -17.561  -1.828  -1.828
  161   1HG   LYS  20          2HG       LYS  20 -16.095   0.442   0.442
  162   2HG   LYS  20          1HG       LYS  20 -15.688   0.167   0.167
  163   1HD   LYS  20          2HD       LYS  20 -18.498   0.348   0.348
  164   2HD   LYS  20          1HD       LYS  20 -17.674   1.618   1.618
  165   1HE   LYS  20          2HE       LYS  20 -18.176  -1.157  -1.157
  166   2HE   LYS  20          1HE       LYS  20 -19.227   0.226   0.226
  167   1HZ   LYS  20          1HZ       LYS  20 -17.050   1.361   1.361
  168   2HZ   LYS  20          3HZ       LYS  20 -16.448  -0.218  -0.218
  169   3HZ   LYS  20          2HZ       LYS  20 -17.794   0.263   0.263
  170    H    VAL  21           H        VAL  21 -13.665  -2.860  -2.860
  171    HA   VAL  21           HA       VAL  21 -14.415  -5.633  -5.633
  172    HB   VAL  21           HB       VAL  21 -12.688  -4.442  -4.442
  173   1HG1  VAL  21          2HG1      VAL  21 -11.707  -3.135  -3.135
  174   2HG1  VAL  21          1HG1      VAL  21 -10.983  -4.606  -4.606
  175   3HG1  VAL  21          3HG1      VAL  21 -10.492  -3.990  -3.990
  176   1HG2  VAL  21          2HG2      VAL  21 -12.747  -6.980  -6.980
  177   2HG2  VAL  21          1HG2      VAL  21 -11.222  -6.314  -6.314
  178   3HG2  VAL  21          3HG2      VAL  21 -11.411  -6.717  -6.717
  179    H    LEU  22           H        LEU  22 -12.592  -3.762  -3.762
  180    HA   LEU  22           HA       LEU  22 -11.703  -5.929  -5.929
  181   1HB   LEU  22          2HB       LEU  22 -11.810  -2.975  -2.975
  182   2HB   LEU  22          1HB       LEU  22 -11.879  -3.717  -3.717
  183    HG   LEU  22           HG       LEU  22  -9.794  -4.892  -4.892
  184   1HD1  LEU  22          2HD1      LEU  22 -10.197  -5.290  -5.290
  185   2HD1  LEU  22          1HD1      LEU  22  -9.776  -3.607  -3.607
  186   3HD1  LEU  22          3HD1      LEU  22  -8.573  -4.712  -4.712
  187   1HD2  LEU  22          2HD2      LEU  22  -9.865  -2.397  -2.397
  188   2HD2  LEU  22          1HD2      LEU  22  -8.334  -3.009  -3.009
  189   3HD2  LEU  22          3HD2      LEU  22  -9.408  -2.082  -2.082
  190    H    GLY  23           H        GLY  23 -14.401  -3.661  -3.661
  191   1HA   GLY  23          2HA       GLY  23 -15.607  -5.219  -5.219
  192   2HA   GLY  23          1HA       GLY  23 -16.068  -3.583  -3.583
  193    H    VAL  24           H        VAL  24 -18.263  -4.512  -4.512
  194    HA   VAL  24           HA       VAL  24 -19.040  -5.600  -5.600
  195    HB   VAL  24           HB       VAL  24 -20.674  -7.123  -7.123
  196   1HG1  VAL  24          1HG1      VAL  24 -18.302  -7.769  -7.769
  197   2HG1  VAL  24          3HG1      VAL  24 -17.859  -7.700  -7.700
  198   3HG1  VAL  24          2HG1      VAL  24 -19.084  -8.845  -8.845
  199   1HG2  VAL  24          3HG2      VAL  24 -19.138  -6.175  -6.175
  200   2HG2  VAL  24          2HG2      VAL  24 -20.874  -6.051  -6.051
  201   3HG2  VAL  24          1HG2      VAL  24 -20.136  -7.628  -7.628
  202    H    ASN  25           H        ASN  25 -20.097  -4.103  -4.103
  203    HA   ASN  25           HA       ASN  25 -22.720  -3.354  -3.354
  204   1HB   ASN  25          2HB       ASN  25 -21.291  -3.133  -3.133
  205   2HB   ASN  25          1HB       ASN  25 -21.165  -1.484  -1.484
  206   1HD2  ASN  25          2HD2      ASN  25 -24.398  -0.664  -0.664
  207   2HD2  ASN  25          1HD2      ASN  25 -22.851  -0.147  -0.147
  208    H    VAL  26           H        VAL  26 -22.864  -0.569  -0.569
  209    HA   VAL  26           HA       VAL  26 -21.408   0.309   0.309
  210    HB   VAL  26           HB       VAL  26 -23.908   1.678   1.678
  211   1HG1  VAL  26          2HG1      VAL  26 -22.252   2.206   2.206
  212   2HG1  VAL  26          1HG1      VAL  26 -23.218   0.974   0.974
  213   3HG1  VAL  26          3HG1      VAL  26 -23.993   2.424   2.424
  214   1HG2  VAL  26          3HG2      VAL  26 -23.827  -0.946  -0.946
  215   2HG2  VAL  26          2HG2      VAL  26 -24.581  -0.669  -0.669
  216   3HG2  VAL  26          1HG2      VAL  26 -25.249   0.090   0.090
  217    H    MET  27           H        MET  27 -22.792   1.485   1.485
  218    HA   MET  27           HA       MET  27 -21.443   4.036   4.036
  219   1HB   MET  27          2HB       MET  27 -23.424   3.053   3.053
  220   2HB   MET  27          1HB       MET  27 -22.063   2.805   2.805
  221   1HG   MET  27          2HG       MET  27 -21.575   5.088   5.088
  222   2HG   MET  27          1HG       MET  27 -22.387   5.445   5.445
  223   1HE   MET  27          1HE       MET  27 -22.995   7.321   7.321
  224   2HE   MET  27          3HE       MET  27 -24.723   7.487   7.487
  225   3HE   MET  27          2HE       MET  27 -23.560   7.441   7.441
  226    H    LEU  28           H        LEU  28 -20.551   0.828   0.828
  227    HA   LEU  28           HA       LEU  28 -18.357   1.347   1.347
  228   1HB   LEU  28          2HB       LEU  28 -19.388  -0.849  -0.849
  229   2HB   LEU  28          1HB       LEU  28 -17.641  -0.899  -0.899
  230    HG   LEU  28           HG       LEU  28 -18.757  -2.161  -2.161
  231   1HD1  LEU  28          1HD1      LEU  28 -16.652  -0.681  -0.681
  232   2HD1  LEU  28          3HD1      LEU  28 -17.742   0.373   0.373
  233   3HD1  LEU  28          2HD1      LEU  28 -17.502  -1.296  -1.296
  234   1HD2  LEU  28          3HD2      LEU  28 -20.084   0.501   0.501
  235   2HD2  LEU  28          2HD2      LEU  28 -20.883  -0.982  -0.982
  236   3HD2  LEU  28          1HD2      LEU  28 -20.138  -0.895  -0.895
  237    H    ARG  29           H        ARG  29 -18.644   1.860   1.860
  238    HA   ARG  29           HA       ARG  29 -15.718   1.916   1.916
  239   1HB   ARG  29          2HB       ARG  29 -17.865   2.649   2.649
  240   2HB   ARG  29          1HB       ARG  29 -16.193   2.206   2.206
  241   1HG   ARG  29          2HG       ARG  29 -16.860   0.065   0.065
  242   2HG   ARG  29          1HG       ARG  29 -17.255   0.056   0.056
  243   1HD   ARG  29          2HD       ARG  29 -19.495   0.236   0.236
  244   2HD   ARG  29          1HD       ARG  29 -19.274   1.352   1.352
  245    HE   ARG  29           HE       ARG  29 -18.446  -1.374  -1.374
  246   1HH1  ARG  29          2HH1      ARG  29 -20.244   1.166   1.166
  247   2HH1  ARG  29          1HH1      ARG  29 -21.569   0.231   0.231
  248   1HH2  ARG  29          1HH2      ARG  29 -20.506  -2.726  -2.726
  249   2HH2  ARG  29          2HH2      ARG  29 -21.717  -1.969  -1.969
  250    H    LYS  30           H        LYS  30 -18.471   4.168   4.168
  251    HA   LYS  30           HA       LYS  30 -16.907   6.474   6.474
  252   1HB   LYS  30          2HB       LYS  30 -19.531   6.016   6.016
  253   2HB   LYS  30          1HB       LYS  30 -19.457   6.772   6.772
  254   1HG   LYS  30          2HG       LYS  30 -18.483   8.769   8.769
  255   2HG   LYS  30          1HG       LYS  30 -18.182   8.005   8.005
  256   1HD   LYS  30          2HD       LYS  30 -20.407   8.116   8.116
  257   2HD   LYS  30          1HD       LYS  30 -20.995   8.109   8.109
  258   1HE   LYS  30          2HE       LYS  30 -19.329  10.430  10.430
  259   2HE   LYS  30          1HE       LYS  30 -20.992  10.344  10.344
  260   1HZ   LYS  30          2HZ       LYS  30 -21.688  10.024  10.024
  261   2HZ   LYS  30          1HZ       LYS  30 -20.086  10.312  10.312
  262   3HZ   LYS  30          3HZ       LYS  30 -20.968  11.536  11.536
  263    H    ILE  31           H        ILE  31 -17.422   4.815   4.815
  264    HA   ILE  31           HA       ILE  31 -16.814   7.148   7.148
  265    HB   ILE  31           HB       ILE  31 -16.804   4.189   4.189
  266   1HG1  ILE  31          2HG1      ILE  31 -18.878   6.217   6.217
  267   2HG1  ILE  31          1HG1      ILE  31 -18.988   5.424   5.424
  268   1HG2  ILE  31          1HG2      ILE  31 -16.536   6.713   6.713
  269   2HG2  ILE  31          3HG2      ILE  31 -17.081   5.193   5.193
  270   3HG2  ILE  31          2HG2      ILE  31 -15.476   5.304   5.304
  271   1HD1  ILE  31          2HD1      ILE  31 -18.562   3.781   3.781
  272   2HD1  ILE  31          1HD1      ILE  31 -20.183   4.331   4.331
  273   3HD1  ILE  31          3HD1      ILE  31 -19.281   3.301   3.301
  274    H    ALA  32           H        ALA  32 -15.038   4.561   4.561
  275    HA   ALA  32           HA       ALA  32 -12.544   5.169   5.169
  276   1HB   ALA  32          2HB       ALA  32 -13.279   3.318   3.318
  277   2HB   ALA  32          1HB       ALA  32 -11.602   3.575   3.575
  278   3HB   ALA  32          3HB       ALA  32 -12.755   2.892   2.892
  279    H    VAL  33           H        VAL  33 -14.192   6.139   6.139
  280    HA   VAL  33           HA       VAL  33 -11.873   7.275   7.275
  281    HB   VAL  33           HB       VAL  33 -14.786   7.975   7.975
  282   1HG1  VAL  33          1HG1      VAL  33 -12.210   8.284   8.284
  283   2HG1  VAL  33          3HG1      VAL  33 -13.685   8.025   8.025
  284   3HG1  VAL  33          2HG1      VAL  33 -13.559   9.410   9.410
  285   1HG2  VAL  33          3HG2      VAL  33 -13.830   5.392   5.392
  286   2HG2  VAL  33          2HG2      VAL  33 -15.183   5.986   5.986
  287   3HG2  VAL  33          1HG2      VAL  33 -13.569   5.926   5.926
  288    H    ALA  34           H        ALA  34 -14.457   8.366   8.366
  289    HA   ALA  34           HA       ALA  34 -13.653  11.163  11.163
  290   1HB   ALA  34          1HB       ALA  34 -16.009  10.270  10.270
  291   2HB   ALA  34          3HB       ALA  34 -15.379   9.844   9.844
  292   3HB   ALA  34          2HB       ALA  34 -15.402  11.530  11.530
  293    H    ALA  35           H        ALA  35 -13.100   8.351   8.351
  294    HA   ALA  35           HA       ALA  35 -11.852   9.653   9.653
  295   1HB   ALA  35          2HB       ALA  35 -11.831   6.874   6.874
  296   2HB   ALA  35          1HB       ALA  35 -10.670   7.297   7.297
  297   3HB   ALA  35          3HB       ALA  35 -12.399   7.428   7.428
  298    H    ALA  36           H        ALA  36 -10.609   8.394   8.394
  299    HA   ALA  36           HA       ALA  36  -7.837   8.732   8.732
  300   1HB   ALA  36          3HB       ALA  36  -9.510   8.174   8.174
  301   2HB   ALA  36          2HB       ALA  36  -8.239   9.314   9.314
  302   3HB   ALA  36          1HB       ALA  36  -7.819   7.753   7.753
  303    H    SER  37           H        SER  37  -9.774  10.861  10.861
  304    HA   SER  37           HA       SER  37  -9.523  13.159  13.159
  305   1HB   SER  37          2HB       SER  37  -9.578  12.861  12.861
  306   2HB   SER  37          1HB       SER  37  -9.116  14.436  14.436
  307    HG   SER  37           HG       SER  37 -11.465  12.954  12.954
  308    H    LYS  38           H        LYS  38  -7.223  11.867  11.867
  309    HA   LYS  38           HA       LYS  38  -4.947  12.260  12.260
  310   1HB   LYS  38          2HB       LYS  38  -5.273  14.888  14.888
  311   2HB   LYS  38          1HB       LYS  38  -4.055  14.475  14.475
  312   1HG   LYS  38          2HG       LYS  38  -6.098  14.087  14.087
  313   2HG   LYS  38          1HG       LYS  38  -6.979  15.063  15.063
  314   1HD   LYS  38          2HD       LYS  38  -5.266  16.853  16.853
  315   2HD   LYS  38          1HD       LYS  38  -4.465  15.888  15.888
  316   1HE   LYS  38          2HE       LYS  38  -5.847  17.379  17.379
  317   2HE   LYS  38          1HE       LYS  38  -6.745  15.862  15.862
  318   1HZ   LYS  38          3HZ       LYS  38  -7.958  16.701  16.701
  319   2HZ   LYS  38          2HZ       LYS  38  -7.159  18.191  18.191
  320   3HZ   LYS  38          1HZ       LYS  38  -8.209  17.649  17.649
  321    HA   PRO  39           HA       PRO  39  -4.382  10.989  10.989
  322   1HB   PRO  39          2HB       PRO  39  -3.527   8.435   8.435
  323   2HB   PRO  39          1HB       PRO  39  -5.218   8.879   8.879
  324   1HG   PRO  39          2HG       PRO  39  -3.840   8.256   8.256
  325   2HG   PRO  39          1HG       PRO  39  -5.545   8.055   8.055
  326   1HD   PRO  39          2HD       PRO  39  -4.511  10.141  10.141
  327   2HD   PRO  39          1HD       PRO  39  -6.100  10.137  10.137
  328    H    ALA  40           H        ALA  40  -2.301  10.255  10.255
  329    HA   ALA  40           HA       ALA  40   0.033  11.141  11.141
  330   1HB   ALA  40          2HB       ALA  40  -0.580  11.278  11.278
  331   2HB   ALA  40          1HB       ALA  40   1.071  11.434  11.434
  332   3HB   ALA  40          3HB       ALA  40  -0.160  12.596  12.596
  333    H    VAL  41           H        VAL  41   2.144  10.097  10.097
  334    HA   VAL  41           HA       VAL  41   1.851   7.354   7.354
  335    HB   VAL  41           HB       VAL  41   2.758   8.026   8.026
  336   1HG1  VAL  41          1HG1      VAL  41   3.150   5.476   5.476
  337   2HG1  VAL  41          3HG1      VAL  41   3.293   5.567   5.567
  338   3HG1  VAL  41          2HG1      VAL  41   4.402   6.479   6.479
  339   1HG2  VAL  41          1HG2      VAL  41   0.625   6.234   6.234
  340   2HG2  VAL  41          3HG2      VAL  41   0.390   7.660   7.660
  341   3HG2  VAL  41          2HG2      VAL  41   1.097   6.198   6.198
  342    H    GLU  42           H        GLU  42   4.082   6.393   6.393
  343    HA   GLU  42           HA       GLU  42   6.335   8.302   8.302
  344   1HB   GLU  42          2HB       GLU  42   5.205   8.759   8.759
  345   2HB   GLU  42          1HB       GLU  42   5.356   7.056   7.056
  346   1HG   GLU  42          2HG       GLU  42   7.836   7.271   7.271
  347   2HG   GLU  42          1HG       GLU  42   7.634   8.994   8.994
  348    H    ILE  43           H        ILE  43   7.792   7.019   7.019
  349    HA   ILE  43           HA       ILE  43   7.808   4.114   4.114
  350    HB   ILE  43           HB       ILE  43   9.010   5.778   5.778
  351   1HG1  ILE  43          2HG1      ILE  43   7.420   3.514   3.514
  352   2HG1  ILE  43          1HG1      ILE  43   6.523   4.416   4.416
  353   1HG2  ILE  43          1HG2      ILE  43   9.671   3.010   3.010
  354   2HG2  ILE  43          3HG2      ILE  43   9.450   3.262   3.262
  355   3HG2  ILE  43          2HG2      ILE  43  10.667   4.189   4.189
  356   1HD1  ILE  43          1HD1      ILE  43   7.860   6.099   6.099
  357   2HD1  ILE  43          3HD1      ILE  43   6.589   5.058   5.058
  358   3HD1  ILE  43          2HD1      ILE  43   6.224   6.201   6.201
  359    H    LYS  44           H        LYS  44   9.500   3.111   3.111
  360    HA   LYS  44           HA       LYS  44  11.822   4.794   4.794
  361   1HB   LYS  44          2HB       LYS  44  11.364   2.341   2.341
  362   2HB   LYS  44          1HB       LYS  44  11.696   3.974   3.974
  363   1HG   LYS  44          2HG       LYS  44   9.335   4.580   4.580
  364   2HG   LYS  44          1HG       LYS  44   8.975   3.037   3.037
  365   1HD   LYS  44          2HD       LYS  44   9.194   1.860   1.860
  366   2HD   LYS  44          1HD       LYS  44  10.275   3.062   3.062
  367   1HE   LYS  44          2HE       LYS  44   8.316   4.665   4.665
  368   2HE   LYS  44          1HE       LYS  44   7.286   3.306   3.306
  369   1HZ   LYS  44          3HZ       LYS  44   9.073   3.291   3.291
  370   2HZ   LYS  44          2HZ       LYS  44   7.439   3.752   3.752
  371   3HZ   LYS  44          1HZ       LYS  44   7.860   2.169   2.169
  372    H    GLN  45           H        GLN  45  13.411   4.197   4.197
  373    HA   GLN  45           HA       GLN  45  13.529   1.349   1.349
  374   1HB   GLN  45          2HB       GLN  45  13.606   3.079   3.079
  375   2HB   GLN  45          1HB       GLN  45  15.078   3.737   3.737
  376   1HG   GLN  45          2HG       GLN  45  16.196   1.541   1.541
  377   2HG   GLN  45          1HG       GLN  45  14.739   0.932   0.932
  378   1HE2  GLN  45          2HE2      GLN  45  16.496   1.978   1.978
  379   2HE2  GLN  45          1HE2      GLN  45  16.203   0.640   0.640
  380    H    GLU  46           H        GLU  46  14.936  -0.020  -0.020
  381    HA   GLU  46           HA       GLU  46  17.444   1.057   1.057
  382   1HB   GLU  46          2HB       GLU  46  15.473  -0.958  -0.958
  383   2HB   GLU  46          1HB       GLU  46  17.177  -1.110  -1.110
  384   1HG   GLU  46          2HG       GLU  46  15.939   1.592   1.592
  385   2HG   GLU  46          1HG       GLU  46  15.484   0.378   0.378
  386    H    GLY  47           H        GLY  47  17.592   0.421   0.421
  387   1HA   GLY  47          2HA       GLY  47  19.174  -0.864  -0.864
  388   2HA   GLY  47          1HA       GLY  47  19.149  -2.101  -2.101
  389    H    ASP  48           H        ASP  48  18.285  -3.953  -3.953
  390    HA   ASP  48           HA       ASP  48  16.412  -3.942  -3.942
  391   1HB   ASP  48          2HB       ASP  48  16.223  -6.432  -6.432
  392   2HB   ASP  48          1HB       ASP  48  17.795  -5.870  -5.870
  393    H    THR  49           H        THR  49  15.926  -3.239  -3.239
  394    HA   THR  49           HA       THR  49  13.310  -4.603  -4.603
  395    HB   THR  49           HB       THR  49  15.035  -3.097  -3.097
  396    HG1  THR  49           HG1      THR  49  15.021  -5.099  -5.099
  397   1HG2  THR  49          2HG2      THR  49  12.693  -2.451  -2.451
  398   2HG2  THR  49          1HG2      THR  49  12.231  -4.152  -4.152
  399   3HG2  THR  49          3HG2      THR  49  13.305  -3.500  -3.500
  400    H    PHE  50           H        PHE  50  11.410  -3.456  -3.456
  401    HA   PHE  50           HA       PHE  50  11.619  -0.491  -0.491
  402   1HB   PHE  50          2HB       PHE  50  10.120  -2.333  -2.333
  403   2HB   PHE  50          1HB       PHE  50   9.966  -0.573  -0.573
  404    HD1  PHE  50           HD2      PHE  50  11.860   0.860   0.860
  405    HD2  PHE  50           HD1      PHE  50  12.153  -3.416  -3.416
  406    HE1  PHE  50           HE2      PHE  50  13.960   1.032   1.032
  407    HE2  PHE  50           HE1      PHE  50  14.258  -3.246  -3.246
  408    HZ   PHE  50           HZ       PHE  50  15.172  -1.029  -1.029
  409    H    TYR  51           H        TYR  51  10.398   0.311   0.311
  410    HA   TYR  51           HA       TYR  51   8.007  -1.164  -1.164
  411   1HB   TYR  51          2HB       TYR  51   9.868  -0.450  -0.450
  412   2HB   TYR  51          1HB       TYR  51   9.419   1.214   1.214
  413    HD1  TYR  51           HD1      TYR  51   6.882   1.798   1.798
  414    HD2  TYR  51           HD2      TYR  51   8.818  -1.600  -1.600
  415    HE1  TYR  51           HE1      TYR  51   5.097   1.676   1.676
  416    HE2  TYR  51           HE2      TYR  51   7.031  -1.713  -1.713
  417    HH   TYR  51           HH       TYR  51   5.085   0.641   0.641
  418    H    ILE  52           H        ILE  52   5.964   0.007   0.007
  419    HA   ILE  52           HA       ILE  52   5.938   2.670   2.670
  420    HB   ILE  52           HB       ILE  52   3.978   0.671   0.671
  421   1HG1  ILE  52          2HG1      ILE  52   6.902   0.776   0.776
  422   2HG1  ILE  52          1HG1      ILE  52   6.091  -0.595  -0.595
  423   1HG2  ILE  52          2HG2      ILE  52   4.415   3.263   3.263
  424   2HG2  ILE  52          1HG2      ILE  52   5.565   2.575   2.575
  425   3HG2  ILE  52          3HG2      ILE  52   3.857   2.148   2.148
  426   1HD1  ILE  52          3HD1      ILE  52   4.466  -0.381  -0.381
  427   2HD1  ILE  52          2HD1      ILE  52   5.828   0.470   0.470
  428   3HD1  ILE  52          1HD1      ILE  52   6.020  -1.195  -1.195
  429    H    LYS  53           H        LYS  53   4.997   3.707   3.707
  430    HA   LYS  53           HA       LYS  53   2.528   2.549   2.549
  431   1HB   LYS  53          2HB       LYS  53   4.578   3.531   3.531
  432   2HB   LYS  53          1HB       LYS  53   3.838   5.081   5.081
  433   1HG   LYS  53          2HG       LYS  53   1.672   3.593   3.593
  434   2HG   LYS  53          1HG       LYS  53   2.969   3.014   3.014
  435   1HD   LYS  53          2HD       LYS  53   3.534   5.416   5.416
  436   2HD   LYS  53          1HD       LYS  53   2.088   5.888   5.888
  437   1HE   LYS  53          2HE       LYS  53   1.039   5.695   5.695
  438   2HE   LYS  53          1HE       LYS  53   1.090   3.962   3.962
  439   1HZ   LYS  53          2HZ       LYS  53   3.358   5.344   5.344
  440   2HZ   LYS  53          1HZ       LYS  53   2.031   4.803   4.803
  441   3HZ   LYS  53          3HZ       LYS  53   2.962   3.692   3.692
  442    H    THR  54           H        THR  54   0.670   3.226   3.226
  443    HA   THR  54           HA       THR  54   0.597   5.951   5.951
  444    HB   THR  54           HB       THR  54  -1.401   3.685   3.685
  445    HG1  THR  54           HG1      THR  54  -0.148   2.912   2.912
  446   1HG2  THR  54          2HG2      THR  54  -1.512   6.426   6.426
  447   2HG2  THR  54          1HG2      THR  54  -1.234   5.542   5.542
  448   3HG2  THR  54          3HG2      THR  54  -2.623   5.148   5.148
  449    H    SER  55           H        SER  55  -0.981   7.451   7.451
  450    HA   SER  55           HA       SER  55  -2.814   6.602   6.602
  451   1HB   SER  55          2HB       SER  55  -2.058   8.965   8.965
  452   2HB   SER  55          1HB       SER  55  -1.231   7.464   7.464
  453    HG   SER  55           HG       SER  55  -0.475   9.528   9.528
  454    H    THR  56           H        THR  56  -4.788   7.518   7.518
  455    HA   THR  56           HA       THR  56  -5.122   9.614   9.614
  456    HB   THR  56           HB       THR  56  -7.661   8.883   8.883
  457    HG1  THR  56           HG1      THR  56  -7.745   7.059   7.059
  458   1HG2  THR  56          2HG2      THR  56  -5.641   7.495   7.495
  459   2HG2  THR  56          1HG2      THR  56  -7.363   7.110   7.110
  460   3HG2  THR  56          3HG2      THR  56  -6.813   8.732   8.732
  461    H    THR  57           H        THR  57  -7.143   8.920   8.920
  462    HA   THR  57           HA       THR  57  -6.466  11.396  11.396
  463    HB   THR  57           HB       THR  57  -8.780  12.295  12.295
  464    HG1  THR  57           HG1      THR  57 -10.295  11.109  11.109
  465   1HG2  THR  57          3HG2      THR  57  -6.995  12.960  12.960
  466   2HG2  THR  57          2HG2      THR  57  -7.772  11.849  11.849
  467   3HG2  THR  57          1HG2      THR  57  -8.662  13.239  13.239
  468    H    VAL  58           H        VAL  58  -8.801   8.770   8.770
  469    HA   VAL  58           HA       VAL  58  -8.856   8.356   8.356
  470    HB   VAL  58           HB       VAL  58 -10.874   7.441   7.441
  471   1HG1  VAL  58          2HG1      VAL  58 -10.556   7.164   7.164
  472   2HG1  VAL  58          1HG1      VAL  58 -12.188   7.416   7.416
  473   3HG1  VAL  58          3HG1      VAL  58 -11.241   6.031   6.031
  474   1HG2  VAL  58          3HG2      VAL  58 -10.688   9.911   9.911
  475   2HG2  VAL  58          2HG2      VAL  58 -11.164   9.768   9.768
  476   3HG2  VAL  58          1HG2      VAL  58 -12.268   9.249   9.249
  477    H    ARG  59           H        ARG  59  -7.692   7.087   7.087
  478    HA   ARG  59           HA       ARG  59  -7.453   4.380   4.380
  479   1HB   ARG  59          2HB       ARG  59  -8.782   4.410   4.410
  480   2HB   ARG  59          1HB       ARG  59  -7.387   5.090   5.090
  481   1HG   ARG  59          2HG       ARG  59  -6.107   3.138   3.138
  482   2HG   ARG  59          1HG       ARG  59  -7.121   2.547   2.547
  483   1HD   ARG  59          2HD       ARG  59  -8.980   2.658   2.658
  484   2HD   ARG  59          1HD       ARG  59  -7.548   2.376   2.376
  485    HE   ARG  59           HE       ARG  59  -7.172   0.296   0.296
  486   1HH1  ARG  59          1HH2      ARG  59  -8.530   0.319   0.319
  487   2HH1  ARG  59          2HH2      ARG  59 -10.097  -0.351  -0.351
  488   1HH2  ARG  59          2HH1      ARG  59  -9.911   0.127   0.127
  489   2HH2  ARG  59          1HH1      ARG  59 -10.879  -0.459  -0.459
  490    H    THR  60           H        THR  60  -5.409   3.250   3.250
  491    HA   THR  60           HA       THR  60  -3.163   4.792   4.792
  492    HB   THR  60           HB       THR  60  -3.096   3.998   3.998
  493    HG1  THR  60           HG1      THR  60  -4.292   5.695   5.695
  494   1HG2  THR  60          2HG2      THR  60  -1.270   5.383   5.383
  495   2HG2  THR  60          1HG2      THR  60  -1.217   5.857   5.857
  496   3HG2  THR  60          3HG2      THR  60  -0.886   4.186   4.186
  497    H    THR  61           H        THR  61  -2.542   3.068   3.068
  498    HA   THR  61           HA       THR  61  -2.242   0.390   0.390
  499    HB   THR  61           HB       THR  61  -1.803  -0.264  -0.264
  500    HG1  THR  61           HG1      THR  61  -3.237   2.140   2.140
  501   1HG2  THR  61          3HG2      THR  61  -3.920  -0.572  -0.572
  502   2HG2  THR  61          2HG2      THR  61  -4.587   0.747   0.747
  503   3HG2  THR  61          1HG2      THR  61  -4.082  -0.749  -0.749
  504    H    GLU  62           H        GLU  62  -0.244  -0.846  -0.846
  505    HA   GLU  62           HA       GLU  62   2.063   0.647   0.647
  506   1HB   GLU  62          2HB       GLU  62   3.362   0.702   0.702
  507   2HB   GLU  62          1HB       GLU  62   1.819   1.483   1.483
  508   1HG   GLU  62          2HG       GLU  62   1.233  -1.104  -1.104
  509   2HG   GLU  62          1HG       GLU  62   2.939  -1.020  -1.020
  510    H    ILE  63           H        ILE  63   3.134  -0.832  -0.832
  511    HA   ILE  63           HA       ILE  63   3.074  -3.688  -3.688
  512    HB   ILE  63           HB       ILE  63   3.589  -4.237  -4.237
  513   1HG1  ILE  63          2HG1      ILE  63   3.125  -1.276  -1.276
  514   2HG1  ILE  63          1HG1      ILE  63   4.712  -2.044  -2.044
  515   1HG2  ILE  63          3HG2      ILE  63   1.209  -3.867  -3.867
  516   2HG2  ILE  63          2HG2      ILE  63   1.198  -2.408  -2.408
  517   3HG2  ILE  63          1HG2      ILE  63   1.376  -3.988  -3.988
  518   1HD1  ILE  63          3HD1      ILE  63   2.598  -3.299  -3.299
  519   2HD1  ILE  63          2HD1      ILE  63   3.235  -1.749  -1.749
  520   3HD1  ILE  63          1HD1      ILE  63   4.324  -3.116  -3.116
  521    H    ASN  64           H        ASN  64   5.194  -4.867  -4.867
  522    HA   ASN  64           HA       ASN  64   7.562  -3.200  -3.200
  523   1HB   ASN  64          2HB       ASN  64   8.562  -3.573  -3.573
  524   2HB   ASN  64          1HB       ASN  64   6.927  -2.993  -2.993
  525   1HD2  ASN  64          2HD2      ASN  64   7.885  -6.852  -6.852
  526   2HD2  ASN  64          1HD2      ASN  64   8.871  -5.972  -5.972
  527    H    PHE  65           H        PHE  65   9.174  -4.441  -4.441
  528    HA   PHE  65           HA       PHE  65   9.295  -7.346  -7.346
  529   1HB   PHE  65          2HB       PHE  65   8.710  -7.997  -7.997
  530   2HB   PHE  65          1HB       PHE  65   7.382  -7.098  -7.098
  531    HD1  PHE  65           HD2      PHE  65   6.945  -4.740  -4.740
  532    HD2  PHE  65           HD1      PHE  65   9.995  -7.085  -7.085
  533    HE1  PHE  65           HE2      PHE  65   7.087  -3.071  -3.071
  534    HE2  PHE  65           HE1      PHE  65  10.148  -5.421  -5.421
  535    HZ   PHE  65           HZ       PHE  65   8.696  -3.407  -3.407
  536    H    LYS  66           H        LYS  66  10.642  -8.284  -8.284
  537    HA   LYS  66           HA       LYS  66  12.982  -6.501  -6.501
  538   1HB   LYS  66          2HB       LYS  66  14.389  -8.639  -8.639
  539   2HB   LYS  66          1HB       LYS  66  13.802  -7.994  -7.994
  540   1HG   LYS  66          2HG       LYS  66  11.821  -9.582  -9.582
  541   2HG   LYS  66          1HG       LYS  66  12.689 -10.333 -10.333
  542   1HD   LYS  66          2HD       LYS  66  13.289 -11.624 -11.624
  543   2HD   LYS  66          1HD       LYS  66  14.667 -10.558 -10.558
  544   1HE   LYS  66          2HE       LYS  66  13.356  -8.946  -8.946
  545   2HE   LYS  66          1HE       LYS  66  12.571 -10.437 -10.437
  546   1HZ   LYS  66          3HZ       LYS  66  15.513 -10.186 -10.186
  547   2HZ   LYS  66          2HZ       LYS  66  14.658  -9.772  -9.772
  548   3HZ   LYS  66          1HZ       LYS  66  14.610 -11.365 -11.365
  549    H    VAL  67           H        VAL  67  14.046  -7.012  -7.012
  550    HA   VAL  67           HA       VAL  67  12.098  -8.055  -8.055
  551    HB   VAL  67           HB       VAL  67  14.820  -7.476  -7.476
  552   1HG1  VAL  67          2HG1      VAL  67  11.960  -6.844  -6.844
  553   2HG1  VAL  67          1HG1      VAL  67  13.270  -5.952  -5.952
  554   3HG1  VAL  67          3HG1      VAL  67  13.167  -7.703  -7.703
  555   1HG2  VAL  67          3HG2      VAL  67  13.262  -5.460  -5.460
  556   2HG2  VAL  67          2HG2      VAL  67  15.007  -5.674  -5.674
  557   3HG2  VAL  67          1HG2      VAL  67  14.114  -4.935  -4.935
  558    H    GLY  68           H        GLY  68  11.957 -10.303 -10.303
  559   1HA   GLY  68          2HA       GLY  68  13.337 -12.120 -12.120
  560   2HA   GLY  68          1HA       GLY  68  14.483 -11.863 -11.863
  561    H    GLU  69           H        GLU  69  12.214 -11.457 -11.457
  562    HA   GLU  69           HA       GLU  69  11.411 -14.339 -14.339
  563   1HB   GLU  69          2HB       GLU  69  12.350 -12.371 -12.371
  564   2HB   GLU  69          1HB       GLU  69  11.324 -13.727 -13.727
  565   1HG   GLU  69          2HG       GLU  69  13.652 -14.337 -14.337
  566   2HG   GLU  69          1HG       GLU  69  14.000 -13.929 -13.929
  567    H    GLU  70           H        GLU  70   9.333 -14.750 -14.750
  568    HA   GLU  70           HA       GLU  70   7.337 -12.692 -12.692
  569   1HB   GLU  70          2HB       GLU  70   7.007 -15.498 -15.498
  570   2HB   GLU  70          1HB       GLU  70   5.697 -14.463 -14.463
  571   1HG   GLU  70          2HG       GLU  70   7.232 -14.346 -14.346
  572   2HG   GLU  70          1HG       GLU  70   7.795 -15.901 -15.901
  573    H    PHE  71           H        PHE  71   5.540 -12.296 -12.296
  574    HA   PHE  71           HA       PHE  71   6.251 -12.590 -12.590
  575   1HB   PHE  71          2HB       PHE  71   6.315 -10.100 -10.100
  576   2HB   PHE  71          1HB       PHE  71   7.698 -10.712 -10.712
  577    HD1  PHE  71           HD2      PHE  71   7.661 -10.556 -10.556
  578    HD2  PHE  71           HD1      PHE  71   4.855  -8.486  -8.486
  579    HE1  PHE  71           HE2      PHE  71   7.090  -9.046  -9.046
  580    HE2  PHE  71           HE1      PHE  71   4.282  -6.978  -6.978
  581    HZ   PHE  71           HZ       PHE  71   5.397  -7.255  -7.255
  582    H    GLU  72           H        GLU  72   4.631 -11.194 -11.194
  583    HA   GLU  72           HA       GLU  72   1.989 -11.400 -11.400
  584   1HB   GLU  72          2HB       GLU  72   2.287 -10.962 -10.962
  585   2HB   GLU  72          1HB       GLU  72   0.962 -11.708 -11.708
  586   1HG   GLU  72          2HG       GLU  72   2.499 -13.609 -13.609
  587   2HG   GLU  72          1HG       GLU  72   3.707 -12.897 -12.897
  588    H    GLU  73           H        GLU  73   0.596  -9.591  -9.591
  589    HA   GLU  73           HA       GLU  73   1.390  -7.100  -7.100
  590   1HB   GLU  73          2HB       GLU  73   1.548  -5.825  -5.825
  591   2HB   GLU  73          1HB       GLU  73   2.868  -6.972  -6.972
  592   1HG   GLU  73          2HG       GLU  73   2.135  -8.361  -8.361
  593   2HG   GLU  73          1HG       GLU  73   0.436  -7.980  -7.980
  594    H    GLN  74           H        GLN  74  -0.152  -5.282  -5.282
  595    HA   GLN  74           HA       GLN  74  -2.866  -6.562  -6.562
  596   1HB   GLN  74          2HB       GLN  74  -1.902  -3.934  -3.934
  597   2HB   GLN  74          1HB       GLN  74  -3.598  -4.173  -4.173
  598   1HG   GLN  74          2HG       GLN  74  -3.632  -6.208  -6.208
  599   2HG   GLN  74          1HG       GLN  74  -1.972  -5.857  -5.857
  600   1HE2  GLN  74          2HE2      GLN  74  -4.858  -3.171  -3.171
  601   2HE2  GLN  74          1HE2      GLN  74  -5.016  -3.920  -3.920
  602    H    THR  75           H        THR  75  -3.966  -6.276  -6.276
  603    HA   THR  75           HA       THR  75  -2.803  -4.958  -4.958
  604    HB   THR  75           HB       THR  75  -4.451  -6.887  -6.887
  605    HG1  THR  75           HG1      THR  75  -4.288  -6.240  -6.240
  606   1HG2  THR  75          3HG2      THR  75  -6.123  -4.958  -4.958
  607   2HG2  THR  75          2HG2      THR  75  -6.838  -5.363  -5.363
  608   3HG2  THR  75          1HG2      THR  75  -6.490  -6.636  -6.636
  609    H    VAL  76           H        VAL  76  -5.258  -3.560  -3.560
  610    HA   VAL  76           HA       VAL  76  -4.857  -1.063  -1.063
  611    HB   VAL  76           HB       VAL  76  -4.330  -1.080  -1.080
  612   1HG1  VAL  76          2HG1      VAL  76  -6.095  -2.689  -2.689
  613   2HG1  VAL  76          1HG1      VAL  76  -7.318  -1.466  -1.466
  614   3HG1  VAL  76          3HG1      VAL  76  -6.146  -1.203  -1.203
  615   1HG2  VAL  76          2HG2      VAL  76  -5.265   0.936   0.936
  616   2HG2  VAL  76          1HG2      VAL  76  -5.248   1.052   1.052
  617   3HG2  VAL  76          3HG2      VAL  76  -6.748   0.665   0.665
  618    H    ASP  77           H        ASP  77  -7.269  -3.463  -3.463
  619    HA   ASP  77           HA       ASP  77  -9.518  -1.656  -1.656
  620   1HB   ASP  77          2HB       ASP  77  -9.400  -3.916  -3.916
  621   2HB   ASP  77          1HB       ASP  77  -9.847  -4.606  -4.606
  622    H    GLY  78           H        GLY  78  -7.734  -4.226  -4.226
  623   1HA   GLY  78          2HA       GLY  78  -7.413  -3.650  -3.650
  624   2HA   GLY  78          1HA       GLY  78  -9.174  -3.579  -3.579
  625    H    ARG  79           H        ARG  79  -7.060  -5.873  -5.873
  626    HA   ARG  79           HA       ARG  79  -8.187  -8.063  -8.063
  627   1HB   ARG  79          2HB       ARG  79  -8.113  -7.702  -7.702
  628   2HB   ARG  79          1HB       ARG  79  -7.891  -9.327  -9.327
  629   1HG   ARG  79          2HG       ARG  79 -10.167  -7.569  -7.569
  630   2HG   ARG  79          1HG       ARG  79 -10.307  -8.591  -8.591
  631   1HD   ARG  79          2HD       ARG  79  -9.448  -9.664  -9.664
  632   2HD   ARG  79          1HD       ARG  79 -11.132  -9.635  -9.635
  633    HE   ARG  79           HE       ARG  79  -9.394 -10.904 -10.904
  634   1HH1  ARG  79          2HH1      ARG  79 -11.932 -12.079 -12.079
  635   2HH1  ARG  79          1HH1      ARG  79 -11.806 -13.433 -13.433
  636   1HH2  ARG  79          1HH2      ARG  79  -8.882 -12.318 -12.318
  637   2HH2  ARG  79          2HH2      ARG  79 -10.079 -13.569 -13.569
  638    HA   PRO  80           HA       PRO  80  -3.883  -9.124  -9.124
  639   1HB   PRO  80          2HB       PRO  80  -4.113 -11.747 -11.747
  640   2HB   PRO  80          1HB       PRO  80  -4.383 -10.363 -10.363
  641   1HG   PRO  80          2HG       PRO  80  -6.379 -12.201 -12.201
  642   2HG   PRO  80          1HG       PRO  80  -6.498 -11.254 -11.254
  643   1HD   PRO  80          2HD       PRO  80  -7.684 -10.594 -10.594
  644   2HD   PRO  80          1HD       PRO  80  -7.521  -9.514  -9.514
  645    H    CYS  81           H        CYS  81  -2.349  -9.982  -9.982
  646    HA   CYS  81           HA       CYS  81  -2.910 -12.271 -12.271
  647   1HB   CYS  81          2HB       CYS  81  -2.471 -10.951 -10.951
  648   2HB   CYS  81          1HB       CYS  81  -4.033 -10.635 -10.635
  649    HG   CYS  81           HG       CYS  81  -1.644  -8.655  -8.655
  650    H    LYS  82           H        LYS  82  -0.987 -13.179 -13.179
  651    HA   LYS  82           HA       LYS  82   1.499 -11.966 -11.966
  652   1HB   LYS  82          2HB       LYS  82   1.126 -14.353 -14.353
  653   2HB   LYS  82          1HB       LYS  82   0.960 -14.653 -14.653
  654   1HG   LYS  82          2HG       LYS  82   3.164 -15.093 -15.093
  655   2HG   LYS  82          1HG       LYS  82   3.400 -13.357 -13.357
  656   1HD   LYS  82          2HD       LYS  82   4.599 -14.096 -14.096
  657   2HD   LYS  82          1HD       LYS  82   3.007 -13.907 -13.907
  658   1HE   LYS  82          2HE       LYS  82   2.673 -16.166 -16.166
  659   2HE   LYS  82          1HE       LYS  82   3.545 -16.521 -16.521
  660   1HZ   LYS  82          3HZ       LYS  82   5.586 -15.756 -15.756
  661   2HZ   LYS  82          2HZ       LYS  82   4.614 -16.040 -16.040
  662   3HZ   LYS  82          1HZ       LYS  82   4.960 -17.306 -17.306
  663    H    SER  83           H        SER  83   2.487 -10.560 -10.560
  664    HA   SER  83           HA       SER  83   2.119 -10.855 -10.855
  665   1HB   SER  83          2HB       SER  83   1.776  -8.685  -8.685
  666   2HB   SER  83          1HB       SER  83   3.511  -8.538  -8.538
  667    HG   SER  83           HG       SER  83   2.111  -7.537  -7.537
  668    H    LEU  84           H        LEU  84   4.191 -10.019 -10.019
  669    HA   LEU  84           HA       LEU  84   6.727 -10.784 -10.784
  670   1HB   LEU  84          2HB       LEU  84   5.974 -12.978 -12.978
  671   2HB   LEU  84          1HB       LEU  84   5.588 -12.317 -12.317
  672    HG   LEU  84           HG       LEU  84   7.964 -11.824 -11.824
  673   1HD1  LEU  84          3HD1      LEU  84   8.196 -11.980 -11.980
  674   2HD1  LEU  84          2HD1      LEU  84   9.019 -13.427 -13.427
  675   3HD1  LEU  84          1HD1      LEU  84   9.526 -11.840 -11.840
  676   1HD2  LEU  84          1HD2      LEU  84   7.090 -14.595 -14.595
  677   2HD2  LEU  84          3HD2      LEU  84   7.420 -13.921 -13.921
  678   3HD2  LEU  84          2HD2      LEU  84   8.755 -14.320 -14.320
  679    H    VAL  85           H        VAL  85   8.540  -9.999  -9.999
  680    HA   VAL  85           HA       VAL  85   7.711  -8.310  -8.310
  681    HB   VAL  85           HB       VAL  85   9.522  -7.258  -7.258
  682   1HG1  VAL  85          1HG1      VAL  85   9.504  -6.327  -6.327
  683   2HG1  VAL  85          3HG1      VAL  85   7.875  -5.754  -5.754
  684   3HG1  VAL  85          2HG1      VAL  85   9.242  -5.164  -5.164
  685   1HG2  VAL  85          1HG2      VAL  85   6.554  -7.337  -7.337
  686   2HG2  VAL  85          3HG2      VAL  85   7.599  -7.271  -7.271
  687   3HG2  VAL  85          2HG2      VAL  85   7.273  -5.807  -5.807
  688    H    LYS  86           H        LYS  86   9.056  -8.519  -8.519
  689    HA   LYS  86           HA       LYS  86  11.894  -9.285  -9.285
  690   1HB   LYS  86          2HB       LYS  86  11.615 -10.102 -10.102
  691   2HB   LYS  86          1HB       LYS  86  11.285 -11.173 -11.173
  692   1HG   LYS  86          2HG       LYS  86   8.864 -10.470 -10.470
  693   2HG   LYS  86          1HG       LYS  86   9.269  -9.596  -9.596
  694   1HD   LYS  86          2HD       LYS  86   9.874 -11.600 -11.600
  695   2HD   LYS  86          1HD       LYS  86   9.897 -12.531 -12.531
  696   1HE   LYS  86          2HE       LYS  86   7.804 -13.150 -13.150
  697   2HE   LYS  86          1HE       LYS  86   7.347 -11.622 -11.622
  698   1HZ   LYS  86          1HZ       LYS  86   7.908 -10.646 -10.646
  699   2HZ   LYS  86          3HZ       LYS  86   7.733 -12.240 -12.240
  700   3HZ   LYS  86          2HZ       LYS  86   6.430 -11.459 -11.459
  701    H    TRP  87           H        TRP  87  13.384  -8.260  -8.260
  702    HA   TRP  87           HA       TRP  87  12.516  -5.539  -5.539
  703   1HB   TRP  87          2HB       TRP  87  15.093  -7.077  -7.077
  704   2HB   TRP  87          1HB       TRP  87  14.889  -5.476  -5.476
  705    HD1  TRP  87           HD1      TRP  87  15.741  -7.239  -7.239
  706    HE1  TRP  87           HE1      TRP  87  15.971  -5.580  -5.580
  707    HE3  TRP  87           HE3      TRP  87  13.725  -3.092  -3.092
  708    HZ2  TRP  87           HZ2      TRP  87  15.371  -2.843  -2.843
  709    HZ3  TRP  87           HZ3      TRP  87  13.541  -0.972  -0.972
  710    HH2  TRP  87           HH2      TRP  87  14.361  -0.850  -0.850
  711    H    GLU  88           H        GLU  88  13.181  -4.683  -4.683
  712    HA   GLU  88           HA       GLU  88  12.529  -6.590  -6.590
  713   1HB   GLU  88          2HB       GLU  88  10.562  -5.079  -5.079
  714   2HB   GLU  88          1HB       GLU  88  11.463  -3.772  -3.772
  715   1HG   GLU  88          2HG       GLU  88  10.050  -4.514  -4.514
  716   2HG   GLU  88          1HG       GLU  88  11.586  -5.309  -5.309
  717    H    SER  89           H        SER  89  13.610  -3.362  -3.362
  718    HA   SER  89           HA       SER  89  15.734  -3.490  -3.490
  719   1HB   SER  89          2HB       SER  89  15.362  -1.194  -1.194
  720   2HB   SER  89          1HB       SER  89  13.764  -1.934  -1.934
  721    HG   SER  89           HG       SER  89  13.702  -0.027  -0.027
  722    H    GLU  90           H        GLU  90  16.749  -0.871  -0.871
  723    HA   GLU  90           HA       GLU  90  18.220  -1.899  -1.899
  724   1HB   GLU  90          2HB       GLU  90  19.337   0.337   0.337
  725   2HB   GLU  90          1HB       GLU  90  19.370  -0.470  -0.470
  726   1HG   GLU  90          2HG       GLU  90  17.629   0.904   0.904
  727   2HG   GLU  90          1HG       GLU  90  17.194   1.489   1.489
  728    H    ASN  91           H        ASN  91  15.429   0.161   0.161
  729    HA   ASN  91           HA       ASN  91  15.190   0.313   0.313
  730   1HB   ASN  91          2HB       ASN  91  14.785   2.729   2.729
  731   2HB   ASN  91          1HB       ASN  91  14.723   2.671   2.671
  732   1HD2  ASN  91          2HD2      ASN  91  18.200   3.519   3.519
  733   2HD2  ASN  91          1HD2      ASN  91  16.677   3.787   3.787
  734    H    LYS  92           H        LYS  92  13.718  -1.114  -1.114
  735    HA   LYS  92           HA       LYS  92  11.018  -0.082  -0.082
  736   1HB   LYS  92          2HB       LYS  92  11.417   0.639   0.639
  737   2HB   LYS  92          1HB       LYS  92  11.979  -0.966  -0.966
  738   1HG   LYS  92          2HG       LYS  92   9.785  -1.902  -1.902
  739   2HG   LYS  92          1HG       LYS  92   9.182  -0.452  -0.452
  740   1HD   LYS  92          2HD       LYS  92   9.531   0.847   0.847
  741   2HD   LYS  92          1HD       LYS  92  10.167  -0.589  -0.589
  742   1HE   LYS  92          2HE       LYS  92   7.490  -0.837  -0.837
  743   2HE   LYS  92          1HE       LYS  92   7.583   0.126   0.126
  744   1HZ   LYS  92          2HZ       LYS  92   8.731  -1.759  -1.759
  745   2HZ   LYS  92          1HZ       LYS  92   8.476  -2.684  -2.684
  746   3HZ   LYS  92          3HZ       LYS  92   7.151  -2.144  -2.144
  747    H    MET  93           H        MET  93  10.223  -1.687  -1.687
  748    HA   MET  93           HA       MET  93  10.774  -4.508  -4.508
  749   1HB   MET  93          2HB       MET  93  10.522  -5.144  -5.144
  750   2HB   MET  93          1HB       MET  93  11.807  -3.963  -3.963
  751   1HG   MET  93          2HG       MET  93   9.431  -2.483  -2.483
  752   2HG   MET  93          1HG       MET  93   9.397  -3.778  -3.778
  753   1HE   MET  93          2HE       MET  93  11.465  -4.597  -4.597
  754   2HE   MET  93          1HE       MET  93  12.727  -3.609  -3.609
  755   3HE   MET  93          3HE       MET  93  11.092  -3.597  -3.597
  756    H    VAL  94           H        VAL  94   9.091  -6.013  -6.013
  757    HA   VAL  94           HA       VAL  94   6.365  -4.843  -4.843
  758    HB   VAL  94           HB       VAL  94   7.100  -7.676  -7.676
  759   1HG1  VAL  94          3HG1      VAL  94   4.844  -5.811  -5.811
  760   2HG1  VAL  94          2HG1      VAL  94   5.241  -6.858  -6.858
  761   3HG1  VAL  94          1HG1      VAL  94   4.834  -7.560  -7.560
  762   1HG2  VAL  94          3HG2      VAL  94   7.682  -5.163  -5.163
  763   2HG2  VAL  94          2HG2      VAL  94   8.627  -6.648  -6.648
  764   3HG2  VAL  94          1HG2      VAL  94   7.174  -6.597  -6.597
  765    H    CYS  95           H        CYS  95   4.625  -6.458  -6.458
  766    HA   CYS  95           HA       CYS  95   5.650  -7.934  -7.934
  767   1HB   CYS  95          2HB       CYS  95   5.286  -5.581  -5.581
  768   2HB   CYS  95          1HB       CYS  95   3.603  -5.715  -5.715
  769    HG   CYS  95           HG       CYS  95   4.614  -6.628  -6.628
  770    H    GLU  96           H        GLU  96   4.492  -9.752  -9.752
  771    HA   GLU  96           HA       GLU  96   1.844  -9.994  -9.994
  772   1HB   GLU  96          2HB       GLU  96   2.168 -12.475 -12.475
  773   2HB   GLU  96          1HB       GLU  96   3.336 -11.776 -11.776
  774   1HG   GLU  96          2HG       GLU  96   5.045 -11.716 -11.716
  775   2HG   GLU  96          1HG       GLU  96   3.897 -11.974 -11.974
  776    H    GLN  97           H        GLN  97   0.117 -11.161 -11.161
  777    HA   GLN  97           HA       GLN  97   0.569 -11.131 -11.131
  778   1HB   GLN  97          2HB       GLN  97   0.099  -8.718  -8.718
  779   2HB   GLN  97          1HB       GLN  97  -1.567  -9.281  -9.281
  780   1HG   GLN  97          2HG       GLN  97  -1.138 -10.072 -10.072
  781   2HG   GLN  97          1HG       GLN  97   0.259  -9.003  -9.003
  782   1HE2  GLN  97          2HE2      GLN  97  -1.653  -6.023  -6.023
  783   2HE2  GLN  97          1HE2      GLN  97  -0.113  -6.695  -6.695
  784    H    LYS  98           H        LYS  98  -0.876 -12.384 -12.384
  785    HA   LYS  98           HA       LYS  98  -3.441 -13.142 -13.142
  786   1HB   LYS  98          2HB       LYS  98  -2.988 -15.553 -15.553
  787   2HB   LYS  98          1HB       LYS  98  -1.875 -14.885 -14.885
  788   1HG   LYS  98          2HG       LYS  98  -0.477 -14.358 -14.358
  789   2HG   LYS  98          1HG       LYS  98  -1.342 -15.805 -15.805
  790   1HD   LYS  98          2HD       LYS  98   0.134 -15.685 -15.685
  791   2HD   LYS  98          1HD       LYS  98   0.927 -16.181 -16.181
  792   1HE   LYS  98          2HE       LYS  98  -1.662 -17.510 -17.510
  793   2HE   LYS  98          1HE       LYS  98  -0.418 -17.884 -17.884
  794   1HZ   LYS  98          2HZ       LYS  98   0.241 -17.940 -17.940
  795   2HZ   LYS  98          1HZ       LYS  98  -0.563 -19.262 -19.262
  796   3HZ   LYS  98          3HZ       LYS  98   0.958 -18.789 -18.789
  797    H    LEU  99           H        LEU  99  -5.009 -13.818 -13.818
  798    HA   LEU  99           HA       LEU  99  -4.760 -12.565 -12.565
  799   1HB   LEU  99          2HB       LEU  99  -6.560 -14.816 -14.816
  800   2HB   LEU  99          1HB       LEU  99  -6.740 -13.960 -13.960
  801    HG   LEU  99           HG       LEU  99  -6.553 -12.294 -12.294
  802   1HD1  LEU  99          3HD1      LEU  99  -8.792 -14.193 -14.193
  803   2HD1  LEU  99          2HD1      LEU  99  -9.156 -12.641 -12.641
  804   3HD1  LEU  99          1HD1      LEU  99  -8.101 -13.794 -13.794
  805   1HD2  LEU  99          3HD2      LEU  99  -8.176 -12.262 -12.262
  806   2HD2  LEU  99          2HD2      LEU  99  -6.797 -11.234 -11.234
  807   3HD2  LEU  99          1HD2      LEU  99  -8.316 -11.043 -11.043
  808    H    LEU 100           H        LEU 100  -4.924 -13.672 -13.672
  809    HA   LEU 100           HA       LEU 100  -3.032 -15.950 -15.950
  810   1HB   LEU 100          2HB       LEU 100  -3.948 -13.849 -13.849
  811   2HB   LEU 100          1HB       LEU 100  -3.117 -15.311 -15.311
  812    HG   LEU 100           HG       LEU 100  -2.030 -13.423 -13.423
  813   1HD1  LEU 100          2HD1      LEU 100  -2.301 -12.697 -12.697
  814   2HD1  LEU 100          1HD1      LEU 100  -0.827 -13.650 -13.650
  815   3HD1  LEU 100          3HD1      LEU 100  -0.871 -12.269 -12.269
  816   1HD2  LEU 100          3HD2      LEU 100  -1.181 -15.999 -15.999
  817   2HD2  LEU 100          2HD2      LEU 100  -0.814 -15.329 -15.329
  818   3HD2  LEU 100          1HD2      LEU 100   0.084 -14.783 -14.783
  819    H    LYS 101           H        LYS 101  -6.341 -15.381 -15.381
  820    HA   LYS 101           HA       LYS 101  -6.908 -18.015 -18.015
  821   1HB   LYS 101          2HB       LYS 101  -7.082 -16.101 -16.101
  822   2HB   LYS 101          1HB       LYS 101  -8.586 -15.711 -15.711
  823   1HG   LYS 101          2HG       LYS 101  -8.169 -18.584 -18.584
  824   2HG   LYS 101          1HG       LYS 101  -8.426 -17.533 -17.533
  825   1HD   LYS 101          2HD       LYS 101 -10.400 -16.570 -16.570
  826   2HD   LYS 101          1HD       LYS 101 -10.270 -18.107 -18.107
  827   1HE   LYS 101          2HE       LYS 101 -10.996 -19.332 -19.332
  828   2HE   LYS 101          1HE       LYS 101 -10.281 -18.226 -18.226
  829   1HZ   LYS 101          1HZ       LYS 101 -12.025 -16.625 -16.625
  830   2HZ   LYS 101          3HZ       LYS 101 -12.721 -17.712 -17.712
  831   3HZ   LYS 101          2HZ       LYS 101 -12.682 -18.090 -18.090
  832    H    GLY 102           H        GLY 102  -8.538 -18.985 -18.985
  833   1HA   GLY 102          2HA       GLY 102 -10.245 -19.239 -19.239
  834   2HA   GLY 102          1HA       GLY 102 -10.715 -17.574 -17.574
  835    H    GLU 103           H        GLU 103 -11.041 -17.388 -17.388
  836    HA   GLU 103           HA       GLU 103  -8.841 -16.093 -16.093
  837   1HB   GLU 103          2HB       GLU 103  -8.053 -18.465 -18.465
  838   2HB   GLU 103          1HB       GLU 103  -9.497 -18.826 -18.826
  839   1HG   GLU 103          2HG       GLU 103  -8.849 -17.320 -17.320
  840   2HG   GLU 103          1HG       GLU 103  -7.568 -16.626 -16.626
  841    H    GLY 104           H        GLY 104  -9.562 -14.934 -14.934
  842   1HA   GLY 104          2HA       GLY 104 -12.026 -15.658 -15.658
  843   2HA   GLY 104          1HA       GLY 104 -12.141 -14.190 -14.190
  844    HA   PRO 105           HA       PRO 105 -10.169 -12.105 -12.105
  845   1HB   PRO 105          2HB       PRO 105  -9.327  -9.839  -9.839
  846   2HB   PRO 105          1HB       PRO 105 -11.021 -10.142 -10.142
  847   1HG   PRO 105          2HG       PRO 105  -9.718 -10.232 -10.232
  848   2HG   PRO 105          1HG       PRO 105 -11.426 -10.003 -10.003
  849   1HD   PRO 105          2HD       PRO 105 -10.186 -12.421 -12.421
  850   2HD   PRO 105          1HD       PRO 105 -11.859 -12.226 -12.226
  851    H    LYS 106           H        LYS 106  -7.947 -10.746 -10.746
  852    HA   LYS 106           HA       LYS 106  -5.762 -12.077 -12.077
  853   1HB   LYS 106          2HB       LYS 106  -6.063 -13.238 -13.238
  854   2HB   LYS 106          1HB       LYS 106  -5.897 -11.694 -11.694
  855   1HG   LYS 106          2HG       LYS 106  -3.635 -11.458 -11.458
  856   2HG   LYS 106          1HG       LYS 106  -3.774 -12.724 -12.724
  857   1HD   LYS 106          2HD       LYS 106  -2.668 -13.813 -13.813
  858   2HD   LYS 106          1HD       LYS 106  -4.353 -14.280 -14.280
  859   1HE   LYS 106          2HE       LYS 106  -3.280 -13.539 -13.539
  860   2HE   LYS 106          1HE       LYS 106  -4.653 -12.529 -12.529
  861   1HZ   LYS 106          3HZ       LYS 106  -1.960 -11.785 -11.785
  862   2HZ   LYS 106          2HZ       LYS 106  -2.416 -11.447 -11.447
  863   3HZ   LYS 106          1HZ       LYS 106  -3.303 -10.795 -10.795
  864    H    THR 107           H        THR 107  -4.070 -10.630 -10.630
  865    HA   THR 107           HA       THR 107  -4.339  -7.896  -7.896
  866    HB   THR 107           HB       THR 107  -3.065  -7.474  -7.474
  867    HG1  THR 107           HG1      THR 107  -3.449  -9.341  -9.341
  868   1HG2  THR 107          1HG2      THR 107  -5.195  -6.475  -6.475
  869   2HG2  THR 107          3HG2      THR 107  -6.046  -7.438  -7.438
  870   3HG2  THR 107          2HG2      THR 107  -4.912  -6.187  -6.187
  871    H    SER 108           H        SER 108  -2.496  -6.817  -6.817
  872    HA   SER 108           HA       SER 108   0.181  -7.780  -7.780
  873   1HB   SER 108          2HB       SER 108  -0.912  -8.069  -8.069
  874   2HB   SER 108          1HB       SER 108   0.795  -8.184  -8.184
  875    HG   SER 108           HG       SER 108   0.343 -10.200 -10.200
  876    H    TRP 109           H        TRP 109   1.525  -5.942  -5.942
  877    HA   TRP 109           HA       TRP 109   0.601  -3.709  -3.709
  878   1HB   TRP 109          2HB       TRP 109   1.231  -2.102  -2.102
  879   2HB   TRP 109          1HB       TRP 109  -0.228  -3.042  -3.042
  880    HD1  TRP 109           HD1      TRP 109  -0.223  -4.776  -4.776
  881    HE1  TRP 109           HE1      TRP 109   1.433  -5.273  -5.273
  882    HE3  TRP 109           HE3      TRP 109   3.838  -2.151  -2.151
  883    HZ2  TRP 109           HZ2      TRP 109   4.125  -4.643  -4.643
  884    HZ3  TRP 109           HZ3      TRP 109   5.928  -2.117  -2.117
  885    HH2  TRP 109           HH2      TRP 109   6.081  -3.356  -3.356
  886    H    THR 110           H        THR 110   2.338  -1.966  -1.966
  887    HA   THR 110           HA       THR 110   5.069  -3.162  -3.162
  888    HB   THR 110           HB       THR 110   5.627  -2.494  -2.494
  889    HG1  THR 110           HG1      THR 110   4.804  -0.668  -0.668
  890   1HG2  THR 110          2HG2      THR 110   3.598  -4.312  -4.312
  891   2HG2  THR 110          1HG2      THR 110   2.899  -3.239  -3.239
  892   3HG2  THR 110          3HG2      THR 110   4.427  -4.057  -4.057
  893    H    MET 111           H        MET 111   6.739  -1.359  -1.359
  894    HA   MET 111           HA       MET 111   5.935   1.381   1.381
  895   1HB   MET 111          2HB       MET 111   7.332   1.510   1.510
  896   2HB   MET 111          1HB       MET 111   5.960   0.423   0.423
  897   1HG   MET 111          2HG       MET 111   7.291  -1.476  -1.476
  898   2HG   MET 111          1HG       MET 111   8.559  -0.712  -0.712
  899   1HE   MET 111          2HE       MET 111   6.502  -0.189  -0.189
  900   2HE   MET 111          1HE       MET 111   7.360  -1.681  -1.681
  901   3HE   MET 111          3HE       MET 111   7.684  -0.212  -0.212
  902    H    GLU 112           H        GLU 112   7.489   2.809   2.809
  903    HA   GLU 112           HA       GLU 112  10.155   1.698   1.698
  904   1HB   GLU 112          2HB       GLU 112  10.019   2.789   2.789
  905   2HB   GLU 112          1HB       GLU 112   8.848   1.487   1.487
  906   1HG   GLU 112          2HG       GLU 112   7.099   3.126   3.126
  907   2HG   GLU 112          1HG       GLU 112   8.268   4.435   4.435
  908    H    LEU 113           H        LEU 113  11.793   3.239   3.239
  909    HA   LEU 113           HA       LEU 113  11.006   5.868   5.868
  910   1HB   LEU 113          2HB       LEU 113  12.829   3.962   3.962
  911   2HB   LEU 113          1HB       LEU 113  13.861   5.081   5.081
  912    HG   LEU 113           HG       LEU 113  13.641   5.542   5.542
  913   1HD1  LEU 113          3HD1      LEU 113  13.311   7.423   7.423
  914   2HD1  LEU 113          2HD1      LEU 113  12.654   8.047   8.047
  915   3HD1  LEU 113          1HD1      LEU 113  14.334   7.529   7.529
  916   1HD2  LEU 113          2HD2      LEU 113  11.135   4.952   4.952
  917   2HD2  LEU 113          1HD2      LEU 113  11.633   6.337   6.337
  918   3HD2  LEU 113          3HD2      LEU 113  10.889   6.588   6.588
  919    H    THR 114           H        THR 114  11.803   7.784   7.784
  920    HA   THR 114           HA       THR 114  12.658   7.373   7.373
  921    HB   THR 114           HB       THR 114  12.077   9.653   9.653
  922    HG1  THR 114           HG1      THR 114  12.075  11.124  11.124
  923   1HG2  THR 114          1HG2      THR 114  10.151   8.125   8.125
  924   2HG2  THR 114          3HG2      THR 114  10.133   8.593   8.593
  925   3HG2  THR 114          2HG2      THR 114   9.779   9.788   9.788
  926    H    ASN 115           H        ASN 115  14.468   8.673   8.673
  927    HA   ASN 115           HA       ASN 115  16.866   8.328   8.328
  928   1HB   ASN 115          2HB       ASN 115  16.122   9.814   9.814
  929   2HB   ASN 115          1HB       ASN 115  17.711  10.094  10.094
  930   1HD2  ASN 115          2HD2      ASN 115  19.015   7.045   7.045
  931   2HD2  ASN 115          1HD2      ASN 115  19.312   8.567   8.567
  932    H    ASP 116           H        ASP 116  14.529  10.895  10.895
  933    HA   ASP 116           HA       ASP 116  16.415  12.834  12.834
  934   1HB   ASP 116          2HB       ASP 116  13.557  12.845  12.845
  935   2HB   ASP 116          1HB       ASP 116  14.024  13.983  13.983
  936    H    GLY 117           H        GLY 117  14.019  10.502  10.502
  937   1HA   GLY 117          2HA       GLY 117  14.526   9.690   9.690
  938   2HA   GLY 117          1HA       GLY 117  14.460  11.390  11.390
  939    H    GLU 118           H        GLU 118  12.155  11.316  11.316
  940    HA   GLU 118           HA       GLU 118   9.955  11.477  11.477
  941   1HB   GLU 118          2HB       GLU 118   9.975  10.774  10.774
  942   2HB   GLU 118          1HB       GLU 118   8.551  11.267  11.267
  943   1HG   GLU 118          2HG       GLU 118   9.223  13.463  13.463
  944   2HG   GLU 118          1HG       GLU 118  10.937  13.046  13.046
  945    H    LEU 119           H        LEU 119   8.004   9.896   9.896
  946    HA   LEU 119           HA       LEU 119   8.884   7.075   7.075
  947   1HB   LEU 119          2HB       LEU 119   9.316   7.763   7.763
  948   2HB   LEU 119          1HB       LEU 119   7.601   8.114   8.114
  949    HG   LEU 119           HG       LEU 119   8.586   5.387   5.387
  950   1HD1  LEU 119          3HD1      LEU 119   8.441   6.633   6.633
  951   2HD1  LEU 119          2HD1      LEU 119   8.107   4.912   4.912
  952   3HD1  LEU 119          1HD1      LEU 119   9.673   5.567   5.567
  953   1HD2  LEU 119          1HD2      LEU 119   6.026   6.603   6.603
  954   2HD2  LEU 119          3HD2      LEU 119   6.267   5.461   5.461
  955   3HD2  LEU 119          2HD2      LEU 119   6.361   4.907   4.907
  956    H    ILE 120           H        ILE 120   7.402   6.350   6.350
  957    HA   ILE 120           HA       ILE 120   4.544   7.160   7.160
  958    HB   ILE 120           HB       ILE 120   5.401   7.730   7.730
  959   1HG1  ILE 120          2HG1      ILE 120   3.600   5.299   5.299
  960   2HG1  ILE 120          1HG1      ILE 120   3.034   6.890   6.890
  961   1HG2  ILE 120          1HG2      ILE 120   5.994   4.767   4.767
  962   2HG2  ILE 120          3HG2      ILE 120   6.112   5.916   5.916
  963   3HG2  ILE 120          2HG2      ILE 120   7.188   6.063   6.063
  964   1HD1  ILE 120          2HD1      ILE 120   4.603   6.687   6.687
  965   2HD1  ILE 120          1HD1      ILE 120   2.918   6.166   6.166
  966   3HD1  ILE 120          3HD1      ILE 120   3.327   7.822   7.822
  967    H    LEU 121           H        LEU 121   2.957   5.451   5.451
  968    HA   LEU 121           HA       LEU 121   4.107   2.715   2.715
  969   1HB   LEU 121          2HB       LEU 121   3.800   3.706   3.706
  970   2HB   LEU 121          1HB       LEU 121   2.115   4.054   4.054
  971    HG   LEU 121           HG       LEU 121   2.711   1.253   1.253
  972   1HD1  LEU 121          1HD1      LEU 121   4.353   2.021   2.021
  973   2HD1  LEU 121          3HD1      LEU 121   2.890   1.889   1.889
  974   3HD1  LEU 121          2HD1      LEU 121   3.491   0.485   0.485
  975   1HD2  LEU 121          1HD2      LEU 121   0.480   2.417   2.417
  976   2HD2  LEU 121          3HD2      LEU 121   0.732   0.913   0.913
  977   3HD2  LEU 121          2HD2      LEU 121   0.923   2.463   2.463
  978    H    THR 122           H        THR 122   2.841   1.127   1.127
  979    HA   THR 122           HA       THR 122   0.183   1.976   1.976
  980    HB   THR 122           HB       THR 122   1.096  -0.385  -0.385
  981    HG1  THR 122           HG1      THR 122   3.042   0.265   0.265
  982   1HG2  THR 122          2HG2      THR 122   0.522   2.473   2.473
  983   2HG2  THR 122          1HG2      THR 122   1.229   1.410   1.410
  984   3HG2  THR 122          3HG2      THR 122  -0.329   1.009   1.009
  985    H    MET 123           H        MET 123  -1.308  -0.022  -0.022
  986    HA   MET 123           HA       MET 123  -0.728  -2.068  -2.068
  987   1HB   MET 123          2HB       MET 123  -3.216  -0.333  -0.333
  988   2HB   MET 123          1HB       MET 123  -2.841  -1.657  -1.657
  989   1HG   MET 123          2HG       MET 123  -0.666  -0.351  -0.351
  990   2HG   MET 123          1HG       MET 123  -1.478   1.022   1.022
  991   1HE   MET 123          3HE       MET 123  -0.860  -1.235  -1.235
  992   2HE   MET 123          2HE       MET 123  -1.798  -0.749  -0.749
  993   3HE   MET 123          1HE       MET 123  -2.490  -1.875  -1.875
  994    H    THR 124           H        THR 124  -2.429  -3.779  -3.779
  995    HA   THR 124           HA       THR 124  -4.044  -3.894  -3.894
  996    HB   THR 124           HB       THR 124  -2.267  -6.217  -6.217
  997    HG1  THR 124           HG1      THR 124  -1.692  -3.960  -3.960
  998   1HG2  THR 124          1HG2      THR 124  -4.285  -6.396  -6.396
  999   2HG2  THR 124          3HG2      THR 124  -3.475  -5.279  -5.279
 1000   3HG2  THR 124          2HG2      THR 124  -2.759  -6.854  -6.854
 1001    H    ALA 125           H        ALA 125  -5.719  -5.432  -5.432
 1002    HA   ALA 125           HA       ALA 125  -5.960  -7.106  -7.106
 1003   1HB   ALA 125          1HB       ALA 125  -7.396  -4.533  -4.533
 1004   2HB   ALA 125          3HB       ALA 125  -8.380  -5.898  -5.898
 1005   3HB   ALA 125          2HB       ALA 125  -6.971  -5.409  -5.409
 1006    H    ASP 126           H        ASP 126  -6.144  -8.836  -8.836
 1007    HA   ASP 126           HA       ASP 126  -7.399 -10.437 -10.437
 1008   1HB   ASP 126          2HB       ASP 126  -9.409  -8.743  -8.743
 1009   2HB   ASP 126          1HB       ASP 126  -9.767  -8.907  -8.907
 1010    H    ASP 127           H        ASP 127  -8.712  -7.488  -7.488
 1011    HA   ASP 127           HA       ASP 127  -6.847  -7.784  -7.784
 1012   1HB   ASP 127          2HB       ASP 127  -9.150  -9.111  -9.111
 1013   2HB   ASP 127          1HB       ASP 127  -9.733  -7.507  -7.507
 1014    H    VAL 128           H        VAL 128  -7.555  -5.857  -5.857
 1015    HA   VAL 128           HA       VAL 128  -8.107  -3.473  -3.473
 1016    HB   VAL 128           HB       VAL 128  -9.001  -2.378  -2.378
 1017   1HG1  VAL 128          2HG1      VAL 128 -10.456  -3.907  -3.907
 1018   2HG1  VAL 128          1HG1      VAL 128 -10.223  -5.141  -5.141
 1019   3HG1  VAL 128          3HG1      VAL 128 -11.035  -3.629  -3.629
 1020   1HG2  VAL 128          2HG2      VAL 128  -7.769  -4.724  -4.724
 1021   2HG2  VAL 128          1HG2      VAL 128  -8.048  -3.101  -3.101
 1022   3HG2  VAL 128          3HG2      VAL 128  -9.357  -4.282  -4.282
 1023    H    VAL 129           H        VAL 129  -7.112  -1.471  -1.471
 1024    HA   VAL 129           HA       VAL 129  -4.617  -2.147  -2.147
 1025    HB   VAL 129           HB       VAL 129  -4.719  -1.308  -1.308
 1026   1HG1  VAL 129          2HG1      VAL 129  -2.809  -0.177  -0.177
 1027   2HG1  VAL 129          1HG1      VAL 129  -2.166  -0.648  -0.648
 1028   3HG1  VAL 129          3HG1      VAL 129  -3.447   0.560   0.560
 1029   1HG2  VAL 129          3HG2      VAL 129  -3.353  -3.287  -3.287
 1030   2HG2  VAL 129          2HG2      VAL 129  -3.953  -3.448  -3.448
 1031   3HG2  VAL 129          1HG2      VAL 129  -2.402  -2.665  -2.665
 1032    H    CYS 130           H        CYS 130  -4.524  -0.711  -0.711
 1033    HA   CYS 130           HA       CYS 130  -5.736   1.987   1.987
 1034   1HB   CYS 130          2HB       CYS 130  -6.137   0.313   0.313
 1035   2HB   CYS 130          1HB       CYS 130  -4.661   1.067   1.067
 1036    HG   CYS 130           HG       CYS 130  -6.683   3.147   3.147
 1037    H    THR 131           H        THR 131  -4.294   3.499   3.499
 1038    HA   THR 131           HA       THR 131  -1.453   3.256   3.256
 1039    HB   THR 131           HB       THR 131  -2.609   4.778   4.778
 1040    HG1  THR 131           HG1      THR 131  -1.499   3.099   3.099
 1041   1HG2  THR 131          1HG2      THR 131   0.135   4.493   4.493
 1042   2HG2  THR 131          3HG2      THR 131  -0.036   4.632   4.632
 1043   3HG2  THR 131          2HG2      THR 131  -0.639   5.914   5.914
 1044    H    ARG 132           H        ARG 132  -0.441   5.073   5.073
 1045    HA   ARG 132           HA       ARG 132  -1.882   7.594   7.594
 1046   1HB   ARG 132          2HB       ARG 132  -1.201   7.413   7.413
 1047   2HB   ARG 132          1HB       ARG 132  -2.749   6.798   6.798
 1048   1HG   ARG 132          2HG       ARG 132  -1.633   4.528   4.528
 1049   2HG   ARG 132          1HG       ARG 132  -0.232   5.207   5.207
 1050   1HD   ARG 132          2HD       ARG 132  -1.553   4.146   4.146
 1051   2HD   ARG 132          1HD       ARG 132  -1.835   5.877   5.877
 1052    HE   ARG 132           HE       ARG 132  -3.803   4.751   4.751
 1053   1HH1  ARG 132          1HH2      ARG 132  -3.757   6.478   6.478
 1054   2HH1  ARG 132          2HH2      ARG 132  -4.923   5.566   5.566
 1055   1HH2  ARG 132          2HH1      ARG 132  -4.908   2.880   2.880
 1056   2HH2  ARG 132          1HH1      ARG 132  -5.575   3.530   3.530
 1057    H    VAL 133           H        VAL 133  -0.300   9.078   9.078
 1058    HA   VAL 133           HA       VAL 133   2.524   8.318   8.318
 1059    HB   VAL 133           HB       VAL 133   1.277  10.977  10.977
 1060   1HG1  VAL 133          1HG1      VAL 133   4.051   9.824   9.824
 1061   2HG1  VAL 133          3HG1      VAL 133   3.480  11.291  11.291
 1062   3HG1  VAL 133          2HG1      VAL 133   3.616  11.237  11.237
 1063   1HG2  VAL 133          1HG2      VAL 133   1.791   8.464   8.464
 1064   2HG2  VAL 133          3HG2      VAL 133   0.474   9.625   9.625
 1065   3HG2  VAL 133          2HG2      VAL 133   2.068   9.998   9.998
 1066    H    TYR 134           H        TYR 134   3.986   9.033   9.033
 1067    HA   TYR 134           HA       TYR 134   2.857  10.838  10.838
 1068   1HB   TYR 134          2HB       TYR 134   4.337   8.245   8.245
 1069   2HB   TYR 134          1HB       TYR 134   4.483   9.483   9.483
 1070    HD1  TYR 134           HD2      TYR 134   2.522  10.237  10.237
 1071    HD2  TYR 134           HD1      TYR 134   2.238   7.075   7.075
 1072    HE1  TYR 134           HE2      TYR 134   0.341   9.556   9.556
 1073    HE2  TYR 134           HE1      TYR 134   0.070   6.382   6.382
 1074    HH   TYR 134           HH       TYR 134  -0.979   6.946   6.946
 1075    H    VAL 135           H        VAL 135   4.038  12.615  12.615
 1076    HA   VAL 135           HA       VAL 135   6.899  12.533  12.533
 1077    HB   VAL 135           HB       VAL 135   4.836  14.350  14.350
 1078   1HG1  VAL 135          1HG1      VAL 135   5.231  15.450  15.450
 1079   2HG1  VAL 135          3HG1      VAL 135   6.889  15.771  15.771
 1080   3HG1  VAL 135          2HG1      VAL 135   5.541  16.505  16.505
 1081   1HG2  VAL 135          2HG2      VAL 135   7.799  14.183  14.183
 1082   2HG2  VAL 135          1HG2      VAL 135   6.520  14.081  14.081
 1083   3HG2  VAL 135          3HG2      VAL 135   6.969  15.646  15.646
 1084    H    ARG 136           H        ARG 136   8.472  13.025  13.025
 1085    HA   ARG 136           HA       ARG 136   7.954  12.528  12.528
 1086   1HB   ARG 136          2HB       ARG 136  10.177  13.510  13.510
 1087   2HB   ARG 136          1HB       ARG 136  10.072  14.397  14.397
 1088   1HG   ARG 136          2HG       ARG 136  10.372  12.509  12.509
 1089   2HG   ARG 136          1HG       ARG 136   9.745  11.426  11.426
 1090   1HD   ARG 136          2HD       ARG 136  12.448  12.796  12.796
 1091   2HD   ARG 136          1HD       ARG 136  12.127  11.064  11.064
 1092    HE   ARG 136           HE       ARG 136  10.994  11.858  11.858
 1093   1HH1  ARG 136          1HH2      ARG 136  13.616  10.224  10.224
 1094   2HH1  ARG 136          2HH2      ARG 136  14.710  11.046  11.046
 1095   1HH2  ARG 136          2HH1      ARG 136  12.602  13.752  13.752
 1096   2HH2  ARG 136          1HH1      ARG 136  14.137  13.044  13.044
 1097    H    GLU 137           HN       GLU 137   7.037  13.556  13.556
 1098    HA   GLU 137           HA       GLU 137   5.533  15.891  15.891
 1099   1HB   GLU 137          2HB       GLU 137   5.371  14.265  14.265
 1100   2HB   GLU 137          1HB       GLU 137   6.955  14.766  14.766
 1101   1HG   GLU 137          2HG       GLU 137   6.172  16.683  16.683
 1102   2HG   GLU 137          1HG       GLU 137   5.000  16.944  16.944

  Start of MODEL    3
    1   1H    PRO   1          1H        PRO   1 -15.390   5.107   5.107
    2   2H    PRO   1          2H        PRO   1 -15.971   4.226   4.226
    3    HA   PRO   1           HA       PRO   1 -17.559   3.323   3.323
    4   1HB   PRO   1          2HB       PRO   1 -18.819   5.600   5.600
    5   2HB   PRO   1          1HB       PRO   1 -19.373   4.656   4.656
    6   1HG   PRO   1          2HG       PRO   1 -18.301   7.303   7.303
    7   2HG   PRO   1          1HG       PRO   1 -18.820   6.339   6.339
    8   1HD   PRO   1          1HD       PRO   1 -16.138   7.002   7.002
    9   2HD   PRO   1          2HD       PRO   1 -16.665   6.098   6.098
   10    H    ASN   2           H        ASN   2 -16.004   6.018   6.018
   11    HA   ASN   2           HA       ASN   2 -15.839   4.239   4.239
   12   1HB   ASN   2          2HB       ASN   2 -16.901   7.025   7.025
   13   2HB   ASN   2          1HB       ASN   2 -15.999   6.596   6.596
   14   1HD2  ASN   2          2HD2      ASN   2 -19.745   5.127   5.127
   15   2HD2  ASN   2          1HD2      ASN   2 -19.018   6.134   6.134
   16    H    PHE   3           H        PHE   3 -13.866   4.182   4.182
   17    HA   PHE   3           HA       PHE   3 -11.698   5.841   5.841
   18   1HB   PHE   3          2HB       PHE   3 -11.671   3.391   3.391
   19   2HB   PHE   3          1HB       PHE   3 -10.234   4.221   4.221
   20    HD1  PHE   3           HD1      PHE   3 -13.429   2.938   2.938
   21    HD2  PHE   3           HD2      PHE   3  -9.142   3.142   3.142
   22    HE1  PHE   3           HE1      PHE   3 -13.448   1.576   1.576
   23    HE2  PHE   3           HE2      PHE   3  -9.167   1.771   1.771
   24    HZ   PHE   3           HZ       PHE   3 -11.319   0.981   0.981
   25    H    SER   4           H        SER   4 -13.832   6.042   6.042
   26    HA   SER   4           HA       SER   4 -12.059   6.604   6.604
   27   1HB   SER   4          2HB       SER   4 -14.451   5.900   5.900
   28   2HB   SER   4          1HB       SER   4 -14.932   7.491   7.491
   29    HG   SER   4           HG       SER   4 -14.362   8.342   8.342
   30    H    GLY   5           H        GLY   5 -10.837   8.337   8.337
   31   1HA   GLY   5          2HA       GLY   5 -11.554  10.993  10.993
   32   2HA   GLY   5          1HA       GLY   5 -11.158  10.754  10.754
   33    H    ASN   6           H        ASN   6  -9.397  12.413  12.413
   34    HA   ASN   6           HA       ASN   6  -7.122  10.920  10.920
   35   1HB   ASN   6          2HB       ASN   6  -7.699  13.857  13.857
   36   2HB   ASN   6          1HB       ASN   6  -6.052  13.293  13.293
   37   1HD2  ASN   6          2HD2      ASN   6  -7.013  12.001  12.001
   38   2HD2  ASN   6          1HD2      ASN   6  -6.277  11.384  11.384
   39    H    TRP   7           H        TRP   7  -4.964  11.500  11.500
   40    HA   TRP   7           HA       TRP   7  -5.463  11.721  11.721
   41   1HB   TRP   7          2HB       TRP   7  -4.347   9.256   9.256
   42   2HB   TRP   7          1HB       TRP   7  -4.279   9.540   9.540
   43    HD1  TRP   7           HD1      TRP   7  -6.556   8.359   8.359
   44    HE1  TRP   7           HE1      TRP   7  -8.919   7.898   7.898
   45    HE3  TRP   7           HE3      TRP   7  -6.027  10.467  10.467
   46    HZ2  TRP   7           HZ2      TRP   7 -10.382   8.400   8.400
   47    HZ3  TRP   7           HZ3      TRP   7  -7.910  10.507  10.507
   48    HH2  TRP   7           HH2      TRP   7 -10.072   9.475   9.475
   49    H    LYS   8           H        LYS   8  -3.924  12.884  12.884
   50    HA   LYS   8           HA       LYS   8  -1.200  12.874  12.874
   51   1HB   LYS   8          2HB       LYS   8  -2.858  15.094  15.094
   52   2HB   LYS   8          1HB       LYS   8  -1.102  15.172  15.172
   53   1HG   LYS   8          2HG       LYS   8  -1.126  14.605  14.605
   54   2HG   LYS   8          1HG       LYS   8  -2.793  15.175  15.175
   55   1HD   LYS   8          2HD       LYS   8  -2.181  17.351  17.351
   56   2HD   LYS   8          1HD       LYS   8  -0.739  16.883  16.883
   57   1HE   LYS   8          2HE       LYS   8  -0.216  15.967  15.967
   58   2HE   LYS   8          1HE       LYS   8  -1.029  17.509  17.509
   59   1HZ   LYS   8          1HZ       LYS   8   1.115  17.283  17.283
   60   2HZ   LYS   8          3HZ       LYS   8   1.502  17.478  17.478
   61   3HZ   LYS   8          2HZ       LYS   8   0.575  18.657  18.657
   62    H    ILE   9           H        ILE   9   0.084  11.734  11.734
   63    HA   ILE   9           HA       ILE   9  -0.404  10.774  10.774
   64    HB   ILE   9           HB       ILE   9   1.309   9.898   9.898
   65   1HG1  ILE   9          2HG1      ILE   9   2.403  10.996  10.996
   66   2HG1  ILE   9          1HG1      ILE   9   1.636   9.429   9.429
   67   1HG2  ILE   9          2HG2      ILE   9   1.948  12.497  12.497
   68   2HG2  ILE   9          1HG2      ILE   9   3.256  12.063  12.063
   69   3HG2  ILE   9          3HG2      ILE   9   3.005  11.139  11.139
   70   1HD1  ILE   9          3HD1      ILE   9   3.609   9.230   9.230
   71   2HD1  ILE   9          2HD1      ILE   9   4.396  10.321  10.321
   72   3HD1  ILE   9          1HD1      ILE   9   3.830   8.741   8.741
   73    H    ILE  10           H        ILE  10   0.197  11.426  11.426
   74    HA   ILE  10           HA       ILE  10   1.137  14.246  14.246
   75    HB   ILE  10           HB       ILE  10  -0.322  14.464  14.464
   76   1HG1  ILE  10          2HG1      ILE  10  -2.162  12.432  12.432
   77   2HG1  ILE  10          1HG1      ILE  10  -0.676  11.564  11.564
   78   1HG2  ILE  10          3HG2      ILE  10  -1.166  15.077  15.077
   79   2HG2  ILE  10          2HG2      ILE  10  -1.816  13.448  13.448
   80   3HG2  ILE  10          1HG2      ILE  10  -2.461  14.520  14.520
   81   1HD1  ILE  10          3HD1      ILE  10   0.276  12.946  12.946
   82   2HD1  ILE  10          2HD1      ILE  10  -1.427  13.029  13.029
   83   3HD1  ILE  10          1HD1      ILE  10  -0.639  11.462  11.462
   84    H    ARG  11           H        ARG  11   1.368  10.925  10.925
   85    HA   ARG  11           HA       ARG  11   3.800  11.644  11.644
   86   1HB   ARG  11          2HB       ARG  11   1.246  10.769  10.769
   87   2HB   ARG  11          1HB       ARG  11   2.729  10.048  10.048
   88   1HG   ARG  11          2HG       ARG  11   3.677  12.292  12.292
   89   2HG   ARG  11          1HG       ARG  11   2.204  13.023  13.023
   90   1HD   ARG  11          2HD       ARG  11   0.906  12.304  12.304
   91   2HD   ARG  11          1HD       ARG  11   2.090  11.087  11.087
   92    HE   ARG  11           HE       ARG  11   3.316  13.653  13.653
   93   1HH1  ARG  11          2HH1      ARG  11   2.934  11.349  11.349
   94   2HH1  ARG  11          1HH1      ARG  11   2.158  12.229  12.229
   95   1HH2  ARG  11          1HH2      ARG  11   1.408  14.969  14.969
   96   2HH2  ARG  11          2HH2      ARG  11   1.294  14.278  14.278
   97    H    SER  12           H        SER  12   4.677   9.481   9.481
   98    HA   SER  12           HA       SER  12   4.022   6.933   6.933
   99   1HB   SER  12          2HB       SER  12   5.734   6.652   6.652
  100   2HB   SER  12          1HB       SER  12   4.789   8.074   8.074
  101    HG   SER  12           HG       SER  12   6.539   9.205   9.205
  102    H    GLU  13           H        GLU  13   5.897   5.348   5.348
  103    HA   GLU  13           HA       GLU  13   8.040   6.393   6.393
  104   1HB   GLU  13          2HB       GLU  13   7.263   5.142   5.142
  105   2HB   GLU  13          1HB       GLU  13   6.225   6.498   6.498
  106   1HG   GLU  13          2HG       GLU  13   5.496   3.950   3.950
  107   2HG   GLU  13          1HG       GLU  13   5.327   3.944   3.944
  108    H    ASN  14           H        ASN  14   7.567   4.482   4.482
  109    HA   ASN  14           HA       ASN  14   9.497   2.463   2.463
  110   1HB   ASN  14          2HB       ASN  14   6.640   1.773   1.773
  111   2HB   ASN  14          1HB       ASN  14   7.914   0.599   0.599
  112   1HD2  ASN  14          2HD2      ASN  14   6.508   0.778   0.778
  113   2HD2  ASN  14          1HD2      ASN  14   5.665   1.147   1.147
  114    H    PHE  15           H        PHE  15   9.125   4.567   4.567
  115    HA   PHE  15           HA       PHE  15   8.690   3.228   3.228
  116   1HB   PHE  15          2HB       PHE  15   8.734   5.761   5.761
  117   2HB   PHE  15          1HB       PHE  15  10.485   5.628   5.628
  118    HD1  PHE  15           HD2      PHE  15   9.957   3.203   3.203
  119    HD2  PHE  15           HD1      PHE  15   9.169   7.410   7.410
  120    HE1  PHE  15           HE2      PHE  15  10.012   3.441   3.441
  121    HE2  PHE  15           HE1      PHE  15   9.217   7.611   7.611
  122    HZ   PHE  15           HZ       PHE  15   9.633   5.594   5.594
  123    H    GLU  16           H        GLU  16  11.812   4.426   4.426
  124    HA   GLU  16           HA       GLU  16  13.458   2.905   2.905
  125   1HB   GLU  16          2HB       GLU  16  15.237   3.253   3.253
  126   2HB   GLU  16          1HB       GLU  16  14.358   4.737   4.737
  127   1HG   GLU  16          2HG       GLU  16  12.958   4.413   4.413
  128   2HG   GLU  16          1HG       GLU  16  13.819   2.917   2.917
  129    H    GLU  17           H        GLU  17  11.789   1.996   1.996
  130    HA   GLU  17           HA       GLU  17  13.252  -0.382  -0.382
  131   1HB   GLU  17          2HB       GLU  17  10.366   0.336   0.336
  132   2HB   GLU  17          1HB       GLU  17  11.240  -1.000  -1.000
  133   1HG   GLU  17          2HG       GLU  17  13.004   0.925   0.925
  134   2HG   GLU  17          1HG       GLU  17  11.563   1.936   1.936
  135    H    LEU  18           H        LEU  18  10.456   0.260   0.260
  136    HA   LEU  18           HA       LEU  18  10.081  -2.533  -2.533
  137   1HB   LEU  18          2HB       LEU  18   8.224  -0.830  -0.830
  138   2HB   LEU  18          1HB       LEU  18   8.976  -0.068  -0.068
  139    HG   LEU  18           HG       LEU  18   8.792  -2.224  -2.224
  140   1HD1  LEU  18          1HD1      LEU  18   7.804  -3.085  -3.085
  141   2HD1  LEU  18          3HD1      LEU  18   6.921  -3.715  -3.715
  142   3HD1  LEU  18          2HD1      LEU  18   8.653  -4.009  -4.009
  143   1HD2  LEU  18          3HD2      LEU  18   6.886  -0.333  -0.333
  144   2HD2  LEU  18          2HD2      LEU  18   6.661  -1.732  -1.732
  145   3HD2  LEU  18          1HD2      LEU  18   6.017  -1.748  -1.748
  146    H    LEU  19           H        LEU  19  12.154   0.001   0.001
  147    HA   LEU  19           HA       LEU  19  12.444  -1.262  -1.262
  148   1HB   LEU  19          2HB       LEU  19  14.112   1.017   1.017
  149   2HB   LEU  19          1HB       LEU  19  13.843   0.584   0.584
  150    HG   LEU  19           HG       LEU  19  12.067   2.084   2.084
  151   1HD1  LEU  19          2HD1      LEU  19  13.571   2.735   2.735
  152   2HD1  LEU  19          1HD1      LEU  19  11.976   2.524   2.524
  153   3HD1  LEU  19          3HD1      LEU  19  12.206   3.673   3.673
  154   1HD2  LEU  19          3HD2      LEU  19  11.099   0.023   0.023
  155   2HD2  LEU  19          2HD2      LEU  19  10.305   0.681   0.681
  156   3HD2  LEU  19          1HD2      LEU  19  10.294   1.583   1.583
  157    H    LYS  20           H        LYS  20  13.898  -1.335  -1.335
  158    HA   LYS  20           HA       LYS  20  16.449  -2.440  -2.440
  159   1HB   LYS  20          2HB       LYS  20  15.372  -2.526  -2.526
  160   2HB   LYS  20          1HB       LYS  20  17.053  -2.622  -2.622
  161   1HG   LYS  20          2HG       LYS  20  15.868  -0.187  -0.187
  162   2HG   LYS  20          1HG       LYS  20  15.596  -0.298  -0.298
  163   1HD   LYS  20          2HD       LYS  20  18.286  -0.610  -0.610
  164   2HD   LYS  20          1HD       LYS  20  17.728   0.846   0.846
  165   1HE   LYS  20          2HE       LYS  20  17.384  -0.619  -0.619
  166   2HE   LYS  20          1HE       LYS  20  18.292  -1.867  -1.867
  167   1HZ   LYS  20          1HZ       LYS  20  20.035  -0.069  -0.069
  168   2HZ   LYS  20          3HZ       LYS  20  19.212   0.803   0.803
  169   3HZ   LYS  20          2HZ       LYS  20  19.879  -0.717  -0.717
  170    H    VAL  21           H        VAL  21  13.323  -3.537  -3.537
  171    HA   VAL  21           HA       VAL  21  14.118  -6.325  -6.325
  172    HB   VAL  21           HB       VAL  21  12.220  -5.256  -5.256
  173   1HG1  VAL  21          2HG1      VAL  21  11.402  -3.870  -3.870
  174   2HG1  VAL  21          1HG1      VAL  21  10.778  -5.326  -5.326
  175   3HG1  VAL  21          3HG1      VAL  21  10.126  -4.790  -4.790
  176   1HG2  VAL  21          2HG2      VAL  21  12.442  -7.782  -7.782
  177   2HG2  VAL  21          1HG2      VAL  21  10.960  -7.216  -7.216
  178   3HG2  VAL  21          3HG2      VAL  21  11.029  -7.394  -7.394
  179    H    LEU  22           H        LEU  22  12.483  -4.341  -4.341
  180    HA   LEU  22           HA       LEU  22  11.798  -6.399  -6.399
  181   1HB   LEU  22          2HB       LEU  22  11.908  -3.445  -3.445
  182   2HB   LEU  22          1HB       LEU  22  12.121  -4.102  -4.102
  183    HG   LEU  22           HG       LEU  22   9.998  -5.235  -5.235
  184   1HD1  LEU  22          3HD1      LEU  22  10.151  -5.884  -5.884
  185   2HD1  LEU  22          2HD1      LEU  22   9.750  -4.225  -4.225
  186   3HD1  LEU  22          1HD1      LEU  22   8.582  -5.213  -5.213
  187   1HD2  LEU  22          3HD2      LEU  22   9.793  -2.441  -2.441
  188   2HD2  LEU  22          2HD2      LEU  22   9.965  -2.831  -2.831
  189   3HD2  LEU  22          1HD2      LEU  22   8.498  -3.290  -3.290
  190    H    GLY  23           H        GLY  23  14.426  -4.051  -4.051
  191   1HA   GLY  23          2HA       GLY  23  15.853  -5.515  -5.515
  192   2HA   GLY  23          1HA       GLY  23  16.193  -3.863  -3.863
  193    H    VAL  24           H        VAL  24  18.408  -4.383  -4.383
  194    HA   VAL  24           HA       VAL  24  19.159  -5.542  -5.542
  195    HB   VAL  24           HB       VAL  24  20.422  -6.531  -6.531
  196   1HG1  VAL  24          2HG1      VAL  24  21.829  -6.474  -6.474
  197   2HG1  VAL  24          1HG1      VAL  24  20.651  -7.540  -7.540
  198   3HG1  VAL  24          3HG1      VAL  24  21.570  -8.099  -8.099
  199   1HG2  VAL  24          3HG2      VAL  24  18.355  -7.798  -7.798
  200   2HG2  VAL  24          2HG2      VAL  24  18.181  -7.432  -7.432
  201   3HG2  VAL  24          1HG2      VAL  24  19.286  -8.702  -8.702
  202    H    ASN  25           H        ASN  25  20.234  -3.972  -3.972
  203    HA   ASN  25           HA       ASN  25  22.784  -3.088  -3.088
  204   1HB   ASN  25          2HB       ASN  25  21.436  -2.945  -2.945
  205   2HB   ASN  25          1HB       ASN  25  21.223  -1.296  -1.296
  206   1HD2  ASN  25          2HD2      ASN  25  24.514  -0.382  -0.382
  207   2HD2  ASN  25          1HD2      ASN  25  22.944   0.116   0.116
  208    H    VAL  26           H        VAL  26  22.661  -0.258  -0.258
  209    HA   VAL  26           HA       VAL  26  21.000   0.568   0.568
  210    HB   VAL  26           HB       VAL  26  22.933   2.222   2.222
  211   1HG1  VAL  26          2HG1      VAL  26  22.859  -0.713  -0.713
  212   2HG1  VAL  26          1HG1      VAL  26  24.274   0.204   0.204
  213   3HG1  VAL  26          3HG1      VAL  26  22.672   0.645   0.645
  214   1HG2  VAL  26          1HG2      VAL  26  24.320   0.182   0.182
  215   2HG2  VAL  26          3HG2      VAL  26  24.248   1.927   1.927
  216   3HG2  VAL  26          2HG2      VAL  26  25.177   1.259   1.259
  217    H    MET  27           H        MET  27  22.781   1.697   1.697
  218    HA   MET  27           HA       MET  27  21.549   4.303   4.303
  219   1HB   MET  27          2HB       MET  27  23.610   3.180   3.180
  220   2HB   MET  27          1HB       MET  27  22.342   3.033   3.033
  221   1HG   MET  27          2HG       MET  27  22.019   5.351   5.351
  222   2HG   MET  27          1HG       MET  27  22.739   5.636   5.636
  223   1HE   MET  27          3HE       MET  27  23.564   7.518   7.518
  224   2HE   MET  27          2HE       MET  27  25.212   7.601   7.601
  225   3HE   MET  27          1HE       MET  27  23.873   7.347   7.347
  226    H    LEU  28           H        LEU  28  20.658   1.132   1.132
  227    HA   LEU  28           HA       LEU  28  18.583   1.806   1.806
  228   1HB   LEU  28          2HB       LEU  28  19.489  -0.534  -0.534
  229   2HB   LEU  28          1HB       LEU  28  17.769  -0.545  -0.545
  230    HG   LEU  28           HG       LEU  28  19.049  -1.670  -1.670
  231   1HD1  LEU  28          2HD1      LEU  28  17.043   0.088   0.088
  232   2HD1  LEU  28          1HD1      LEU  28  18.294   0.874   0.874
  233   3HD1  LEU  28          3HD1      LEU  28  17.807  -0.781  -0.781
  234   1HD2  LEU  28          1HD2      LEU  28  20.428   1.020   1.020
  235   2HD2  LEU  28          3HD2      LEU  28  21.174  -0.496  -0.496
  236   3HD2  LEU  28          2HD2      LEU  28  20.601  -0.306  -0.306
  237    H    ARG  29           H        ARG  29  18.646   1.672   1.672
  238    HA   ARG  29           HA       ARG  29  15.727   1.902   1.902
  239   1HB   ARG  29          2HB       ARG  29  17.828   2.220   2.220
  240   2HB   ARG  29          1HB       ARG  29  16.105   1.939   1.939
  241   1HG   ARG  29          2HG       ARG  29  16.245  -0.289  -0.289
  242   2HG   ARG  29          1HG       ARG  29  17.606  -0.031  -0.031
  243   1HD   ARG  29          2HD       ARG  29  19.103   0.314   0.314
  244   2HD   ARG  29          1HD       ARG  29  17.751   0.112   0.112
  245    HE   ARG  29           HE       ARG  29  18.021  -2.182  -2.182
  246   1HH1  ARG  29          1HH2      ARG  29  20.297  -0.775  -0.775
  247   2HH1  ARG  29          2HH2      ARG  29  20.465  -2.139  -2.139
  248   1HH2  ARG  29          2HH1      ARG  29  17.825  -3.887  -3.887
  249   2HH2  ARG  29          1HH1      ARG  29  19.064  -3.898  -3.898
  250    H    LYS  30           H        LYS  30  18.544   3.976   3.976
  251    HA   LYS  30           HA       LYS  30  17.074   6.244   6.244
  252   1HB   LYS  30          2HB       LYS  30  19.695   5.663   5.663
  253   2HB   LYS  30          1HB       LYS  30  19.608   6.706   6.706
  254   1HG   LYS  30          2HG       LYS  30  18.454   8.432   8.432
  255   2HG   LYS  30          1HG       LYS  30  18.687   7.403   7.403
  256   1HD   LYS  30          2HD       LYS  30  21.060   7.591   7.591
  257   2HD   LYS  30          1HD       LYS  30  20.989   8.286   8.286
  258   1HE   LYS  30          2HE       LYS  30  20.350  10.370  10.370
  259   2HE   LYS  30          1HE       LYS  30  19.553   9.714   9.714
  260   1HZ   LYS  30          3HZ       LYS  30  21.751   9.169   9.169
  261   2HZ   LYS  30          2HZ       LYS  30  22.482   9.889   9.889
  262   3HZ   LYS  30          1HZ       LYS  30  21.574  10.834  10.834
  263    H    ILE  31           H        ILE  31  17.573   5.010   5.010
  264    HA   ILE  31           HA       ILE  31  16.953   7.572   7.572
  265    HB   ILE  31           HB       ILE  31  17.049   4.758   4.758
  266   1HG1  ILE  31          2HG1      ILE  31  19.084   6.905   6.905
  267   2HG1  ILE  31          1HG1      ILE  31  19.168   5.998   5.998
  268   1HG2  ILE  31          1HG2      ILE  31  16.752   7.505   7.505
  269   2HG2  ILE  31          3HG2      ILE  31  17.338   6.122   6.122
  270   3HG2  ILE  31          2HG2      ILE  31  15.719   6.095   6.095
  271   1HD1  ILE  31          1HD1      ILE  31  18.830   3.940   3.940
  272   2HD1  ILE  31          3HD1      ILE  31  19.619   5.071   5.071
  273   3HD1  ILE  31          2HD1      ILE  31  20.425   4.582   4.582
  274    H    ALA  32           H        ALA  32  15.237   4.741   4.741
  275    HA   ALA  32           HA       ALA  32  12.760   5.402   5.402
  276   1HB   ALA  32          1HB       ALA  32  13.566   3.347   3.347
  277   2HB   ALA  32          3HB       ALA  32  11.868   3.601   3.601
  278   3HB   ALA  32          2HB       ALA  32  13.007   3.091   3.091
  279    H    VAL  33           H        VAL  33  14.250   6.098   6.098
  280    HA   VAL  33           HA       VAL  33  11.798   6.992   6.992
  281    HB   VAL  33           HB       VAL  33  14.587   7.737   7.737
  282   1HG1  VAL  33          3HG1      VAL  33  11.918   7.266   7.266
  283   2HG1  VAL  33          2HG1      VAL  33  13.420   7.330   7.330
  284   3HG1  VAL  33          1HG1      VAL  33  12.893   8.735   8.735
  285   1HG2  VAL  33          1HG2      VAL  33  13.582   5.042   5.042
  286   2HG2  VAL  33          3HG2      VAL  33  15.158   5.563   5.563
  287   3HG2  VAL  33          2HG2      VAL  33  13.821   5.363   5.363
  288    H    ALA  34           H        ALA  34  14.651   8.460   8.460
  289    HA   ALA  34           HA       ALA  34  13.831  11.183  11.183
  290   1HB   ALA  34          2HB       ALA  34  16.169  10.362  10.362
  291   2HB   ALA  34          1HB       ALA  34  15.547  10.149  10.149
  292   3HB   ALA  34          3HB       ALA  34  15.581  11.755  11.755
  293    H    ALA  35           H        ALA  35  13.322   8.763   8.763
  294    HA   ALA  35           HA       ALA  35  12.056  10.384  10.384
  295   1HB   ALA  35          1HB       ALA  35  11.588   7.471   7.471
  296   2HB   ALA  35          3HB       ALA  35  11.071   8.236   8.236
  297   3HB   ALA  35          2HB       ALA  35  12.789   8.066   8.066
  298    H    ALA  36           H        ALA  36  10.564   8.313   8.313
  299    HA   ALA  36           HA       ALA  36   7.950   9.606   9.606
  300   1HB   ALA  36          1HB       ALA  36   9.023   7.241   7.241
  301   2HB   ALA  36          3HB       ALA  36   7.651   8.012   8.012
  302   3HB   ALA  36          2HB       ALA  36   7.508   7.426   7.426
  303    H    SER  37           H        SER  37   9.451  11.692  11.692
  304    HA   SER  37           HA       SER  37   9.890  12.048  12.048
  305   1HB   SER  37          2HB       SER  37  10.958  13.576  13.576
  306   2HB   SER  37          1HB       SER  37   9.405  14.042  14.042
  307    HG   SER  37           HG       SER  37   9.075  15.335  15.335
  308    H    LYS  38           H        LYS  38   7.235  12.793  12.793
  309    HA   LYS  38           HA       LYS  38   5.286  12.592  12.592
  310   1HB   LYS  38          2HB       LYS  38   5.700  15.119  15.119
  311   2HB   LYS  38          1HB       LYS  38   4.205  14.778  14.778
  312   1HG   LYS  38          2HG       LYS  38   6.946  14.881  14.881
  313   2HG   LYS  38          1HG       LYS  38   5.794  16.215  16.215
  314   1HD   LYS  38          2HD       LYS  38   4.197  14.208  14.208
  315   2HD   LYS  38          1HD       LYS  38   5.752  13.676  13.676
  316   1HE   LYS  38          2HE       LYS  38   6.059  15.709  15.709
  317   2HE   LYS  38          1HE       LYS  38   4.743  16.505  16.505
  318   1HZ   LYS  38          2HZ       LYS  38   3.206  14.898  14.898
  319   2HZ   LYS  38          1HZ       LYS  38   4.488  14.230  14.230
  320   3HZ   LYS  38          3HZ       LYS  38   4.006  15.831  15.831
  321    HA   PRO  39           HA       PRO  39   4.282  10.873  10.873
  322   1HB   PRO  39          2HB       PRO  39   3.518   8.391   8.391
  323   2HB   PRO  39          1HB       PRO  39   5.172   8.816   8.816
  324   1HG   PRO  39          2HG       PRO  39   4.014   8.487   8.487
  325   2HG   PRO  39          1HG       PRO  39   5.673   8.211   8.211
  326   1HD   PRO  39          2HD       PRO  39   4.811  10.471  10.471
  327   2HD   PRO  39          1HD       PRO  39   6.302  10.372  10.372
  328    H    ALA  40           H        ALA  40   2.248  10.838  10.838
  329    HA   ALA  40           HA       ALA  40  -0.022  11.372  11.372
  330   1HB   ALA  40          1HB       ALA  40   0.569  11.974  11.974
  331   2HB   ALA  40          3HB       ALA  40  -1.113  11.868  11.868
  332   3HB   ALA  40          2HB       ALA  40  -0.033  13.048  13.048
  333    H    VAL  41           H        VAL  41  -2.170  10.458  10.458
  334    HA   VAL  41           HA       VAL  41  -1.921   7.860   7.860
  335    HB   VAL  41           HB       VAL  41  -2.734   8.170   8.170
  336   1HG1  VAL  41          2HG1      VAL  41  -3.164   5.811   5.811
  337   2HG1  VAL  41          1HG1      VAL  41  -3.340   5.747   5.747
  338   3HG1  VAL  41          3HG1      VAL  41  -4.416   6.763   6.763
  339   1HG2  VAL  41          2HG2      VAL  41  -0.668   6.522   6.522
  340   2HG2  VAL  41          1HG2      VAL  41  -0.379   7.799   7.799
  341   3HG2  VAL  41          3HG2      VAL  41  -1.089   6.268   6.268
  342    H    GLU  42           H        GLU  42  -4.137   6.965   6.965
  343    HA   GLU  42           HA       GLU  42  -6.389   8.837   8.837
  344   1HB   GLU  42          2HB       GLU  42  -5.348   9.630   9.630
  345   2HB   GLU  42          1HB       GLU  42  -5.479   8.010   8.010
  346   1HG   GLU  42          2HG       GLU  42  -8.030   8.983   8.983
  347   2HG   GLU  42          1HG       GLU  42  -7.392  10.035  10.035
  348    H    ILE  43           H        ILE  43  -7.836   7.433   7.433
  349    HA   ILE  43           HA       ILE  43  -7.867   4.639   4.639
  350    HB   ILE  43           HB       ILE  43  -8.945   5.983   5.983
  351   1HG1  ILE  43          2HG1      ILE  43  -7.580   3.826   3.826
  352   2HG1  ILE  43          1HG1      ILE  43  -6.787   4.061   4.061
  353   1HG2  ILE  43          2HG2      ILE  43  -9.664   3.278   3.278
  354   2HG2  ILE  43          1HG2      ILE  43  -9.652   3.556   3.556
  355   3HG2  ILE  43          3HG2      ILE  43 -10.729   4.494   4.494
  356   1HD1  ILE  43          1HD1      ILE  43  -6.330   6.410   6.410
  357   2HD1  ILE  43          3HD1      ILE  43  -7.106   6.167   6.167
  358   3HD1  ILE  43          2HD1      ILE  43  -5.615   5.308   5.308
  359    H    LYS  44           H        LYS  44  -9.517   3.796   3.796
  360    HA   LYS  44           HA       LYS  44 -11.885   5.521   5.521
  361   1HB   LYS  44          2HB       LYS  44 -11.346   3.121   3.121
  362   2HB   LYS  44          1HB       LYS  44 -11.932   4.710   4.710
  363   1HG   LYS  44          2HG       LYS  44  -9.638   5.620   5.620
  364   2HG   LYS  44          1HG       LYS  44  -9.048   4.055   4.055
  365   1HD   LYS  44          2HD       LYS  44  -9.524   3.047   3.047
  366   2HD   LYS  44          1HD       LYS  44 -10.497   4.424   4.424
  367   1HE   LYS  44          2HE       LYS  44  -7.656   4.952   4.952
  368   2HE   LYS  44          1HE       LYS  44  -7.957   4.132   4.132
  369   1HZ   LYS  44          1HZ       LYS  44  -9.473   6.554   6.554
  370   2HZ   LYS  44          3HZ       LYS  44  -7.919   6.687   6.687
  371   3HZ   LYS  44          2HZ       LYS  44  -9.152   5.910   5.910
  372    H    GLN  45           H        GLN  45 -13.124   4.820   4.820
  373    HA   GLN  45           HA       GLN  45 -13.417   1.902   1.902
  374   1HB   GLN  45          2HB       GLN  45 -13.178   2.715   2.715
  375   2HB   GLN  45          1HB       GLN  45 -13.651   4.337   4.337
  376   1HG   GLN  45          2HG       GLN  45 -15.288   3.606   3.606
  377   2HG   GLN  45          1HG       GLN  45 -16.077   3.480   3.480
  378   1HE2  GLN  45          2HE2      GLN  45 -16.130   0.268   0.268
  379   2HE2  GLN  45          1HE2      GLN  45 -16.160   1.880   1.880
  380    H    GLU  46           H        GLU  46 -15.096   0.804   0.804
  381    HA   GLU  46           HA       GLU  46 -17.656   2.256   2.256
  382   1HB   GLU  46          2HB       GLU  46 -16.210   0.368   0.368
  383   2HB   GLU  46          1HB       GLU  46 -17.922   0.757   0.757
  384   1HG   GLU  46          2HG       GLU  46 -15.796   2.899   2.899
  385   2HG   GLU  46          1HG       GLU  46 -16.295   2.191   2.191
  386    H    GLY  47           H        GLY  47 -17.478   1.004   1.004
  387   1HA   GLY  47          2HA       GLY  47 -18.996  -0.517  -0.517
  388   2HA   GLY  47          1HA       GLY  47 -19.086  -1.469  -1.469
  389    H    ASP  48           H        ASP  48 -18.261  -3.460  -3.460
  390    HA   ASP  48           HA       ASP  48 -16.148  -3.840  -3.840
  391   1HB   ASP  48          2HB       ASP  48 -16.085  -6.190  -6.190
  392   2HB   ASP  48          1HB       ASP  48 -17.596  -5.706  -5.706
  393    H    THR  49           H        THR  49 -15.994  -2.662  -2.662
  394    HA   THR  49           HA       THR  49 -13.396  -3.954  -3.954
  395    HB   THR  49           HB       THR  49 -15.343  -2.275  -2.275
  396    HG1  THR  49           HG1      THR  49 -15.837  -4.229  -4.229
  397   1HG2  THR  49          1HG2      THR  49 -12.462  -2.890  -2.890
  398   2HG2  THR  49          3HG2      THR  49 -13.669  -2.533  -2.533
  399   3HG2  THR  49          2HG2      THR  49 -13.271  -1.323  -1.323
  400    H    PHE  50           H        PHE  50 -11.493  -2.846  -2.846
  401    HA   PHE  50           HA       PHE  50 -11.659   0.082   0.082
  402   1HB   PHE  50          2HB       PHE  50 -10.028  -1.953  -1.953
  403   2HB   PHE  50          1HB       PHE  50  -9.899  -0.201  -0.201
  404    HD1  PHE  50           HD2      PHE  50 -11.806   1.112   1.112
  405    HD2  PHE  50           HD1      PHE  50 -11.943  -3.169  -3.169
  406    HE1  PHE  50           HE2      PHE  50 -13.780   1.065   1.065
  407    HE2  PHE  50           HE1      PHE  50 -13.928  -3.209  -3.209
  408    HZ   PHE  50           HZ       PHE  50 -14.859  -1.098  -1.098
  409    H    TYR  51           H        TYR  51 -10.471   1.085   1.085
  410    HA   TYR  51           HA       TYR  51  -8.186  -0.310  -0.310
  411   1HB   TYR  51          2HB       TYR  51 -10.096   0.631   0.631
  412   2HB   TYR  51          1HB       TYR  51  -9.599   2.232   2.232
  413    HD1  TYR  51           HD1      TYR  51  -7.113   2.855   2.855
  414    HD2  TYR  51           HD2      TYR  51  -9.102  -0.344  -0.344
  415    HE1  TYR  51           HE1      TYR  51  -5.408   2.946   2.946
  416    HE2  TYR  51           HE2      TYR  51  -7.385  -0.252  -0.252
  417    HH   TYR  51           HH       TYR  51  -5.557   2.118   2.118
  418    H    ILE  52           H        ILE  52  -6.114   0.847   0.847
  419    HA   ILE  52           HA       ILE  52  -5.946   3.297   3.297
  420    HB   ILE  52           HB       ILE  52  -3.958   1.205   1.205
  421   1HG1  ILE  52          2HG1      ILE  52  -6.872   1.046   1.046
  422   2HG1  ILE  52          1HG1      ILE  52  -5.981  -0.174  -0.174
  423   1HG2  ILE  52          1HG2      ILE  52  -4.619   3.696   3.696
  424   2HG2  ILE  52          3HG2      ILE  52  -5.510   2.673   2.673
  425   3HG2  ILE  52          2HG2      ILE  52  -3.765   2.485   2.485
  426   1HD1  ILE  52          2HD1      ILE  52  -4.449   0.259   0.259
  427   2HD1  ILE  52          1HD1      ILE  52  -6.120   0.255   0.255
  428   3HD1  ILE  52          3HD1      ILE  52  -5.487  -1.129  -1.129
  429    H    LYS  53           H        LYS  53  -4.963   4.587   4.587
  430    HA   LYS  53           HA       LYS  53  -2.564   3.538   3.538
  431   1HB   LYS  53          2HB       LYS  53  -4.272   4.475   4.475
  432   2HB   LYS  53          1HB       LYS  53  -4.331   5.956   5.956
  433   1HG   LYS  53          2HG       LYS  53  -2.244   6.685   6.685
  434   2HG   LYS  53          1HG       LYS  53  -1.728   5.060   5.060
  435   1HD   LYS  53          2HD       LYS  53  -2.220   6.097   6.097
  436   2HD   LYS  53          1HD       LYS  53  -3.649   5.122   5.122
  437   1HE   LYS  53          2HE       LYS  53  -3.678   7.877   7.877
  438   2HE   LYS  53          1HE       LYS  53  -3.769   7.752   7.752
  439   1HZ   LYS  53          1HZ       LYS  53  -5.521   6.291   6.291
  440   2HZ   LYS  53          3HZ       LYS  53  -5.960   7.698   7.698
  441   3HZ   LYS  53          2HZ       LYS  53  -5.634   6.267   6.267
  442    H    THR  54           H        THR  54  -0.712   4.046   4.046
  443    HA   THR  54           HA       THR  54  -0.610   6.601   6.601
  444    HB   THR  54           HB       THR  54   1.331   4.266   4.266
  445    HG1  THR  54           HG1      THR  54  -0.226   3.373   3.373
  446   1HG2  THR  54          3HG2      THR  54   1.528   6.912   6.912
  447   2HG2  THR  54          2HG2      THR  54   1.211   5.891   5.891
  448   3HG2  THR  54          1HG2      THR  54   2.593   5.554   5.554
  449    H    SER  55           H        SER  55   1.036   8.131   8.131
  450    HA   SER  55           HA       SER  55   2.815   7.482   7.482
  451   1HB   SER  55          2HB       SER  55   2.165   9.904   9.904
  452   2HB   SER  55          1HB       SER  55   1.152   8.526   8.526
  453    HG   SER  55           HG       SER  55   0.557  10.695  10.695
  454    H    THR  56           H        THR  56   4.834   8.014   8.014
  455    HA   THR  56           HA       THR  56   5.234  10.163  10.163
  456    HB   THR  56           HB       THR  56   7.509   9.210   9.210
  457    HG1  THR  56           HG1      THR  56   8.180   7.606   7.606
  458   1HG2  THR  56          2HG2      THR  56   5.056   7.858   7.858
  459   2HG2  THR  56          1HG2      THR  56   6.291   6.661   6.661
  460   3HG2  THR  56          3HG2      THR  56   6.578   7.835   7.835
  461    H    THR  57           H        THR  57   7.948  10.762  10.762
  462    HA   THR  57           HA       THR  57   7.533  12.851  12.851
  463    HB   THR  57           HB       THR  57   9.447  12.823  12.823
  464    HG1  THR  57           HG1      THR  57   9.953  14.047  14.047
  465   1HG2  THR  57          1HG2      THR  57   9.702  10.228  10.228
  466   2HG2  THR  57          3HG2      THR  57  10.821  10.750  10.750
  467   3HG2  THR  57          2HG2      THR  57  11.107  11.207  11.207
  468    H    VAL  58           H        VAL  58   8.878   9.587   9.587
  469    HA   VAL  58           HA       VAL  58   8.320  10.044  10.044
  470    HB   VAL  58           HB       VAL  58  10.702   8.579   8.579
  471   1HG1  VAL  58          3HG1      VAL  58   9.715   9.219   9.219
  472   2HG1  VAL  58          2HG1      VAL  58  11.434   8.961   8.961
  473   3HG1  VAL  58          1HG1      VAL  58  10.276   7.674   7.674
  474   1HG2  VAL  58          2HG2      VAL  58  10.591  11.153  11.153
  475   2HG2  VAL  58          1HG2      VAL  58  12.024  10.483  10.483
  476   3HG2  VAL  58          3HG2      VAL  58  10.755  11.218  11.218
  477    H    ARG  59           H        ARG  59   7.753   8.022   8.022
  478    HA   ARG  59           HA       ARG  59   7.347   5.619   5.619
  479   1HB   ARG  59          2HB       ARG  59   8.526   5.419   5.419
  480   2HB   ARG  59          1HB       ARG  59   7.012   5.878   5.878
  481   1HG   ARG  59          2HG       ARG  59   5.904   3.928   3.928
  482   2HG   ARG  59          1HG       ARG  59   7.076   3.610   3.610
  483   1HD   ARG  59          2HD       ARG  59   8.006   3.638   3.638
  484   2HD   ARG  59          1HD       ARG  59   7.168   2.214   2.214
  485    HE   ARG  59           HE       ARG  59   9.031   1.778   1.778
  486   1HH1  ARG  59          1HH2      ARG  59  10.006   3.616   3.616
  487   2HH1  ARG  59          2HH2      ARG  59  11.320   4.411   4.411
  488   1HH2  ARG  59          1HH1      ARG  59  11.546   4.238   4.238
  489   2HH2  ARG  59          2HH1      ARG  59  10.402   3.315   3.315
  490    H    THR  60           H        THR  60   5.258   4.393   4.393
  491    HA   THR  60           HA       THR  60   2.957   5.862   5.862
  492    HB   THR  60           HB       THR  60   3.007   5.261   5.261
  493    HG1  THR  60           HG1      THR  60   3.780   7.206   7.206
  494   1HG2  THR  60          2HG2      THR  60   1.163   6.560   6.560
  495   2HG2  THR  60          1HG2      THR  60   1.218   7.227   7.227
  496   3HG2  THR  60          3HG2      THR  60   0.787   5.535   5.535
  497    H    THR  61           H        THR  61   2.508   3.952   3.952
  498    HA   THR  61           HA       THR  61   2.295   1.380   1.380
  499    HB   THR  61           HB       THR  61   1.395   0.711   0.711
  500    HG1  THR  61           HG1      THR  61   1.516   2.232   2.232
  501   1HG2  THR  61          1HG2      THR  61   4.144   1.296   1.296
  502   2HG2  THR  61          3HG2      THR  61   3.965   0.944   0.944
  503   3HG2  THR  61          2HG2      THR  61   3.436  -0.234  -0.234
  504    H    GLU  62           H        GLU  62   0.217   0.070   0.070
  505    HA   GLU  62           HA       GLU  62  -2.262   1.559   1.559
  506   1HB   GLU  62          2HB       GLU  62  -1.173   1.131   1.131
  507   2HB   GLU  62          1HB       GLU  62  -2.837   0.585   0.585
  508   1HG   GLU  62          2HG       GLU  62  -3.633   2.698   2.698
  509   2HG   GLU  62          1HG       GLU  62  -2.306   3.202   3.202
  510    H    ILE  63           H        ILE  63  -3.280   0.041   0.041
  511    HA   ILE  63           HA       ILE  63  -3.246  -2.798  -2.798
  512    HB   ILE  63           HB       ILE  63  -3.688  -3.442  -3.442
  513   1HG1  ILE  63          2HG1      ILE  63  -3.142  -0.525  -0.525
  514   2HG1  ILE  63          1HG1      ILE  63  -4.753  -1.244  -1.244
  515   1HG2  ILE  63          1HG2      ILE  63  -1.325  -2.991  -2.991
  516   2HG2  ILE  63          3HG2      ILE  63  -1.271  -1.673  -1.673
  517   3HG2  ILE  63          2HG2      ILE  63  -1.460  -3.337  -3.337
  518   1HD1  ILE  63          1HD1      ILE  63  -2.598  -2.578  -2.578
  519   2HD1  ILE  63          3HD1      ILE  63  -3.351  -1.121  -1.121
  520   3HD1  ILE  63          2HD1      ILE  63  -4.338  -2.536  -2.536
  521    H    ASN  64           H        ASN  64  -5.356  -3.960  -3.960
  522    HA   ASN  64           HA       ASN  64  -7.679  -2.321  -2.321
  523   1HB   ASN  64          2HB       ASN  64  -8.788  -2.399  -2.399
  524   2HB   ASN  64          1HB       ASN  64  -7.167  -1.779  -1.779
  525   1HD2  ASN  64          2HD2      ASN  64  -8.188  -5.476  -5.476
  526   2HD2  ASN  64          1HD2      ASN  64  -9.116  -4.754  -4.754
  527    H    PHE  65           H        PHE  65  -9.232  -3.662  -3.662
  528    HA   PHE  65           HA       PHE  65  -9.457  -6.472  -6.472
  529   1HB   PHE  65          2HB       PHE  65  -8.757  -7.444  -7.444
  530   2HB   PHE  65          1HB       PHE  65  -7.449  -6.465  -6.465
  531    HD1  PHE  65           HD2      PHE  65  -6.968  -4.202  -4.202
  532    HD2  PHE  65           HD1      PHE  65  -9.898  -6.816  -6.816
  533    HE1  PHE  65           HE2      PHE  65  -6.989  -2.815  -2.815
  534    HE2  PHE  65           HE1      PHE  65  -9.930  -5.433  -5.433
  535    HZ   PHE  65           HZ       PHE  65  -8.476  -3.427  -3.427
  536    H    LYS  66           H        LYS  66 -10.718  -7.652  -7.652
  537    HA   LYS  66           HA       LYS  66 -12.967  -5.906  -5.906
  538   1HB   LYS  66          2HB       LYS  66 -14.450  -7.965  -7.965
  539   2HB   LYS  66          1HB       LYS  66 -13.931  -7.108  -7.108
  540   1HG   LYS  66          2HG       LYS  66 -12.012  -8.747  -8.747
  541   2HG   LYS  66          1HG       LYS  66 -12.763  -9.663  -9.663
  542   1HD   LYS  66          2HD       LYS  66 -13.551 -10.676 -10.676
  543   2HD   LYS  66          1HD       LYS  66 -14.887  -9.680  -9.680
  544   1HE   LYS  66          2HE       LYS  66 -13.598  -7.855  -7.855
  545   2HE   LYS  66          1HE       LYS  66 -13.151  -9.324  -9.324
  546   1HZ   LYS  66          3HZ       LYS  66 -15.563  -9.912  -9.912
  547   2HZ   LYS  66          2HZ       LYS  66 -15.882  -8.348  -8.348
  548   3HZ   LYS  66          1HZ       LYS  66 -15.177  -8.561  -8.561
  549    H    VAL  67           H        VAL  67 -13.947  -6.698  -6.698
  550    HA   VAL  67           HA       VAL  67 -11.949  -8.059  -8.059
  551    HB   VAL  67           HB       VAL  67 -14.608  -7.569  -7.569
  552   1HG1  VAL  67          1HG1      VAL  67 -11.735  -6.878  -6.878
  553   2HG1  VAL  67          3HG1      VAL  67 -13.103  -6.466  -6.466
  554   3HG1  VAL  67          2HG1      VAL  67 -12.718  -8.157  -8.157
  555   1HG2  VAL  67          2HG2      VAL  67 -13.064  -5.386  -5.386
  556   2HG2  VAL  67          1HG2      VAL  67 -14.806  -5.562  -5.562
  557   3HG2  VAL  67          3HG2      VAL  67 -13.808  -5.050  -5.050
  558    H    GLY  68           H        GLY  68 -11.900 -10.235 -10.235
  559   1HA   GLY  68          2HA       GLY  68 -13.253 -12.219 -12.219
  560   2HA   GLY  68          1HA       GLY  68 -14.457 -11.736 -11.736
  561    H    GLU  69           H        GLU  69 -12.144 -11.058 -11.058
  562    HA   GLU  69           HA       GLU  69 -11.484 -13.890 -13.890
  563   1HB   GLU  69          2HB       GLU  69 -12.354 -11.582 -11.582
  564   2HB   GLU  69          1HB       GLU  69 -11.544 -13.003 -13.003
  565   1HG   GLU  69          2HG       GLU  69 -13.294 -14.461 -14.461
  566   2HG   GLU  69          1HG       GLU  69 -14.074 -13.098 -13.098
  567    H    GLU  70           H        GLU  70  -9.465 -14.181 -14.181
  568    HA   GLU  70           HA       GLU  70  -7.388 -12.281 -12.281
  569   1HB   GLU  70          2HB       GLU  70  -7.113 -14.862 -14.862
  570   2HB   GLU  70          1HB       GLU  70  -5.814 -13.977 -13.977
  571   1HG   GLU  70          2HG       GLU  70  -7.197 -14.268 -14.268
  572   2HG   GLU  70          1HG       GLU  70  -8.102 -15.487 -15.487
  573    H    PHE  71           H        PHE  71  -5.672 -11.666 -11.666
  574    HA   PHE  71           HA       PHE  71  -6.480 -11.549 -11.549
  575   1HB   PHE  71          2HB       PHE  71  -6.521  -9.038  -9.038
  576   2HB   PHE  71          1HB       PHE  71  -7.870  -9.744  -9.744
  577    HD1  PHE  71           HD2      PHE  71  -7.663  -9.964  -9.964
  578    HD2  PHE  71           HD1      PHE  71  -5.022  -7.552  -7.552
  579    HE1  PHE  71           HE2      PHE  71  -6.966  -8.722  -8.722
  580    HE2  PHE  71           HE1      PHE  71  -4.325  -6.311  -6.311
  581    HZ   PHE  71           HZ       PHE  71  -5.297  -6.892  -6.892
  582    H    GLU  72           H        GLU  72  -4.876 -10.002 -10.002
  583    HA   GLU  72           HA       GLU  72  -2.198 -10.414 -10.414
  584   1HB   GLU  72          2HB       GLU  72  -2.550  -9.664  -9.664
  585   2HB   GLU  72          1HB       GLU  72  -1.232 -10.538 -10.538
  586   1HG   GLU  72          2HG       GLU  72  -2.765 -12.460 -12.460
  587   2HG   GLU  72          1HG       GLU  72  -4.030 -11.601 -11.601
  588    H    GLU  73           H        GLU  73  -0.823  -8.638  -8.638
  589    HA   GLU  73           HA       GLU  73  -1.505  -6.011  -6.011
  590   1HB   GLU  73          2HB       GLU  73  -1.718  -4.944  -4.944
  591   2HB   GLU  73          1HB       GLU  73  -3.055  -6.030  -6.030
  592   1HG   GLU  73          2HG       GLU  73  -2.466  -7.533  -7.533
  593   2HG   GLU  73          1HG       GLU  73  -0.739  -7.300  -7.300
  594    H    GLN  74           H        GLN  74   0.003  -4.373  -4.373
  595    HA   GLN  74           HA       GLN  74   2.717  -5.623  -5.623
  596   1HB   GLN  74          2HB       GLN  74   1.742  -2.756  -2.756
  597   2HB   GLN  74          1HB       GLN  74   3.447  -3.155  -3.155
  598   1HG   GLN  74          2HG       GLN  74   1.749  -4.205  -4.205
  599   2HG   GLN  74          1HG       GLN  74   2.769  -2.772  -2.772
  600   1HE2  GLN  74          2HE2      GLN  74   5.805  -4.612  -4.612
  601   2HE2  GLN  74          1HE2      GLN  74   5.109  -3.077  -3.077
  602    H    THR  75           H        THR  75   4.288  -5.031  -5.031
  603    HA   THR  75           HA       THR  75   2.918  -4.924  -4.924
  604    HB   THR  75           HB       THR  75   4.536  -6.786  -6.786
  605    HG1  THR  75           HG1      THR  75   4.679  -6.874  -6.874
  606   1HG2  THR  75          2HG2      THR  75   6.217  -4.589  -4.589
  607   2HG2  THR  75          1HG2      THR  75   6.945  -5.422  -5.422
  608   3HG2  THR  75          3HG2      THR  75   6.578  -6.310  -6.310
  609    H    VAL  76           H        VAL  76   5.678  -3.939  -3.939
  610    HA   VAL  76           HA       VAL  76   5.145  -1.075  -1.075
  611    HB   VAL  76           HB       VAL  76   6.477  -2.260  -2.260
  612   1HG1  VAL  76          1HG1      VAL  76   7.061   0.090   0.090
  613   2HG1  VAL  76          3HG1      VAL  76   5.346   0.495   0.495
  614   3HG1  VAL  76          2HG1      VAL  76   6.068  -0.028  -0.028
  615   1HG2  VAL  76          1HG2      VAL  76   3.616  -1.702  -1.702
  616   2HG2  VAL  76          3HG2      VAL  76   4.300  -3.007  -3.007
  617   3HG2  VAL  76          2HG2      VAL  76   4.161  -1.385  -1.385
  618    H    ASP  77           H        ASP  77   7.566  -3.552  -3.552
  619    HA   ASP  77           HA       ASP  77   9.765  -1.604  -1.604
  620   1HB   ASP  77          2HB       ASP  77   9.709  -4.150  -4.150
  621   2HB   ASP  77          1HB       ASP  77  10.235  -4.433  -4.433
  622    H    GLY  78           H        GLY  78   7.895  -3.773  -3.773
  623   1HA   GLY  78          2HA       GLY  78   7.536  -2.710  -2.710
  624   2HA   GLY  78          1HA       GLY  78   9.298  -2.704  -2.704
  625    H    ARG  79           H        ARG  79   7.086  -5.182  -5.182
  626    HA   ARG  79           HA       ARG  79   8.078  -7.059  -7.059
  627   1HB   ARG  79          2HB       ARG  79   8.141  -7.272  -7.272
  628   2HB   ARG  79          1HB       ARG  79   7.839  -8.733  -8.733
  629   1HG   ARG  79          2HG       ARG  79   9.956  -7.544  -7.544
  630   2HG   ARG  79          1HG       ARG  79  10.322  -7.216  -7.216
  631   1HD   ARG  79          2HD       ARG  79   9.553  -9.969  -9.969
  632   2HD   ARG  79          1HD       ARG  79  11.227  -9.418  -9.418
  633    HE   ARG  79           HE       ARG  79   9.461  -9.864  -9.864
  634   1HH1  ARG  79          1HH2      ARG  79  12.398 -10.676 -10.676
  635   2HH1  ARG  79          2HH2      ARG  79  13.340 -10.185 -10.185
  636   1HH2  ARG  79          2HH1      ARG  79  10.714  -8.534  -8.534
  637   2HH2  ARG  79          1HH1      ARG  79  12.386  -8.973  -8.973
  638    HA   PRO  80           HA       PRO  80   3.767  -8.044  -8.044
  639   1HB   PRO  80          2HB       PRO  80   3.931 -10.551 -10.551
  640   2HB   PRO  80          1HB       PRO  80   4.216  -9.053  -9.053
  641   1HG   PRO  80          2HG       PRO  80   6.188 -11.068 -11.068
  642   2HG   PRO  80          1HG       PRO  80   6.310  -9.942  -9.942
  643   1HD   PRO  80          2HD       PRO  80   7.533  -9.628  -9.628
  644   2HD   PRO  80          1HD       PRO  80   7.391  -8.381  -8.381
  645    H    CYS  81           H        CYS  81   2.216  -9.073  -9.073
  646    HA   CYS  81           HA       CYS  81   2.761 -11.547 -11.547
  647   1HB   CYS  81          2HB       CYS  81   2.359 -10.505 -10.505
  648   2HB   CYS  81          1HB       CYS  81   3.896 -10.045 -10.045
  649    HG   CYS  81           HG       CYS  81   1.745  -8.030  -8.030
  650    H    LYS  82           H        LYS  82   0.823 -12.509 -12.509
  651    HA   LYS  82           HA       LYS  82  -1.647 -11.177 -11.177
  652   1HB   LYS  82          2HB       LYS  82  -1.347 -13.505 -13.505
  653   2HB   LYS  82          1HB       LYS  82  -1.097 -13.980 -13.980
  654   1HG   LYS  82          2HG       LYS  82  -3.301 -14.403 -14.403
  655   2HG   LYS  82          1HG       LYS  82  -3.557 -12.664 -12.664
  656   1HD   LYS  82          2HD       LYS  82  -4.840 -13.363 -13.363
  657   2HD   LYS  82          1HD       LYS  82  -3.300 -13.027 -13.027
  658   1HE   LYS  82          2HE       LYS  82  -2.818 -15.256 -15.256
  659   2HE   LYS  82          1HE       LYS  82  -3.686 -15.760 -15.760
  660   1HZ   LYS  82          1HZ       LYS  82  -5.140 -14.642 -14.642
  661   2HZ   LYS  82          3HZ       LYS  82  -4.698 -16.280 -16.280
  662   3HZ   LYS  82          2HZ       LYS  82  -5.715 -15.657 -15.657
  663    H    SER  83           H        SER  83  -2.696  -9.936  -9.936
  664    HA   SER  83           HA       SER  83  -2.246 -10.366 -10.366
  665   1HB   SER  83          2HB       SER  83  -1.876  -8.107  -8.107
  666   2HB   SER  83          1HB       SER  83  -3.189  -8.069  -8.069
  667    HG   SER  83           HG       SER  83  -3.680  -7.002  -7.002
  668    H    LEU  84           H        LEU  84  -4.216 -10.012 -10.012
  669    HA   LEU  84           HA       LEU  84  -6.817 -10.646 -10.646
  670   1HB   LEU  84          2HB       LEU  84  -5.934 -12.902 -12.902
  671   2HB   LEU  84          1HB       LEU  84  -5.520 -12.456 -12.456
  672    HG   LEU  84           HG       LEU  84  -7.889 -12.142 -12.142
  673   1HD1  LEU  84          1HD1      LEU  84  -8.198 -11.946 -11.946
  674   2HD1  LEU  84          3HD1      LEU  84  -9.088 -13.382 -13.382
  675   3HD1  LEU  84          2HD1      LEU  84  -9.456 -11.823 -11.823
  676   1HD2  LEU  84          3HD2      LEU  84  -6.904 -14.706 -14.706
  677   2HD2  LEU  84          2HD2      LEU  84  -7.361 -14.331 -14.331
  678   3HD2  LEU  84          1HD2      LEU  84  -8.608 -14.608 -14.608
  679    H    VAL  85           H        VAL  85  -8.567 -10.113 -10.113
  680    HA   VAL  85           HA       VAL  85  -7.645  -8.768  -8.768
  681    HB   VAL  85           HB       VAL  85  -9.415  -7.427  -7.427
  682   1HG1  VAL  85          1HG1      VAL  85  -8.819  -6.911  -6.911
  683   2HG1  VAL  85          3HG1      VAL  85  -8.224  -5.582  -5.582
  684   3HG1  VAL  85          2HG1      VAL  85  -9.919  -6.059  -6.059
  685   1HG2  VAL  85          1HG2      VAL  85  -6.462  -7.306  -7.306
  686   2HG2  VAL  85          3HG2      VAL  85  -7.306  -7.395  -7.395
  687   3HG2  VAL  85          2HG2      VAL  85  -7.300  -5.890  -5.890
  688    H    LYS  86           H        LYS  86  -9.005  -8.921  -8.921
  689    HA   LYS  86           HA       LYS  86 -11.828  -9.732  -9.732
  690   1HB   LYS  86          2HB       LYS  86 -11.445 -10.839 -10.839
  691   2HB   LYS  86          1HB       LYS  86 -11.118 -11.733 -11.733
  692   1HG   LYS  86          2HG       LYS  86  -8.723 -11.041 -11.041
  693   2HG   LYS  86          1HG       LYS  86  -9.090 -10.249 -10.249
  694   1HD   LYS  86          2HD       LYS  86  -8.237 -12.412 -12.412
  695   2HD   LYS  86          1HD       LYS  86  -9.983 -12.499 -12.499
  696   1HE   LYS  86          2HE       LYS  86  -9.835 -14.361 -14.361
  697   2HE   LYS  86          1HE       LYS  86  -9.773 -13.210 -13.210
  698   1HZ   LYS  86          2HZ       LYS  86  -7.307 -13.187 -13.187
  699   2HZ   LYS  86          1HZ       LYS  86  -7.494 -14.505 -14.505
  700   3HZ   LYS  86          3HZ       LYS  86  -7.940 -14.656 -14.656
  701    H    TRP  87           H        TRP  87 -13.256  -8.945  -8.945
  702    HA   TRP  87           HA       TRP  87 -12.380  -6.307  -6.307
  703   1HB   TRP  87          2HB       TRP  87 -14.948  -7.876  -7.876
  704   2HB   TRP  87          1HB       TRP  87 -14.734  -6.379  -6.379
  705    HD1  TRP  87           HD1      TRP  87 -15.633  -7.700  -7.700
  706    HE1  TRP  87           HE1      TRP  87 -15.859  -5.792  -5.792
  707    HE3  TRP  87           HE3      TRP  87 -13.523  -3.919  -3.919
  708    HZ2  TRP  87           HZ2      TRP  87 -15.219  -2.995  -2.995
  709    HZ3  TRP  87           HZ3      TRP  87 -13.314  -1.656  -1.656
  710    HH2  TRP  87           HH2      TRP  87 -14.154  -1.190  -1.190
  711    H    GLU  88           H        GLU  88 -13.007  -5.717  -5.717
  712    HA   GLU  88           HA       GLU  88 -12.350  -7.853  -7.853
  713   1HB   GLU  88          2HB       GLU  88 -10.363  -6.314  -6.314
  714   2HB   GLU  88          1HB       GLU  88 -11.214  -5.072  -5.072
  715   1HG   GLU  88          2HG       GLU  88  -9.778  -6.030  -6.030
  716   2HG   GLU  88          1HG       GLU  88 -11.331  -6.805  -6.805
  717    H    SER  89           H        SER  89 -13.375  -4.528  -4.528
  718    HA   SER  89           HA       SER  89 -15.472  -4.823  -4.823
  719   1HB   SER  89          2HB       SER  89 -15.036  -2.575  -2.575
  720   2HB   SER  89          1HB       SER  89 -13.495  -3.428  -3.428
  721    HG   SER  89           HG       SER  89 -14.204  -1.223  -1.223
  722    H    GLU  90           H        GLU  90 -16.425  -2.088  -2.088
  723    HA   GLU  90           HA       GLU  90 -17.945  -2.763  -2.763
  724   1HB   GLU  90          2HB       GLU  90 -18.960  -0.493  -0.493
  725   2HB   GLU  90          1HB       GLU  90 -19.044  -1.514  -1.514
  726   1HG   GLU  90          2HG       GLU  90 -17.292  -0.350  -0.350
  727   2HG   GLU  90          1HG       GLU  90 -16.738   0.382   0.382
  728    H    ASN  91           H        ASN  91 -15.097  -0.841  -0.841
  729    HA   ASN  91           HA       ASN  91 -14.836  -0.354  -0.354
  730   1HB   ASN  91          2HB       ASN  91 -14.308   1.843   1.843
  731   2HB   ASN  91          1HB       ASN  91 -14.352   1.968   1.968
  732   1HD2  ASN  91          2HD2      ASN  91 -17.685   2.775   2.775
  733   2HD2  ASN  91          1HD2      ASN  91 -16.110   2.928   2.928
  734    H    LYS  92           H        LYS  92 -13.437  -2.130  -2.130
  735    HA   LYS  92           HA       LYS  92 -10.697  -1.061  -1.061
  736   1HB   LYS  92          2HB       LYS  92 -11.295  -0.771  -0.771
  737   2HB   LYS  92          1HB       LYS  92 -11.606  -2.502  -2.502
  738   1HG   LYS  92          2HG       LYS  92  -9.213  -2.836  -2.836
  739   2HG   LYS  92          1HG       LYS  92  -8.974  -1.119  -1.119
  740   1HD   LYS  92          2HD       LYS  92  -9.528  -1.429  -1.429
  741   2HD   LYS  92          1HD       LYS  92  -9.954  -3.117  -3.117
  742   1HE   LYS  92          2HE       LYS  92  -7.747  -3.781  -3.781
  743   2HE   LYS  92          1HE       LYS  92  -7.221  -2.195  -2.195
  744   1HZ   LYS  92          3HZ       LYS  92  -7.717  -1.381  -1.381
  745   2HZ   LYS  92          2HZ       LYS  92  -7.892  -3.005  -3.005
  746   3HZ   LYS  92          1HZ       LYS  92  -6.401  -2.443  -2.443
  747    H    MET  93           H        MET  93  -9.929  -2.443  -2.443
  748    HA   MET  93           HA       MET  93 -10.531  -5.354  -5.354
  749   1HB   MET  93          2HB       MET  93  -9.937  -5.384  -5.384
  750   2HB   MET  93          1HB       MET  93 -11.544  -4.887  -4.887
  751   1HG   MET  93          2HG       MET  93 -11.170  -2.664  -2.664
  752   2HG   MET  93          1HG       MET  93  -9.437  -2.785  -2.785
  753   1HE   MET  93          3HE       MET  93 -12.367  -3.127  -3.127
  754   2HE   MET  93          2HE       MET  93 -11.764  -4.111  -4.111
  755   3HE   MET  93          1HE       MET  93 -11.983  -4.833  -4.833
  756    H    VAL  94           H        VAL  94  -8.888  -6.834  -6.834
  757    HA   VAL  94           HA       VAL  94  -6.131  -5.727  -5.727
  758    HB   VAL  94           HB       VAL  94  -6.815  -8.626  -8.626
  759   1HG1  VAL  94          2HG1      VAL  94  -4.551  -6.913  -6.913
  760   2HG1  VAL  94          1HG1      VAL  94  -5.042  -7.584  -7.584
  761   3HG1  VAL  94          3HG1      VAL  94  -4.662  -8.657  -8.657
  762   1HG2  VAL  94          2HG2      VAL  94  -7.407  -6.375  -6.375
  763   2HG2  VAL  94          1HG2      VAL  94  -8.488  -7.664  -7.664
  764   3HG2  VAL  94          3HG2      VAL  94  -7.140  -8.030  -8.030
  765    H    CYS  95           H        CYS  95  -4.434  -7.248  -7.248
  766    HA   CYS  95           HA       CYS  95  -5.548  -8.433  -8.433
  767   1HB   CYS  95          2HB       CYS  95  -5.093  -6.046  -6.046
  768   2HB   CYS  95          1HB       CYS  95  -3.422  -6.269  -6.269
  769    HG   CYS  95           HG       CYS  95  -4.477  -6.978  -6.978
  770    H    GLU  96           H        GLU  96  -4.380 -10.120 -10.120
  771    HA   GLU  96           HA       GLU  96  -1.762 -10.695 -10.695
  772   1HB   GLU  96          2HB       GLU  96  -2.205 -13.077 -13.077
  773   2HB   GLU  96          1HB       GLU  96  -3.385 -12.459 -12.459
  774   1HG   GLU  96          2HG       GLU  96  -5.019 -12.115 -12.115
  775   2HG   GLU  96          1HG       GLU  96  -3.830 -12.339 -12.339
  776    H    GLN  97           H        GLN  97  -0.062 -11.543 -11.543
  777    HA   GLN  97           HA       GLN  97  -0.631 -11.198 -11.198
  778   1HB   GLN  97          2HB       GLN  97  -0.027  -8.952  -8.952
  779   2HB   GLN  97          1HB       GLN  97   1.614  -9.574  -9.574
  780   1HG   GLN  97          2HG       GLN  97   1.063  -9.992  -9.992
  781   2HG   GLN  97          1HG       GLN  97  -0.328  -8.944  -8.944
  782   1HE2  GLN  97          2HE2      GLN  97   1.584  -5.973  -5.973
  783   2HE2  GLN  97          1HE2      GLN  97   0.046  -6.674  -6.674
  784    H    LYS  98           H        LYS  98   0.767 -12.266 -12.266
  785    HA   LYS  98           HA       LYS  98   3.314 -13.323 -13.323
  786   1HB   LYS  98          2HB       LYS  98   2.766 -15.598 -15.598
  787   2HB   LYS  98          1HB       LYS  98   1.692 -15.110 -15.110
  788   1HG   LYS  98          2HG       LYS  98  -0.039 -14.473 -14.473
  789   2HG   LYS  98          1HG       LYS  98   1.038 -14.825 -14.825
  790   1HD   LYS  98          2HD       LYS  98   0.853 -17.111 -17.111
  791   2HD   LYS  98          1HD       LYS  98   0.568 -16.993 -16.993
  792   1HE   LYS  98          2HE       LYS  98  -1.676 -15.891 -15.891
  793   2HE   LYS  98          1HE       LYS  98  -1.384 -16.498 -16.498
  794   1HZ   LYS  98          3HZ       LYS  98  -1.148 -18.312 -18.312
  795   2HZ   LYS  98          2HZ       LYS  98  -2.683 -17.942 -17.942
  796   3HZ   LYS  98          1HZ       LYS  98  -1.512 -18.674 -18.674
  797    H    LEU  99           H        LEU  99   4.828 -13.835 -13.835
  798    HA   LEU  99           HA       LEU  99   4.599 -12.135 -12.135
  799   1HB   LEU  99          2HB       LEU  99   6.338 -14.548 -14.548
  800   2HB   LEU  99          1HB       LEU  99   6.517 -13.503 -13.503
  801    HG   LEU  99           HG       LEU  99   6.428 -12.171 -12.171
  802   1HD1  LEU  99          2HD1      LEU  99   8.764 -13.813 -13.813
  803   2HD1  LEU  99          1HD1      LEU  99   8.888 -12.612 -12.612
  804   3HD1  LEU  99          3HD1      LEU  99   7.889 -14.047 -14.047
  805   1HD2  LEU  99          2HD2      LEU  99   6.780 -11.243 -11.243
  806   2HD2  LEU  99          1HD2      LEU  99   7.664 -10.545 -10.545
  807   3HD2  LEU  99          3HD2      LEU  99   8.451 -11.719 -11.719
  808    H    LEU 100           H        LEU 100   4.752 -12.947 -12.947
  809    HA   LEU 100           HA       LEU 100   2.714 -15.045 -15.045
  810   1HB   LEU 100          2HB       LEU 100   3.818 -12.792 -12.792
  811   2HB   LEU 100          1HB       LEU 100   2.855 -14.094 -14.094
  812    HG   LEU 100           HG       LEU 100   1.892 -12.519 -12.519
  813   1HD1  LEU 100          1HD1      LEU 100   1.956 -11.772 -11.772
  814   2HD1  LEU 100          3HD1      LEU 100   0.447 -11.475 -11.475
  815   3HD1  LEU 100          2HD1      LEU 100   1.946 -10.739 -10.739
  816   1HD2  LEU 100          3HD2      LEU 100   0.731 -14.435 -14.435
  817   2HD2  LEU 100          2HD2      LEU 100   0.560 -14.425 -14.425
  818   3HD2  LEU 100          1HD2      LEU 100  -0.320 -13.251 -13.251
  819    H    LYS 101           H        LYS 101   6.073 -14.681 -14.681
  820    HA   LYS 101           HA       LYS 101   6.472 -17.225 -17.225
  821   1HB   LYS 101          2HB       LYS 101   6.834 -14.865 -14.865
  822   2HB   LYS 101          1HB       LYS 101   8.464 -15.274 -15.274
  823   1HG   LYS 101          2HG       LYS 101   6.642 -17.333 -17.333
  824   2HG   LYS 101          1HG       LYS 101   7.677 -16.293 -16.293
  825   1HD   LYS 101          2HD       LYS 101   9.606 -17.319 -17.319
  826   2HD   LYS 101          1HD       LYS 101   8.967 -17.656 -17.656
  827   1HE   LYS 101          2HE       LYS 101   7.615 -19.483 -19.483
  828   2HE   LYS 101          1HE       LYS 101   8.083 -19.094 -19.094
  829   1HZ   LYS 101          1HZ       LYS 101  10.394 -19.555 -19.555
  830   2HZ   LYS 101          3HZ       LYS 101   9.895 -20.003 -20.003
  831   3HZ   LYS 101          2HZ       LYS 101   9.399 -20.915 -20.915
  832    H    GLY 102           H        GLY 102   8.160 -18.343 -18.343
  833   1HA   GLY 102          2HA       GLY 102   9.908 -18.793 -18.793
  834   2HA   GLY 102          1HA       GLY 102  10.391 -17.104 -17.104
  835    H    GLU 103           H        GLU 103  10.786 -17.271 -17.271
  836    HA   GLU 103           HA       GLU 103   8.664 -16.049 -16.049
  837   1HB   GLU 103          2HB       GLU 103   7.777 -18.392 -18.392
  838   2HB   GLU 103          1HB       GLU 103   9.209 -18.925 -18.925
  839   1HG   GLU 103          2HG       GLU 103   8.634 -17.611 -17.611
  840   2HG   GLU 103          1HG       GLU 103   7.369 -16.761 -16.761
  841    H    GLY 104           H        GLY 104   9.463 -15.135 -15.135
  842   1HA   GLY 104          2HA       GLY 104  11.937 -16.132 -16.132
  843   2HA   GLY 104          1HA       GLY 104  12.032 -14.519 -14.519
  844    HA   PRO 105           HA       PRO 105  10.143 -13.070 -13.070
  845   1HB   PRO 105          2HB       PRO 105   9.343 -10.584 -10.584
  846   2HB   PRO 105          1HB       PRO 105  11.033 -10.993 -10.993
  847   1HG   PRO 105          2HG       PRO 105   9.714 -10.554 -10.554
  848   2HG   PRO 105          1HG       PRO 105  11.430 -10.442 -10.442
  849   1HD   PRO 105          2HD       PRO 105  10.127 -12.620 -12.620
  850   2HD   PRO 105          1HD       PRO 105  11.809 -12.567 -12.567
  851    H    LYS 106           H        LYS 106   7.943 -11.744 -11.744
  852    HA   LYS 106           HA       LYS 106   5.738 -12.783 -12.783
  853   1HB   LYS 106          2HB       LYS 106   5.973 -14.249 -14.249
  854   2HB   LYS 106          1HB       LYS 106   5.905 -12.843 -12.843
  855   1HG   LYS 106          2HG       LYS 106   3.649 -12.517 -12.517
  856   2HG   LYS 106          1HG       LYS 106   3.681 -13.239 -13.239
  857   1HD   LYS 106          2HD       LYS 106   4.091 -15.473 -15.473
  858   2HD   LYS 106          1HD       LYS 106   3.835 -14.699 -14.699
  859   1HE   LYS 106          2HE       LYS 106   1.837 -14.886 -14.886
  860   2HE   LYS 106          1HE       LYS 106   1.742 -15.707 -15.707
  861   1HZ   LYS 106          1HZ       LYS 106   1.712 -13.486 -13.486
  862   2HZ   LYS 106          3HZ       LYS 106   1.621 -12.782 -12.782
  863   3HZ   LYS 106          2HZ       LYS 106   0.362 -13.780 -13.780
  864    H    THR 107           H        THR 107   4.047 -11.259 -11.259
  865    HA   THR 107           HA       THR 107   4.416  -8.699  -8.699
  866    HB   THR 107           HB       THR 107   3.087  -7.933  -7.933
  867    HG1  THR 107           HG1      THR 107   3.518 -10.125 -10.125
  868   1HG2  THR 107          1HG2      THR 107   6.059  -8.080  -8.080
  869   2HG2  THR 107          3HG2      THR 107   5.339  -7.111  -7.111
  870   3HG2  THR 107          2HG2      THR 107   4.968  -6.753  -6.753
  871    H    SER 108           H        SER 108   2.636  -7.658  -7.658
  872    HA   SER 108           HA       SER 108  -0.088  -8.462  -8.462
  873   1HB   SER 108          2HB       SER 108   0.853  -8.945  -8.945
  874   2HB   SER 108          1HB       SER 108  -0.708  -9.358  -9.358
  875    HG   SER 108           HG       SER 108   0.269 -10.928 -10.928
  876    H    TRP 109           H        TRP 109  -1.351  -6.617  -6.617
  877    HA   TRP 109           HA       TRP 109  -0.342  -4.634  -4.634
  878   1HB   TRP 109          2HB       TRP 109  -0.905  -2.802  -2.802
  879   2HB   TRP 109          1HB       TRP 109   0.493  -3.776  -3.776
  880    HD1  TRP 109           HD1      TRP 109   0.396  -5.117  -5.117
  881    HE1  TRP 109           HE1      TRP 109  -1.359  -5.369  -5.369
  882    HE3  TRP 109           HE3      TRP 109  -3.603  -2.864  -2.864
  883    HZ2  TRP 109           HZ2      TRP 109  -4.097  -4.702  -4.702
  884    HZ3  TRP 109           HZ3      TRP 109  -5.767  -2.690  -2.690
  885    HH2  TRP 109           HH2      TRP 109  -6.024  -3.602  -3.602
  886    H    THR 110           H        THR 110  -2.045  -2.833  -2.833
  887    HA   THR 110           HA       THR 110  -4.803  -3.949  -3.949
  888    HB   THR 110           HB       THR 110  -5.349  -3.455  -3.455
  889    HG1  THR 110           HG1      THR 110  -4.393  -1.823  -1.823
  890   1HG2  THR 110          2HG2      THR 110  -3.405  -5.332  -5.332
  891   2HG2  THR 110          1HG2      THR 110  -2.704  -4.466  -4.466
  892   3HG2  THR 110          3HG2      THR 110  -4.282  -5.235  -5.235
  893    H    MET 111           H        MET 111  -6.427  -2.165  -2.165
  894    HA   MET 111           HA       MET 111  -5.552   0.606   0.606
  895   1HB   MET 111          2HB       MET 111  -7.102   0.942   0.942
  896   2HB   MET 111          1HB       MET 111  -5.658  -0.002  -0.002
  897   1HG   MET 111          2HG       MET 111  -6.960  -2.085  -2.085
  898   2HG   MET 111          1HG       MET 111  -8.403  -1.125  -1.125
  899   1HE   MET 111          1HE       MET 111  -9.758  -0.294  -0.294
  900   2HE   MET 111          3HE       MET 111  -9.424   0.688   0.688
  901   3HE   MET 111          2HE       MET 111 -10.104  -0.926  -0.926
  902    H    GLU 112           H        GLU 112  -6.822   1.771   1.771
  903    HA   GLU 112           HA       GLU 112  -9.537   0.690   0.690
  904   1HB   GLU 112          2HB       GLU 112  -7.820   0.585   0.585
  905   2HB   GLU 112          1HB       GLU 112  -7.739   2.345   2.345
  906   1HG   GLU 112          2HG       GLU 112 -10.385   2.113   2.113
  907   2HG   GLU 112          1HG       GLU 112  -9.943   0.576   0.576
  908    H    LEU 113           H        LEU 113 -11.229   2.207   2.207
  909    HA   LEU 113           HA       LEU 113 -10.630   4.916   4.916
  910   1HB   LEU 113          2HB       LEU 113 -12.410   2.993   2.993
  911   2HB   LEU 113          1HB       LEU 113 -13.440   3.965   3.965
  912    HG   LEU 113           HG       LEU 113 -13.407   4.641   4.641
  913   1HD1  LEU 113          2HD1      LEU 113 -14.030   6.149   6.149
  914   2HD1  LEU 113          1HD1      LEU 113 -12.404   6.809   6.809
  915   3HD1  LEU 113          3HD1      LEU 113 -13.494   6.976   6.976
  916   1HD2  LEU 113          1HD2      LEU 113 -10.623   4.501   4.501
  917   2HD2  LEU 113          3HD2      LEU 113 -11.482   5.088   5.088
  918   3HD2  LEU 113          2HD2      LEU 113 -10.982   6.219   6.219
  919    H    THR 114           H        THR 114 -11.427   6.719   6.719
  920    HA   THR 114           HA       THR 114 -12.165   6.004   6.004
  921    HB   THR 114           HB       THR 114 -11.596   8.237   8.237
  922    HG1  THR 114           HG1      THR 114 -12.100   9.752   9.752
  923   1HG2  THR 114          1HG2      THR 114  -9.725   6.643   6.643
  924   2HG2  THR 114          3HG2      THR 114  -9.649   7.674   7.674
  925   3HG2  THR 114          2HG2      THR 114  -9.327   8.353   8.353
  926    H    ASN 115           H        ASN 115 -13.957   7.154   7.154
  927    HA   ASN 115           HA       ASN 115 -16.404   6.945   6.945
  928   1HB   ASN 115          2HB       ASN 115 -15.875   7.076   7.076
  929   2HB   ASN 115          1HB       ASN 115 -16.162   8.800   8.800
  930   1HD2  ASN 115          2HD2      ASN 115 -19.367   6.687   6.687
  931   2HD2  ASN 115          1HD2      ASN 115 -17.829   6.478   6.478
  932    H    ASP 116           H        ASP 116 -14.113   9.562   9.562
  933    HA   ASP 116           HA       ASP 116 -16.046  11.579  11.579
  934   1HB   ASP 116          2HB       ASP 116 -13.021  11.702  11.702
  935   2HB   ASP 116          1HB       ASP 116 -14.091  13.074  13.074
  936    H    GLY 117           H        GLY 117 -13.629   9.426   9.426
  937   1HA   GLY 117          2HA       GLY 117 -14.238   8.832   8.832
  938   2HA   GLY 117          1HA       GLY 117 -14.191  10.568  10.568
  939    H    GLU 118           H        GLU 118 -11.806  10.315  10.315
  940    HA   GLU 118           HA       GLU 118  -9.666  10.668  10.668
  941   1HB   GLU 118          2HB       GLU 118  -9.652   9.690   9.690
  942   2HB   GLU 118          1HB       GLU 118  -8.200  10.142  10.142
  943   1HG   GLU 118          2HG       GLU 118  -9.275  12.395  12.395
  944   2HG   GLU 118          1HG       GLU 118 -10.545  11.922  11.922
  945    H    LEU 119           H        LEU 119  -7.677   9.086   9.086
  946    HA   LEU 119           HA       LEU 119  -8.532   6.245   6.245
  947   1HB   LEU 119          2HB       LEU 119  -9.026   7.224   7.224
  948   2HB   LEU 119          1HB       LEU 119  -7.317   7.605   7.605
  949    HG   LEU 119           HG       LEU 119  -8.285   4.795   4.795
  950   1HD1  LEU 119          1HD1      LEU 119  -8.190   6.364   6.364
  951   2HD1  LEU 119          3HD1      LEU 119  -7.855   4.633   4.633
  952   3HD1  LEU 119          2HD1      LEU 119  -9.411   5.221   5.221
  953   1HD2  LEU 119          1HD2      LEU 119  -5.737   6.130   6.130
  954   2HD2  LEU 119          3HD2      LEU 119  -5.972   4.768   4.768
  955   3HD2  LEU 119          2HD2      LEU 119  -6.080   4.526   4.526
  956    H    ILE 120           H        ILE 120  -7.007   5.349   5.349
  957    HA   ILE 120           HA       ILE 120  -4.171   6.253   6.253
  958    HB   ILE 120           HB       ILE 120  -4.941   6.504   6.504
  959   1HG1  ILE 120          2HG1      ILE 120  -3.210   4.020   4.020
  960   2HG1  ILE 120          1HG1      ILE 120  -2.603   5.642   5.642
  961   1HG2  ILE 120          2HG2      ILE 120  -5.986   3.759   3.759
  962   2HG2  ILE 120          1HG2      ILE 120  -5.397   4.103   4.103
  963   3HG2  ILE 120          3HG2      ILE 120  -6.694   5.077   5.077
  964   1HD1  ILE 120          3HD1      ILE 120  -3.707   6.224   6.224
  965   2HD1  ILE 120          2HD1      ILE 120  -3.572   4.487   4.487
  966   3HD1  ILE 120          1HD1      ILE 120  -2.126   5.444   5.444
  967    H    LEU 121           H        LEU 121  -2.551   4.570   4.570
  968    HA   LEU 121           HA       LEU 121  -3.698   1.907   1.907
  969   1HB   LEU 121          2HB       LEU 121  -3.298   3.243   3.243
  970   2HB   LEU 121          1HB       LEU 121  -1.617   3.464   3.464
  971    HG   LEU 121           HG       LEU 121  -2.338   0.637   0.637
  972   1HD1  LEU 121          3HD1      LEU 121  -3.118   2.261   2.261
  973   2HD1  LEU 121          2HD1      LEU 121  -2.311   0.722   0.722
  974   3HD1  LEU 121          1HD1      LEU 121  -3.816   0.763   0.763
  975   1HD2  LEU 121          1HD2      LEU 121  -0.049   1.809   1.809
  976   2HD2  LEU 121          3HD2      LEU 121  -0.298   0.411   0.411
  977   3HD2  LEU 121          2HD2      LEU 121  -0.412   2.040   2.040
  978    H    THR 122           H        THR 122  -2.326   0.171   0.171
  979    HA   THR 122           HA       THR 122   0.272   0.813   0.813
  980    HB   THR 122           HB       THR 122  -0.742  -1.629  -1.629
  981    HG1  THR 122           HG1      THR 122  -2.644  -0.895  -0.895
  982   1HG2  THR 122          2HG2      THR 122  -0.020   1.109   1.109
  983   2HG2  THR 122          1HG2      THR 122  -0.833   0.011   0.011
  984   3HG2  THR 122          3HG2      THR 122   0.710  -0.448  -0.448
  985    H    MET 123           H        MET 123   1.647  -1.297  -1.297
  986    HA   MET 123           HA       MET 123   0.980  -3.075  -3.075
  987   1HB   MET 123          2HB       MET 123   3.510  -1.402  -1.402
  988   2HB   MET 123          1HB       MET 123   3.068  -2.591  -2.591
  989   1HG   MET 123          2HG       MET 123   0.965  -1.212  -1.212
  990   2HG   MET 123          1HG       MET 123   1.700   0.041   0.041
  991   1HE   MET 123          2HE       MET 123   1.162  -1.627  -1.627
  992   2HE   MET 123          1HE       MET 123   1.012   0.042   0.042
  993   3HE   MET 123          3HE       MET 123   2.255  -1.010  -1.010
  994    H    THR 124           H        THR 124   2.694  -4.773  -4.773
  995    HA   THR 124           HA       THR 124   4.375  -5.221  -5.221
  996    HB   THR 124           HB       THR 124   2.504  -7.406  -7.406
  997    HG1  THR 124           HG1      THR 124   0.997  -6.203  -6.203
  998   1HG2  THR 124          1HG2      THR 124   4.590  -7.884  -7.884
  999   2HG2  THR 124          3HG2      THR 124   3.948  -6.864  -6.864
 1000   3HG2  THR 124          2HG2      THR 124   3.105  -8.345  -8.345
 1001    H    ALA 125           H        ALA 125   6.009  -6.761  -6.761
 1002    HA   ALA 125           HA       ALA 125   6.143  -8.152  -8.152
 1003   1HB   ALA 125          2HB       ALA 125   6.985  -5.619  -5.619
 1004   2HB   ALA 125          1HB       ALA 125   8.461  -6.338  -6.338
 1005   3HB   ALA 125          3HB       ALA 125   7.788  -6.917  -6.917
 1006    H    ASP 126           H        ASP 126   6.438 -10.038 -10.038
 1007    HA   ASP 126           HA       ASP 126   7.758 -11.727 -11.727
 1008   1HB   ASP 126          2HB       ASP 126   9.704  -9.878  -9.878
 1009   2HB   ASP 126          1HB       ASP 126  10.136 -10.260 -10.260
 1010    H    ASP 127           H        ASP 127   9.113  -8.948  -8.948
 1011    HA   ASP 127           HA       ASP 127   7.326  -9.506  -9.506
 1012   1HB   ASP 127          2HB       ASP 127  10.279 -10.010 -10.010
 1013   2HB   ASP 127          1HB       ASP 127   9.553  -9.350  -9.350
 1014    H    VAL 128           H        VAL 128   7.950  -7.338  -7.338
 1015    HA   VAL 128           HA       VAL 128   8.548  -5.157  -5.157
 1016    HB   VAL 128           HB       VAL 128   9.342  -3.831  -3.831
 1017   1HG1  VAL 128          1HG1      VAL 128  10.764  -5.695  -5.695
 1018   2HG1  VAL 128          3HG1      VAL 128  10.701  -6.480  -6.480
 1019   3HG1  VAL 128          2HG1      VAL 128  11.411  -4.873  -4.873
 1020   1HG2  VAL 128          3HG2      VAL 128   7.852  -5.746  -5.746
 1021   2HG2  VAL 128          2HG2      VAL 128   8.697  -4.320  -4.320
 1022   3HG2  VAL 128          1HG2      VAL 128   9.534  -5.869  -5.869
 1023    H    VAL 129           H        VAL 129   7.490  -3.033  -3.033
 1024    HA   VAL 129           HA       VAL 129   4.948  -3.583  -3.583
 1025    HB   VAL 129           HB       VAL 129   5.158  -3.058  -3.058
 1026   1HG1  VAL 129          1HG1      VAL 129   3.153  -1.747  -1.747
 1027   2HG1  VAL 129          3HG1      VAL 129   2.595  -2.373  -2.373
 1028   3HG1  VAL 129          2HG1      VAL 129   3.864  -1.149  -1.149
 1029   1HG2  VAL 129          1HG2      VAL 129   3.631  -4.797  -4.797
 1030   2HG2  VAL 129          3HG2      VAL 129   4.443  -5.210  -5.210
 1031   3HG2  VAL 129          2HG2      VAL 129   2.877  -4.399  -4.399
 1032    H    CYS 130           H        CYS 130   4.782  -1.989  -1.989
 1033    HA   CYS 130           HA       CYS 130   6.040   0.645   0.645
 1034   1HB   CYS 130          2HB       CYS 130   6.235  -0.827  -0.827
 1035   2HB   CYS 130          1HB       CYS 130   4.762   0.052   0.052
 1036    HG   CYS 130           HG       CYS 130   6.108   2.079   2.079
 1037    H    THR 131           H        THR 131   4.718   2.271   2.271
 1038    HA   THR 131           HA       THR 131   1.809   2.084   2.084
 1039    HB   THR 131           HB       THR 131   3.103   3.214   3.214
 1040    HG1  THR 131           HG1      THR 131   2.386   1.404   1.404
 1041   1HG2  THR 131          2HG2      THR 131   0.248   3.093   3.093
 1042   2HG2  THR 131          1HG2      THR 131   0.642   3.220   3.220
 1043   3HG2  THR 131          3HG2      THR 131   1.143   4.490   4.490
 1044    H    ARG 132           H        ARG 132   0.923   3.858   3.858
 1045    HA   ARG 132           HA       ARG 132   2.324   6.470   6.470
 1046   1HB   ARG 132          2HB       ARG 132   1.295   5.216   5.216
 1047   2HB   ARG 132          1HB       ARG 132   2.101   6.777   6.777
 1048   1HG   ARG 132          2HG       ARG 132   3.982   5.260   5.260
 1049   2HG   ARG 132          1HG       ARG 132   3.254   4.027   4.027
 1050   1HD   ARG 132          2HD       ARG 132   3.778   6.656   6.656
 1051   2HD   ARG 132          1HD       ARG 132   5.198   5.696   5.696
 1052    HE   ARG 132           HE       ARG 132   3.065   4.873   4.873
 1053   1HH1  ARG 132          2HH1      ARG 132   6.330   5.187   5.187
 1054   2HH1  ARG 132          1HH1      ARG 132   6.741   3.581   3.581
 1055   1HH2  ARG 132          1HH2      ARG 132   3.470   2.432   2.432
 1056   2HH2  ARG 132          2HH2      ARG 132   5.122   2.021   2.021
 1057    H    VAL 133           H        VAL 133   0.745   7.664   7.664
 1058    HA   VAL 133           HA       VAL 133  -2.088   7.095   7.095
 1059    HB   VAL 133           HB       VAL 133  -0.744   9.584   9.584
 1060   1HG1  VAL 133          2HG1      VAL 133  -3.514   8.412   8.412
 1061   2HG1  VAL 133          1HG1      VAL 133  -2.880   9.758   9.758
 1062   3HG1  VAL 133          3HG1      VAL 133  -3.109   9.935   9.935
 1063   1HG2  VAL 133          3HG2      VAL 133  -1.491   6.959   6.959
 1064   2HG2  VAL 133          2HG2      VAL 133   0.100   7.720   7.720
 1065   3HG2  VAL 133          1HG2      VAL 133  -1.185   8.427   8.427
 1066    H    TYR 134           H        TYR 134  -3.577   8.114   8.114
 1067    HA   TYR 134           HA       TYR 134  -2.475  10.195  10.195
 1068   1HB   TYR 134          2HB       TYR 134  -4.015   7.699   7.699
 1069   2HB   TYR 134          1HB       TYR 134  -4.184   9.115   9.115
 1070    HD1  TYR 134           HD2      TYR 134  -2.254  10.040  10.040
 1071    HD2  TYR 134           HD1      TYR 134  -1.932   6.466   6.466
 1072    HE1  TYR 134           HE2      TYR 134  -0.100   9.512   9.512
 1073    HE2  TYR 134           HE1      TYR 134   0.224   5.929   5.929
 1074    HH   TYR 134           HH       TYR 134   1.216   6.853   6.853
 1075    H    VAL 135           H        VAL 135  -3.680  11.994  11.994
 1076    HA   VAL 135           HA       VAL 135  -6.479  11.822  11.822
 1077    HB   VAL 135           HB       VAL 135  -4.357  13.541  13.541
 1078   1HG1  VAL 135          1HG1      VAL 135  -4.971  14.928  14.928
 1079   2HG1  VAL 135          3HG1      VAL 135  -6.552  15.181  15.181
 1080   3HG1  VAL 135          2HG1      VAL 135  -5.098  15.779  15.779
 1081   1HG2  VAL 135          2HG2      VAL 135  -7.319  13.429  13.429
 1082   2HG2  VAL 135          1HG2      VAL 135  -5.992  12.919  12.919
 1083   3HG2  VAL 135          3HG2      VAL 135  -6.301  14.636  14.636
 1084    H    ARG 136           H        ARG 136  -8.143  12.499  12.499
 1085    HA   ARG 136           HA       ARG 136  -7.801  12.382  12.382
 1086   1HB   ARG 136          2HB       ARG 136  -9.923  13.127  13.127
 1087   2HB   ARG 136          1HB       ARG 136  -9.922  14.203  14.203
 1088   1HG   ARG 136          2HG       ARG 136 -10.299  12.496  12.496
 1089   2HG   ARG 136          1HG       ARG 136  -9.585  11.271  11.271
 1090   1HD   ARG 136          2HD       ARG 136 -12.308  12.570  12.570
 1091   2HD   ARG 136          1HD       ARG 136 -11.947  10.862  10.862
 1092    HE   ARG 136           HE       ARG 136 -10.718  11.393  11.393
 1093   1HH1  ARG 136          1HH2      ARG 136 -13.752  10.553  10.553
 1094   2HH1  ARG 136          2HH2      ARG 136 -14.603  11.137  11.137
 1095   1HH2  ARG 136          2HH1      ARG 136 -11.848  12.788  12.788
 1096   2HH2  ARG 136          1HH1      ARG 136 -13.523  12.407  12.407
 1097    H    GLU 137           HN       GLU 137  -6.996  13.623  13.623
 1098    HA   GLU 137           HA       GLU 137  -5.483  15.925  15.925
 1099   1HB   GLU 137          2HB       GLU 137  -5.893  14.398  14.398
 1100   2HB   GLU 137          1HB       GLU 137  -7.124  15.588  15.588
 1101   1HG   GLU 137          2HG       GLU 137  -4.265  16.318  16.318
 1102   2HG   GLU 137          1HG       GLU 137  -4.836  16.012  16.012

  Start of MODEL    4
    1   1H    PRO   1          1H        PRO   1 -14.425   7.028   7.028
    2   2H    PRO   1          2H        PRO   1 -14.960   6.271   6.271
    3    HA   PRO   1           HA       PRO   1 -16.811   5.590   5.590
    4   1HB   PRO   1          2HB       PRO   1 -17.825   7.974   7.974
    5   2HB   PRO   1          1HB       PRO   1 -18.370   7.201   7.201
    6   1HG   PRO   1          2HG       PRO   1 -16.880   9.632   9.632
    7   2HG   PRO   1          1HG       PRO   1 -17.438   8.861   8.861
    8   1HD   PRO   1          1HD       PRO   1 -14.761   9.017   9.017
    9   2HD   PRO   1          2HD       PRO   1 -15.328   8.230   8.230
   10    H    ASN   2           H        ASN   2 -15.077   7.916   7.916
   11    HA   ASN   2           HA       ASN   2 -15.426   5.990   5.990
   12   1HB   ASN   2          2HB       ASN   2 -15.583   9.013   9.013
   13   2HB   ASN   2          1HB       ASN   2 -15.757   7.864   7.864
   14   1HD2  ASN   2          2HD2      ASN   2 -19.149   7.195   7.195
   15   2HD2  ASN   2          1HD2      ASN   2 -17.820   6.923   6.923
   16    H    PHE   3           H        PHE   3 -13.541   5.466   5.466
   17    HA   PHE   3           HA       PHE   3 -11.090   6.983   6.983
   18   1HB   PHE   3          2HB       PHE   3 -11.516   4.282   4.282
   19   2HB   PHE   3          1HB       PHE   3  -9.948   4.990   4.990
   20    HD1  PHE   3           HD1      PHE   3 -13.140   4.443   4.443
   21    HD2  PHE   3           HD2      PHE   3  -8.860   4.074   4.074
   22    HE1  PHE   3           HE1      PHE   3 -13.157   3.433   3.433
   23    HE2  PHE   3           HE2      PHE   3  -8.887   3.048   3.048
   24    HZ   PHE   3           HZ       PHE   3 -11.038   2.722   2.722
   25    H    SER   4           H        SER   4 -13.374   6.929   6.929
   26    HA   SER   4           HA       SER   4 -11.693   6.911   6.911
   27   1HB   SER   4          2HB       SER   4 -13.652   7.522   7.522
   28   2HB   SER   4          1HB       SER   4 -14.192   6.467   6.467
   29    HG   SER   4           HG       SER   4 -15.371   8.518   8.518
   30    H    GLY   5           H        GLY   5 -10.296   8.425   8.425
   31   1HA   GLY   5          2HA       GLY   5 -10.742  11.062  11.062
   32   2HA   GLY   5          1HA       GLY   5 -10.327  11.120  11.120
   33    H    ASN   6           H        ASN   6  -8.443  12.388  12.388
   34    HA   ASN   6           HA       ASN   6  -6.348  10.508  10.508
   35   1HB   ASN   6          2HB       ASN   6  -6.767  13.486  13.486
   36   2HB   ASN   6          1HB       ASN   6  -5.118  12.861  12.861
   37   1HD2  ASN   6          2HD2      ASN   6  -5.989  10.976  10.976
   38   2HD2  ASN   6          1HD2      ASN   6  -5.352  10.593  10.593
   39    H    TRP   7           H        TRP   7  -4.112  11.036  11.036
   40    HA   TRP   7           HA       TRP   7  -4.474  11.849  11.849
   41   1HB   TRP   7          2HB       TRP   7  -3.645   9.070   9.070
   42   2HB   TRP   7          1HB       TRP   7  -3.516   9.677   9.677
   43    HD1  TRP   7           HD1      TRP   7  -5.972   8.256   8.256
   44    HE1  TRP   7           HE1      TRP   7  -8.341   8.228   8.228
   45    HE3  TRP   7           HE3      TRP   7  -5.087  11.068  11.068
   46    HZ2  TRP   7           HZ2      TRP   7  -9.669   9.305   9.305
   47    HZ3  TRP   7           HZ3      TRP   7  -6.909  11.591  11.591
   48    HH2  TRP   7           HH2      TRP   7  -9.181  10.707  10.707
   49    H    LYS   8           H        LYS   8  -2.763  12.926  12.926
   50    HA   LYS   8           HA       LYS   8  -0.108  12.401  12.401
   51   1HB   LYS   8          2HB       LYS   8  -1.487  14.976  14.976
   52   2HB   LYS   8          1HB       LYS   8   0.268  14.893  14.893
   53   1HG   LYS   8          2HG       LYS   8   0.085  13.776  13.776
   54   2HG   LYS   8          1HG       LYS   8  -1.432  14.676  14.676
   55   1HD   LYS   8          2HD       LYS   8   0.073  16.246  16.246
   56   2HD   LYS   8          1HD       LYS   8   0.045  16.672  16.672
   57   1HE   LYS   8          2HE       LYS   8   2.016  14.982  14.982
   58   2HE   LYS   8          1HE       LYS   8   2.160  15.176  15.176
   59   1HZ   LYS   8          3HZ       LYS   8   2.320  17.578  17.578
   60   2HZ   LYS   8          2HZ       LYS   8   2.247  17.352  17.352
   61   3HZ   LYS   8          1HZ       LYS   8   3.567  16.751  16.751
   62    H    ILE   9           H        ILE   9   1.153  11.455  11.455
   63    HA   ILE   9           HA       ILE   9   0.578  11.210  11.210
   64    HB   ILE   9           HB       ILE   9   2.040   9.676   9.676
   65   1HG1  ILE   9          2HG1      ILE   9   3.528  11.179  11.179
   66   2HG1  ILE   9          1HG1      ILE   9   2.352   9.892   9.892
   67   1HG2  ILE   9          3HG2      ILE   9   3.828  12.108  12.108
   68   2HG2  ILE   9          2HG2      ILE   9   4.392  10.464  10.464
   69   3HG2  ILE   9          1HG2      ILE   9   3.122  11.154  11.154
   70   1HD1  ILE   9          2HD1      ILE   9   3.929   8.516   8.516
   71   2HD1  ILE   9          1HD1      ILE   9   5.133   9.715   9.715
   72   3HD1  ILE   9          3HD1      ILE   9   4.363   8.708   8.708
   73    H    ILE  10           H        ILE  10   1.243  12.341  12.341
   74    HA   ILE  10           HA       ILE  10   2.718  14.892  14.892
   75    HB   ILE  10           HB       ILE  10   1.423  15.876  15.876
   76   1HG1  ILE  10          2HG1      ILE  10  -0.744  14.188  14.188
   77   2HG1  ILE  10          1HG1      ILE  10   0.614  13.064  13.064
   78   1HG2  ILE  10          1HG2      ILE  10   0.610  15.915  15.915
   79   2HG2  ILE  10          3HG2      ILE  10  -0.426  14.543  14.543
   80   3HG2  ILE  10          2HG2      ILE  10  -0.665  16.092  16.092
   81   1HD1  ILE  10          3HD1      ILE  10   1.770  14.697  14.697
   82   2HD1  ILE  10          2HD1      ILE  10   0.169  15.402  15.402
   83   3HD1  ILE  10          1HD1      ILE  10   0.455  13.712  13.712
   84    H    ARG  11           H        ARG  11   2.475  11.992  11.992
   85    HA   ARG  11           HA       ARG  11   5.015  12.745  12.745
   86   1HB   ARG  11          2HB       ARG  11   2.392  12.393  12.393
   87   2HB   ARG  11          1HB       ARG  11   3.750  11.565  11.565
   88   1HG   ARG  11          2HG       ARG  11   5.027  13.735  13.735
   89   2HG   ARG  11          1HG       ARG  11   3.547  14.519  14.519
   90   1HD   ARG  11          2HD       ARG  11   2.422  14.092  14.092
   91   2HD   ARG  11          1HD       ARG  11   3.594  12.868  12.868
   92    HE   ARG  11           HE       ARG  11   5.240  14.862  14.862
   93   1HH1  ARG  11          1HH2      ARG  11   2.787  16.643  16.643
   94   2HH1  ARG  11          2HH2      ARG  11   2.440  17.363  17.363
   95   1HH2  ARG  11          1HH1      ARG  11   3.346  16.502  16.502
   96   2HH2  ARG  11          2HH1      ARG  11   4.388  15.122  15.122
   97    H    SER  12           H        SER  12   5.727  10.736  10.736
   98    HA   SER  12           HA       SER  12   4.882   8.098   8.098
   99   1HB   SER  12          2HB       SER  12   5.458   8.350   8.350
  100   2HB   SER  12          1HB       SER  12   6.941   9.215   9.215
  101    HG   SER  12           HG       SER  12   7.592   7.174   7.174
  102    H    GLU  13           H        GLU  13   6.675   6.503   6.503
  103    HA   GLU  13           HA       GLU  13   8.993   7.700   7.700
  104   1HB   GLU  13          2HB       GLU  13   8.300   6.849   6.849
  105   2HB   GLU  13          1HB       GLU  13   7.293   8.168   8.168
  106   1HG   GLU  13          2HG       GLU  13   6.313   5.544   5.544
  107   2HG   GLU  13          1HG       GLU  13   6.377   5.695   5.695
  108    H    ASN  14           H        ASN  14   8.304   5.491   5.491
  109    HA   ASN  14           HA       ASN  14  10.158   3.503   3.503
  110   1HB   ASN  14          2HB       ASN  14   7.241   2.930   2.930
  111   2HB   ASN  14          1HB       ASN  14   8.431   1.644   1.644
  112   1HD2  ASN  14          2HD2      ASN  14   7.141   2.468   2.468
  113   2HD2  ASN  14          1HD2      ASN  14   6.283   2.633   2.633
  114    H    PHE  15           H        PHE  15   9.861   5.295   5.295
  115    HA   PHE  15           HA       PHE  15   9.176   3.710   3.710
  116   1HB   PHE  15          2HB       PHE  15   9.537   6.263   6.263
  117   2HB   PHE  15          1HB       PHE  15  11.253   5.906   5.906
  118    HD1  PHE  15           HD2      PHE  15  10.254   3.306   3.306
  119    HD2  PHE  15           HD1      PHE  15  10.028   7.592   7.592
  120    HE1  PHE  15           HE2      PHE  15  10.115   3.209   3.209
  121    HE2  PHE  15           HE1      PHE  15   9.881   7.481   7.481
  122    HZ   PHE  15           HZ       PHE  15   9.922   5.278   5.278
  123    H    GLU  16           H        GLU  16  12.466   4.700   4.700
  124    HA   GLU  16           HA       GLU  16  13.860   2.807   2.807
  125   1HB   GLU  16          2HB       GLU  16  14.492   4.419   4.419
  126   2HB   GLU  16          1HB       GLU  16  15.559   3.064   3.064
  127   1HG   GLU  16          2HG       GLU  16  16.303   4.001   4.001
  128   2HG   GLU  16          1HG       GLU  16  14.801   4.885   4.885
  129    H    GLU  17           H        GLU  17  12.188   2.447   2.447
  130    HA   GLU  17           HA       GLU  17  13.395   0.027   0.027
  131   1HB   GLU  17          2HB       GLU  17  10.619   1.150   1.150
  132   2HB   GLU  17          1HB       GLU  17  11.281  -0.226  -0.226
  133   1HG   GLU  17          2HG       GLU  17  13.307   1.527   1.527
  134   2HG   GLU  17          1HG       GLU  17  11.958   2.656   2.656
  135    H    LEU  18           H        LEU  18  10.628   0.667   0.667
  136    HA   LEU  18           HA       LEU  18  10.036  -2.146  -2.146
  137   1HB   LEU  18          2HB       LEU  18   8.547   0.084   0.084
  138   2HB   LEU  18          1HB       LEU  18   9.097  -0.185  -0.185
  139    HG   LEU  18           HG       LEU  18   8.334  -2.558  -2.558
  140   1HD1  LEU  18          3HD1      LEU  18   7.752  -1.627  -1.627
  141   2HD1  LEU  18          2HD1      LEU  18   6.517  -2.643  -2.643
  142   3HD1  LEU  18          1HD1      LEU  18   8.169  -3.238  -3.238
  143   1HD2  LEU  18          1HD2      LEU  18   6.837  -0.279  -0.279
  144   2HD2  LEU  18          3HD2      LEU  18   6.315  -1.932  -1.932
  145   3HD2  LEU  18          2HD2      LEU  18   5.848  -1.141  -1.141
  146    H    LEU  19           H        LEU  19  12.299   0.056   0.056
  147    HA   LEU  19           HA       LEU  19  12.487  -1.524  -1.524
  148   1HB   LEU  19          2HB       LEU  19  14.326   0.712   0.712
  149   2HB   LEU  19          1HB       LEU  19  14.135   0.091   0.091
  150    HG   LEU  19           HG       LEU  19  12.277   1.879   1.879
  151   1HD1  LEU  19          2HD1      LEU  19  13.429   1.861   1.861
  152   2HD1  LEU  19          1HD1      LEU  19  12.317   3.086   3.086
  153   3HD1  LEU  19          3HD1      LEU  19  13.912   2.893   2.893
  154   1HD2  LEU  19          3HD2      LEU  19  11.489  -0.224  -0.224
  155   2HD2  LEU  19          2HD2      LEU  19  10.518   0.588   0.588
  156   3HD2  LEU  19          1HD2      LEU  19  10.836   1.383   1.383
  157    H    LYS  20           H        LYS  20  13.887  -1.424  -1.424
  158    HA   LYS  20           HA       LYS  20  16.334  -2.860  -2.860
  159   1HB   LYS  20          2HB       LYS  20  15.283  -2.489  -2.489
  160   2HB   LYS  20          1HB       LYS  20  16.943  -2.798  -2.798
  161   1HG   LYS  20          2HG       LYS  20  15.984  -0.416  -0.416
  162   2HG   LYS  20          1HG       LYS  20  15.693  -0.280  -0.280
  163   1HD   LYS  20          2HD       LYS  20  18.350  -0.977  -0.977
  164   2HD   LYS  20          1HD       LYS  20  17.916   0.598   0.598
  165   1HE   LYS  20          2HE       LYS  20  17.323  -0.967  -0.967
  166   2HE   LYS  20          1HE       LYS  20  18.626  -1.917  -1.917
  167   1HZ   LYS  20          3HZ       LYS  20  19.873   0.276   0.276
  168   2HZ   LYS  20          2HZ       LYS  20  18.700   0.878   0.878
  169   3HZ   LYS  20          1HZ       LYS  20  19.687  -0.426  -0.426
  170    H    VAL  21           H        VAL  21  13.134  -3.494  -3.494
  171    HA   VAL  21           HA       VAL  21  13.648  -6.274  -6.274
  172    HB   VAL  21           HB       VAL  21  11.868  -4.880  -4.880
  173   1HG1  VAL  21          1HG1      VAL  21  11.203  -3.662  -3.662
  174   2HG1  VAL  21          3HG1      VAL  21  10.408  -5.125  -5.125
  175   3HG1  VAL  21          2HG1      VAL  21   9.842  -4.317  -4.317
  176   1HG2  VAL  21          1HG2      VAL  21  11.818  -7.517  -7.517
  177   2HG2  VAL  21          3HG2      VAL  21  10.530  -6.719  -6.719
  178   3HG2  VAL  21          2HG2      VAL  21  10.346  -7.010  -7.010
  179    H    LEU  22           H        LEU  22  12.200  -4.464  -4.464
  180    HA   LEU  22           HA       LEU  22  11.320  -6.664  -6.664
  181   1HB   LEU  22          2HB       LEU  22  11.766  -3.749  -3.749
  182   2HB   LEU  22          1HB       LEU  22  11.914  -4.636  -4.636
  183    HG   LEU  22           HG       LEU  22   9.672  -5.508  -5.508
  184   1HD1  LEU  22          2HD1      LEU  22   9.762  -5.792  -5.792
  185   2HD1  LEU  22          1HD1      LEU  22   9.474  -4.062  -4.062
  186   3HD1  LEU  22          3HD1      LEU  22   8.257  -5.095  -5.095
  187   1HD2  LEU  22          2HD2      LEU  22  10.112  -3.077  -3.077
  188   2HD2  LEU  22          1HD2      LEU  22   8.459  -3.475  -3.475
  189   3HD2  LEU  22          3HD2      LEU  22   9.512  -2.618  -2.618
  190    H    GLY  23           H        GLY  23  14.160  -4.576  -4.576
  191   1HA   GLY  23          2HA       GLY  23  15.503  -6.558  -6.558
  192   2HA   GLY  23          1HA       GLY  23  15.970  -4.870  -4.870
  193    H    VAL  24           H        VAL  24  18.093  -5.270  -5.270
  194    HA   VAL  24           HA       VAL  24  18.627  -5.992  -5.992
  195    HB   VAL  24           HB       VAL  24  20.397  -7.658  -7.658
  196   1HG1  VAL  24          2HG1      VAL  24  18.020  -8.243  -8.243
  197   2HG1  VAL  24          1HG1      VAL  24  17.655  -8.494  -8.494
  198   3HG1  VAL  24          3HG1      VAL  24  18.874  -9.489  -9.489
  199   1HG2  VAL  24          1HG2      VAL  24  19.043  -7.300  -7.300
  200   2HG2  VAL  24          3HG2      VAL  24  20.750  -7.071  -7.071
  201   3HG2  VAL  24          2HG2      VAL  24  20.053  -8.692  -8.692
  202    H    ASN  25           H        ASN  25  19.984  -5.198  -5.198
  203    HA   ASN  25           HA       ASN  25  22.494  -4.171  -4.171
  204   1HB   ASN  25          2HB       ASN  25  21.326  -4.514  -4.514
  205   2HB   ASN  25          1HB       ASN  25  20.969  -2.805  -2.805
  206   1HD2  ASN  25          2HD2      ASN  25  24.228  -1.800  -1.800
  207   2HD2  ASN  25          1HD2      ASN  25  22.613  -1.362  -1.362
  208    H    VAL  26           H        VAL  26  22.820  -1.573  -1.573
  209    HA   VAL  26           HA       VAL  26  20.989  -0.214  -0.214
  210    HB   VAL  26           HB       VAL  26  22.953   1.480   1.480
  211   1HG1  VAL  26          2HG1      VAL  26  22.211  -0.659  -0.659
  212   2HG1  VAL  26          1HG1      VAL  26  23.906  -1.027  -1.027
  213   3HG1  VAL  26          3HG1      VAL  26  23.463   0.503   0.503
  214   1HG2  VAL  26          1HG2      VAL  26  24.243   0.580   0.580
  215   2HG2  VAL  26          3HG2      VAL  26  25.176   0.487   0.487
  216   3HG2  VAL  26          2HG2      VAL  26  24.413  -0.961  -0.961
  217    H    MET  27           H        MET  27  22.775   0.271   0.271
  218    HA   MET  27           HA       MET  27  21.621   2.841   2.841
  219   1HB   MET  27          2HB       MET  27  23.675   1.915   1.915
  220   2HB   MET  27          1HB       MET  27  22.647   0.762   0.762
  221   1HG   MET  27          2HG       MET  27  21.657   2.404   2.404
  222   2HG   MET  27          1HG       MET  27  21.971   3.680   3.680
  223   1HE   MET  27          3HE       MET  27  23.764   4.985   4.985
  224   2HE   MET  27          2HE       MET  27  24.998   3.801   3.801
  225   3HE   MET  27          1HE       MET  27  25.322   4.992   4.992
  226    H    LEU  28           H        LEU  28  20.545  -0.452  -0.452
  227    HA   LEU  28           HA       LEU  28  18.547  -0.169  -0.169
  228   1HB   LEU  28          2HB       LEU  28  19.188  -2.018  -2.018
  229   2HB   LEU  28          1HB       LEU  28  17.491  -2.005  -2.005
  230    HG   LEU  28           HG       LEU  28  18.743  -3.697  -3.697
  231   1HD1  LEU  28          1HD1      LEU  28  16.880  -2.126  -2.126
  232   2HD1  LEU  28          3HD1      LEU  28  18.213  -1.506  -1.506
  233   3HD1  LEU  28          2HD1      LEU  28  17.781  -3.214  -3.214
  234   1HD2  LEU  28          1HD2      LEU  28  20.852  -2.042  -2.042
  235   2HD2  LEU  28          3HD2      LEU  28  20.694  -3.265  -3.265
  236   3HD2  LEU  28          2HD2      LEU  28  20.251  -1.591  -1.591
  237    H    ARG  29           H        ARG  29  18.370   0.403   0.403
  238    HA   ARG  29           HA       ARG  29  15.547   1.018   1.018
  239   1HB   ARG  29          2HB       ARG  29  17.644   1.911   1.911
  240   2HB   ARG  29          1HB       ARG  29  15.909   1.786   1.786
  241   1HG   ARG  29          2HG       ARG  29  16.149  -0.365  -0.365
  242   2HG   ARG  29          1HG       ARG  29  16.821  -0.751  -0.751
  243   1HD   ARG  29          2HD       ARG  29  18.348  -1.310  -1.310
  244   2HD   ARG  29          1HD       ARG  29  19.056  -0.210  -0.210
  245    HE   ARG  29           HE       ARG  29  17.746   1.001   1.001
  246   1HH1  ARG  29          1HH2      ARG  29  19.527   2.607   2.607
  247   2HH1  ARG  29          2HH2      ARG  29  21.029   2.577   2.577
  248   1HH2  ARG  29          2HH1      ARG  29  20.145  -0.123  -0.123
  249   2HH2  ARG  29          1HH1      ARG  29  21.379   1.031   1.031
  250    H    LYS  30           H        LYS  30  18.501   2.994   2.994
  251    HA   LYS  30           HA       LYS  30  17.225   5.528   5.528
  252   1HB   LYS  30          2HB       LYS  30  19.749   4.907   4.907
  253   2HB   LYS  30          1HB       LYS  30  19.738   5.093   5.093
  254   1HG   LYS  30          2HG       LYS  30  19.422   7.360   7.360
  255   2HG   LYS  30          1HG       LYS  30  18.430   7.260   7.260
  256   1HD   LYS  30          2HD       LYS  30  21.330   6.550   6.550
  257   2HD   LYS  30          1HD       LYS  30  20.888   8.255   8.255
  258   1HE   LYS  30          2HE       LYS  30  19.460   8.067   8.067
  259   2HE   LYS  30          1HE       LYS  30  19.671   6.317   6.317
  260   1HZ   LYS  30          1HZ       LYS  30  21.970   8.164   8.164
  261   2HZ   LYS  30          3HZ       LYS  30  21.088   7.697   7.697
  262   3HZ   LYS  30          2HZ       LYS  30  21.890   6.525   6.525
  263    H    ILE  31           H        ILE  31  17.397   3.281   3.281
  264    HA   ILE  31           HA       ILE  31  16.920   5.318   5.318
  265    HB   ILE  31           HB       ILE  31  16.645   2.291   2.291
  266   1HG1  ILE  31          2HG1      ILE  31  18.800   3.929   3.929
  267   2HG1  ILE  31          1HG1      ILE  31  18.945   3.508   3.508
  268   1HG2  ILE  31          3HG2      ILE  31  16.672   4.379   4.379
  269   2HG2  ILE  31          2HG2      ILE  31  16.667   2.633   2.633
  270   3HG2  ILE  31          1HG2      ILE  31  15.276   3.421   3.421
  271   1HD1  ILE  31          2HD1      ILE  31  18.456   1.090   1.090
  272   2HD1  ILE  31          1HD1      ILE  31  18.771   1.647   1.647
  273   3HD1  ILE  31          3HD1      ILE  31  20.039   1.742   1.742
  274    H    ALA  32           H        ALA  32  15.005   3.241   3.241
  275    HA   ALA  32           HA       ALA  32  12.508   3.808   3.808
  276   1HB   ALA  32          1HB       ALA  32  13.396   1.919   1.919
  277   2HB   ALA  32          3HB       ALA  32  11.995   2.779   2.779
  278   3HB   ALA  32          2HB       ALA  32  11.880   1.931   1.931
  279    H    VAL  33           H        VAL  33  14.358   5.123   5.123
  280    HA   VAL  33           HA       VAL  33  12.171   6.687   6.687
  281    HB   VAL  33           HB       VAL  33  15.123   7.225   7.225
  282   1HG1  VAL  33          2HG1      VAL  33  12.575   7.757   7.757
  283   2HG1  VAL  33          1HG1      VAL  33  14.119   7.711   7.711
  284   3HG1  VAL  33          3HG1      VAL  33  13.858   8.883   8.883
  285   1HG2  VAL  33          1HG2      VAL  33  13.716   4.779   4.779
  286   2HG2  VAL  33          3HG2      VAL  33  15.401   5.185   5.185
  287   3HG2  VAL  33          2HG2      VAL  33  14.160   5.581   5.581
  288    H    ALA  34           H        ALA  34  14.817   7.139   7.139
  289    HA   ALA  34           HA       ALA  34  14.345   9.992   9.992
  290   1HB   ALA  34          2HB       ALA  34  16.133   7.927   7.927
  291   2HB   ALA  34          1HB       ALA  34  15.779   9.349   9.349
  292   3HB   ALA  34          3HB       ALA  34  16.530   9.537   9.537
  293    H    ALA  35           H        ALA  35  13.460   6.996   6.996
  294    HA   ALA  35           HA       ALA  35  12.205   8.152   8.152
  295   1HB   ALA  35          2HB       ALA  35  12.052   5.489   5.489
  296   2HB   ALA  35          1HB       ALA  35  10.963   5.855   5.855
  297   3HB   ALA  35          3HB       ALA  35  12.708   5.854   5.854
  298    H    ALA  36           H        ALA  36  11.110   7.321   7.321
  299    HA   ALA  36           HA       ALA  36   8.314   7.766   7.766
  300   1HB   ALA  36          3HB       ALA  36  10.060   7.208   7.208
  301   2HB   ALA  36          2HB       ALA  36   8.707   8.265   8.265
  302   3HB   ALA  36          1HB       ALA  36   8.406   6.677   6.677
  303    H    SER  37           H        SER  37  10.551   9.719   9.719
  304    HA   SER  37           HA       SER  37  10.525  12.029  12.029
  305   1HB   SER  37          2HB       SER  37  10.040  11.891  11.891
  306   2HB   SER  37          1HB       SER  37  10.150  13.439  13.439
  307    HG   SER  37           HG       SER  37  12.219  13.142  13.142
  308    H    LYS  38           H        LYS  38   8.258  10.915  10.915
  309    HA   LYS  38           HA       LYS  38   6.063  11.440  11.440
  310   1HB   LYS  38          2HB       LYS  38   6.283  13.969  13.969
  311   2HB   LYS  38          1HB       LYS  38   5.233  13.671  13.671
  312   1HG   LYS  38          2HG       LYS  38   7.520  13.274  13.274
  313   2HG   LYS  38          1HG       LYS  38   8.173  14.254  14.254
  314   1HD   LYS  38          2HD       LYS  38   5.755  15.132  15.132
  315   2HD   LYS  38          1HD       LYS  38   7.396  15.511  15.511
  316   1HE   LYS  38          2HE       LYS  38   7.843  16.624  16.624
  317   2HE   LYS  38          1HE       LYS  38   6.215  16.227  16.227
  318   1HZ   LYS  38          1HZ       LYS  38   5.464  17.443  17.443
  319   2HZ   LYS  38          3HZ       LYS  38   7.032  18.088  18.088
  320   3HZ   LYS  38          2HZ       LYS  38   6.031  18.382  18.382
  321    HA   PRO  39           HA       PRO  39   5.033   9.922   9.922
  322   1HB   PRO  39          2HB       PRO  39   4.066   7.481   7.481
  323   2HB   PRO  39          1HB       PRO  39   5.748   7.785   7.785
  324   1HG   PRO  39          2HG       PRO  39   4.575   7.445   7.445
  325   2HG   PRO  39          1HG       PRO  39   6.220   7.105   7.105
  326   1HD   PRO  39          2HD       PRO  39   5.451   9.361   9.361
  327   2HD   PRO  39          1HD       PRO  39   6.959   9.199   9.199
  328    H    ALA  40           H        ALA  40   2.881   9.525   9.525
  329    HA   ALA  40           HA       ALA  40   0.730  10.539  10.539
  330   1HB   ALA  40          1HB       ALA  40   1.271  11.846  11.846
  331   2HB   ALA  40          3HB       ALA  40   0.777  10.447  10.447
  332   3HB   ALA  40          2HB       ALA  40  -0.398  11.282  11.282
  333    H    VAL  41           H        VAL  41  -1.504   9.681   9.681
  334    HA   VAL  41           HA       VAL  41  -1.514   6.940   6.940
  335    HB   VAL  41           HB       VAL  41  -2.153   7.647   7.647
  336   1HG1  VAL  41          2HG1      VAL  41  -2.910   5.176   5.176
  337   2HG1  VAL  41          1HG1      VAL  41  -2.903   5.240   5.240
  338   3HG1  VAL  41          3HG1      VAL  41  -3.997   6.277   6.277
  339   1HG2  VAL  41          2HG2      VAL  41  -0.300   5.672   5.672
  340   2HG2  VAL  41          1HG2      VAL  41   0.151   7.056   7.056
  341   3HG2  VAL  41          3HG2      VAL  41  -0.642   5.663   5.663
  342    H    GLU  42           H        GLU  42  -3.825   6.185   6.185
  343    HA   GLU  42           HA       GLU  42  -5.872   8.309   8.309
  344   1HB   GLU  42          2HB       GLU  42  -4.910   8.629   8.629
  345   2HB   GLU  42          1HB       GLU  42  -5.230   6.937   6.937
  346   1HG   GLU  42          2HG       GLU  42  -7.673   7.393   7.393
  347   2HG   GLU  42          1HG       GLU  42  -7.266   9.104   9.104
  348    H    ILE  43           H        ILE  43  -7.364   7.226   7.226
  349    HA   ILE  43           HA       ILE  43  -7.706   4.317   4.317
  350    HB   ILE  43           HB       ILE  43  -8.582   6.188   6.188
  351   1HG1  ILE  43          2HG1      ILE  43  -7.078   3.795   3.795
  352   2HG1  ILE  43          1HG1      ILE  43  -6.215   4.731   4.731
  353   1HG2  ILE  43          2HG2      ILE  43  -9.330   3.308   3.308
  354   2HG2  ILE  43          1HG2      ILE  43  -9.292   3.973   3.973
  355   3HG2  ILE  43          3HG2      ILE  43 -10.383   4.657   4.657
  356   1HD1  ILE  43          2HD1      ILE  43  -7.371   6.432   6.432
  357   2HD1  ILE  43          1HD1      ILE  43  -6.246   5.245   5.245
  358   3HD1  ILE  43          3HD1      ILE  43  -5.714   6.360   6.360
  359    H    LYS  44           H        LYS  44  -9.464   3.495   3.495
  360    HA   LYS  44           HA       LYS  44 -11.714   5.345   5.345
  361   1HB   LYS  44          2HB       LYS  44 -11.657   2.841   2.841
  362   2HB   LYS  44          1HB       LYS  44 -11.788   4.495   4.495
  363   1HG   LYS  44          2HG       LYS  44  -9.378   4.757   4.757
  364   2HG   LYS  44          1HG       LYS  44  -9.154   3.255   3.255
  365   1HD   LYS  44          2HD       LYS  44  -9.774   1.938   1.938
  366   2HD   LYS  44          1HD       LYS  44 -10.573   3.289   3.289
  367   1HE   LYS  44          2HE       LYS  44  -8.430   4.374   4.374
  368   2HE   LYS  44          1HE       LYS  44  -7.587   3.118   3.118
  369   1HZ   LYS  44          3HZ       LYS  44  -9.294   2.396   2.396
  370   2HZ   LYS  44          2HZ       LYS  44  -7.713   2.958   2.958
  371   3HZ   LYS  44          1HZ       LYS  44  -7.975   1.558   1.558
  372    H    GLN  45           H        GLN  45 -13.269   4.938   4.938
  373    HA   GLN  45           HA       GLN  45 -13.556   2.147   2.147
  374   1HB   GLN  45          2HB       GLN  45 -13.398   3.951   3.951
  375   2HB   GLN  45          1HB       GLN  45 -14.861   4.687   4.687
  376   1HG   GLN  45          2HG       GLN  45 -16.107   2.588   2.588
  377   2HG   GLN  45          1HG       GLN  45 -14.653   1.909   1.909
  378   1HE2  GLN  45          2HE2      GLN  45 -16.062   3.190   3.190
  379   2HE2  GLN  45          1HE2      GLN  45 -15.843   1.789   1.789
  380    H    GLU  46           H        GLU  46 -15.090   0.861   0.861
  381    HA   GLU  46           HA       GLU  46 -17.584   2.083   2.083
  382   1HB   GLU  46          2HB       GLU  46 -15.990  -0.296  -0.296
  383   2HB   GLU  46          1HB       GLU  46 -17.651   0.020   0.020
  384   1HG   GLU  46          2HG       GLU  46 -17.076   2.011   2.011
  385   2HG   GLU  46          1HG       GLU  46 -15.565   2.180   2.180
  386    H    GLY  47           H        GLY  47 -17.652   1.595   1.595
  387   1HA   GLY  47          2HA       GLY  47 -19.231   0.497   0.497
  388   2HA   GLY  47          1HA       GLY  47 -19.387  -0.794  -0.794
  389    H    ASP  48           H        ASP  48 -18.614  -2.673  -2.673
  390    HA   ASP  48           HA       ASP  48 -16.595  -2.708  -2.708
  391   1HB   ASP  48          2HB       ASP  48 -16.647  -5.229  -5.229
  392   2HB   ASP  48          1HB       ASP  48 -18.130  -4.515  -4.515
  393    H    THR  49           H        THR  49 -16.292  -2.195  -2.195
  394    HA   THR  49           HA       THR  49 -13.823  -3.788  -3.788
  395    HB   THR  49           HB       THR  49 -15.526  -2.175  -2.175
  396    HG1  THR  49           HG1      THR  49 -16.018  -4.127  -4.127
  397   1HG2  THR  49          2HG2      THR  49 -12.709  -3.038  -3.038
  398   2HG2  THR  49          1HG2      THR  49 -13.756  -3.451  -3.451
  399   3HG2  THR  49          3HG2      THR  49 -13.585  -1.769  -1.769
  400    H    PHE  50           H        PHE  50 -11.826  -2.830  -2.830
  401    HA   PHE  50           HA       PHE  50 -11.734   0.143   0.143
  402   1HB   PHE  50          2HB       PHE  50 -10.280  -1.768  -1.768
  403   2HB   PHE  50          1HB       PHE  50  -9.965  -0.030  -0.030
  404    HD1  PHE  50           HD2      PHE  50 -11.665   1.601   1.601
  405    HD2  PHE  50           HD1      PHE  50 -12.340  -2.620  -2.620
  406    HE1  PHE  50           HE2      PHE  50 -13.641   2.023   2.023
  407    HE2  PHE  50           HE1      PHE  50 -14.321  -2.204  -2.204
  408    HZ   PHE  50           HZ       PHE  50 -14.983   0.114   0.114
  409    H    TYR  51           H        TYR  51 -10.578   0.748   0.748
  410    HA   TYR  51           HA       TYR  51  -8.397  -0.981  -0.981
  411   1HB   TYR  51          2HB       TYR  51 -10.292  -0.190  -0.190
  412   2HB   TYR  51          1HB       TYR  51  -9.691   1.446   1.446
  413    HD1  TYR  51           HD1      TYR  51  -7.143   1.801   1.801
  414    HD2  TYR  51           HD2      TYR  51  -9.454  -1.500  -1.500
  415    HE1  TYR  51           HE1      TYR  51  -5.484   1.456   1.456
  416    HE2  TYR  51           HE2      TYR  51  -7.795  -1.839  -1.839
  417    HH   TYR  51           HH       TYR  51  -5.593  -1.330  -1.330
  418    H    ILE  52           H        ILE  52  -6.269  -0.001  -0.001
  419    HA   ILE  52           HA       ILE  52  -5.947   2.708   2.708
  420    HB   ILE  52           HB       ILE  52  -4.087   0.589   0.589
  421   1HG1  ILE  52          2HG1      ILE  52  -6.921   0.976   0.976
  422   2HG1  ILE  52          1HG1      ILE  52  -6.300  -0.478  -0.478
  423   1HG2  ILE  52          2HG2      ILE  52  -4.288   3.229   3.229
  424   2HG2  ILE  52          1HG2      ILE  52  -5.392   2.662   2.662
  425   3HG2  ILE  52          3HG2      ILE  52  -3.717   2.111   2.111
  426   1HD1  ILE  52          1HD1      ILE  52  -4.474  -0.168  -0.168
  427   2HD1  ILE  52          3HD1      ILE  52  -5.911   0.506   0.506
  428   3HD1  ILE  52          2HD1      ILE  52  -5.935  -1.145  -1.145
  429    H    LYS  53           H        LYS  53  -5.052   3.599   3.599
  430    HA   LYS  53           HA       LYS  53  -2.770   2.200   2.200
  431   1HB   LYS  53          2HB       LYS  53  -4.798   3.282   3.282
  432   2HB   LYS  53          1HB       LYS  53  -3.963   4.800   4.800
  433   1HG   LYS  53          2HG       LYS  53  -1.929   3.164   3.164
  434   2HG   LYS  53          1HG       LYS  53  -3.311   2.673   2.673
  435   1HD   LYS  53          2HD       LYS  53  -2.600   5.581   5.581
  436   2HD   LYS  53          1HD       LYS  53  -1.906   4.625   4.625
  437   1HE   LYS  53          2HE       LYS  53  -4.500   3.989   3.989
  438   2HE   LYS  53          1HE       LYS  53  -4.697   5.591   5.591
  439   1HZ   LYS  53          2HZ       LYS  53  -2.938   6.295   6.295
  440   2HZ   LYS  53          1HZ       LYS  53  -3.294   4.836   4.836
  441   3HZ   LYS  53          3HZ       LYS  53  -4.509   5.998   5.998
  442    H    THR  54           H        THR  54  -0.805   2.731   2.731
  443    HA   THR  54           HA       THR  54  -0.415   5.461   5.461
  444    HB   THR  54           HB       THR  54   1.400   3.037   3.037
  445    HG1  THR  54           HG1      THR  54   0.372   2.537   2.537
  446   1HG2  THR  54          2HG2      THR  54   1.822   5.761   5.761
  447   2HG2  THR  54          1HG2      THR  54   1.553   4.962   4.962
  448   3HG2  THR  54          3HG2      THR  54   2.830   4.396   4.396
  449    H    SER  55           H        SER  55   1.218   6.815   6.815
  450    HA   SER  55           HA       SER  55   2.798   5.800   5.800
  451   1HB   SER  55          2HB       SER  55   2.190   8.259   8.259
  452   2HB   SER  55          1HB       SER  55   1.256   6.821   6.821
  453    HG   SER  55           HG       SER  55  -0.353   7.640   7.640
  454    H    THR  56           H        THR  56   4.837   6.636   6.636
  455    HA   THR  56           HA       THR  56   5.554   8.618   8.618
  456    HB   THR  56           HB       THR  56   7.944   7.645   7.645
  457    HG1  THR  56           HG1      THR  56   6.149   5.484   5.484
  458   1HG2  THR  56          3HG2      THR  56   6.927   7.599   7.599
  459   2HG2  THR  56          2HG2      THR  56   6.048   6.141   6.141
  460   3HG2  THR  56          1HG2      THR  56   7.811   6.125   6.125
  461    H    THR  57           H        THR  57   6.852   7.665   7.665
  462    HA   THR  57           HA       THR  57   6.454  10.108  10.108
  463    HB   THR  57           HB       THR  57   7.970  11.152  11.152
  464    HG1  THR  57           HG1      THR  57   8.525  11.970  11.970
  465   1HG2  THR  57          3HG2      THR  57   8.985   8.974   8.974
  466   2HG2  THR  57          2HG2      THR  57   9.986   9.007   9.007
  467   3HG2  THR  57          1HG2      THR  57  10.151  10.276  10.276
  468    H    VAL  58           H        VAL  58   8.669   7.463   7.463
  469    HA   VAL  58           HA       VAL  58   8.880   6.934   6.934
  470    HB   VAL  58           HB       VAL  58  10.746   6.045   6.045
  471   1HG1  VAL  58          2HG1      VAL  58  10.691   5.691   5.691
  472   2HG1  VAL  58          1HG1      VAL  58  12.215   5.638   5.638
  473   3HG1  VAL  58          3HG1      VAL  58  10.944   4.471   4.471
  474   1HG2  VAL  58          1HG2      VAL  58  10.530   8.594   8.594
  475   2HG2  VAL  58          3HG2      VAL  58  12.055   7.882   7.882
  476   3HG2  VAL  58          2HG2      VAL  58  11.647   7.928   7.928
  477    H    ARG  59           H        ARG  59   7.535   5.842   5.842
  478    HA   ARG  59           HA       ARG  59   7.065   3.149   3.149
  479   1HB   ARG  59          2HB       ARG  59   8.548   3.055   3.055
  480   2HB   ARG  59          1HB       ARG  59   7.276   3.835   3.835
  481   1HG   ARG  59          2HG       ARG  59   5.831   1.989   1.989
  482   2HG   ARG  59          1HG       ARG  59   6.699   1.328   1.328
  483   1HD   ARG  59          2HD       ARG  59   8.710   1.194   1.194
  484   2HD   ARG  59          1HD       ARG  59   7.416   1.211   1.211
  485    HE   ARG  59           HE       ARG  59   6.488  -0.811  -0.811
  486   1HH1  ARG  59          2HH1      ARG  59   9.119  -0.083  -0.083
  487   2HH1  ARG  59          1HH1      ARG  59   9.988  -1.556  -1.556
  488   1HH2  ARG  59          1HH2      ARG  59   7.893  -2.630  -2.630
  489   2HH2  ARG  59          2HH2      ARG  59   9.295  -2.997  -2.997
  490    H    THR  60           H        THR  60   4.967   2.188   2.188
  491    HA   THR  60           HA       THR  60   2.956   3.949   3.949
  492    HB   THR  60           HB       THR  60   2.593   3.100   3.100
  493    HG1  THR  60           HG1      THR  60   4.080   4.636   4.636
  494   1HG2  THR  60          2HG2      THR  60   1.092   4.899   4.899
  495   2HG2  THR  60          1HG2      THR  60   0.799   4.904   4.904
  496   3HG2  THR  60          3HG2      THR  60   0.499   3.442   3.442
  497    H    THR  61           H        THR  61   2.301   2.312   2.312
  498    HA   THR  61           HA       THR  61   1.684  -0.363  -0.363
  499    HB   THR  61           HB       THR  61   1.582  -1.118  -1.118
  500    HG1  THR  61           HG1      THR  61   2.467   1.501   1.501
  501   1HG2  THR  61          2HG2      THR  61   3.755  -0.865  -0.865
  502   2HG2  THR  61          1HG2      THR  61   4.122   0.460   0.460
  503   3HG2  THR  61          3HG2      THR  61   3.903  -1.174  -1.174
  504    H    GLU  62           H        GLU  62  -0.316  -1.412  -1.412
  505    HA   GLU  62           HA       GLU  62  -2.434   0.283   0.283
  506   1HB   GLU  62          2HB       GLU  62  -3.899   0.297   0.297
  507   2HB   GLU  62          1HB       GLU  62  -2.360   1.031   1.031
  508   1HG   GLU  62          2HG       GLU  62  -1.925  -1.634  -1.634
  509   2HG   GLU  62          1HG       GLU  62  -3.623  -1.420  -1.420
  510    H    ILE  63           H        ILE  63  -3.497  -1.068  -1.068
  511    HA   ILE  63           HA       ILE  63  -3.714  -3.957  -3.957
  512    HB   ILE  63           HB       ILE  63  -4.104  -4.342  -4.342
  513   1HG1  ILE  63          2HG1      ILE  63  -3.403  -1.408  -1.408
  514   2HG1  ILE  63          1HG1      ILE  63  -5.054  -2.025  -2.025
  515   1HG2  ILE  63          3HG2      ILE  63  -1.755  -4.035  -4.035
  516   2HG2  ILE  63          2HG2      ILE  63  -1.628  -2.671  -2.671
  517   3HG2  ILE  63          1HG2      ILE  63  -1.851  -4.303  -4.303
  518   1HD1  ILE  63          3HD1      ILE  63  -3.028  -3.406  -3.406
  519   2HD1  ILE  63          2HD1      ILE  63  -3.511  -1.785  -1.785
  520   3HD1  ILE  63          1HD1      ILE  63  -4.723  -3.055  -3.055
  521    H    ASN  64           H        ASN  64  -5.871  -4.948  -4.948
  522    HA   ASN  64           HA       ASN  64  -8.089  -3.099  -3.099
  523   1HB   ASN  64          2HB       ASN  64  -9.252  -3.473  -3.473
  524   2HB   ASN  64          1HB       ASN  64  -7.605  -3.008  -3.008
  525   1HD2  ASN  64          2HD2      ASN  64  -8.866  -6.818  -6.818
  526   2HD2  ASN  64          1HD2      ASN  64  -9.733  -5.840  -5.840
  527    H    PHE  65           H        PHE  65  -9.704  -4.151  -4.151
  528    HA   PHE  65           HA       PHE  65 -10.160  -7.044  -7.044
  529   1HB   PHE  65          2HB       PHE  65  -9.496  -7.673  -7.673
  530   2HB   PHE  65          1HB       PHE  65  -8.121  -6.942  -6.942
  531    HD1  PHE  65           HD2      PHE  65  -7.465  -4.580  -4.580
  532    HD2  PHE  65           HD1      PHE  65 -10.540  -6.609  -6.609
  533    HE1  PHE  65           HE2      PHE  65  -7.354  -2.832  -2.832
  534    HE2  PHE  65           HE1      PHE  65 -10.440  -4.863  -4.863
  535    HZ   PHE  65           HZ       PHE  65  -8.848  -2.967  -2.967
  536    H    LYS  66           H        LYS  66 -11.485  -7.737  -7.737
  537    HA   LYS  66           HA       LYS  66 -13.495  -5.616  -5.616
  538   1HB   LYS  66          2HB       LYS  66 -15.240  -7.486  -7.486
  539   2HB   LYS  66          1HB       LYS  66 -14.648  -6.947  -6.947
  540   1HG   LYS  66          2HG       LYS  66 -12.926  -8.840  -8.840
  541   2HG   LYS  66          1HG       LYS  66 -13.895  -9.440  -9.440
  542   1HD   LYS  66          2HD       LYS  66 -14.611 -10.542 -10.542
  543   2HD   LYS  66          1HD       LYS  66 -15.893  -9.479  -9.479
  544   1HE   LYS  66          2HE       LYS  66 -15.834  -8.322  -8.322
  545   2HE   LYS  66          1HE       LYS  66 -14.119  -7.978  -7.978
  546   1HZ   LYS  66          1HZ       LYS  66 -15.106 -10.571 -10.571
  547   2HZ   LYS  66          3HZ       LYS  66 -14.735  -9.266  -9.266
  548   3HZ   LYS  66          2HZ       LYS  66 -13.522  -9.958  -9.958
  549    H    VAL  67           H        VAL  67 -14.537  -5.983  -5.983
  550    HA   VAL  67           HA       VAL  67 -12.638  -7.239  -7.239
  551    HB   VAL  67           HB       VAL  67 -15.199  -6.303  -6.303
  552   1HG1  VAL  67          3HG1      VAL  67 -12.246  -5.979  -5.979
  553   2HG1  VAL  67          2HG1      VAL  67 -13.401  -4.934  -4.934
  554   3HG1  VAL  67          1HG1      VAL  67 -13.473  -6.681  -6.681
  555   1HG2  VAL  67          1HG2      VAL  67 -13.554  -4.545  -4.545
  556   2HG2  VAL  67          3HG2      VAL  67 -15.289  -4.520  -4.520
  557   3HG2  VAL  67          2HG2      VAL  67 -14.177  -3.866  -3.866
  558    H    GLY  68           H        GLY  68 -12.810  -9.488  -9.488
  559   1HA   GLY  68          2HA       GLY  68 -14.472 -11.019 -11.019
  560   2HA   GLY  68          1HA       GLY  68 -15.475 -10.742 -10.742
  561    H    GLU  69           H        GLU  69 -12.864 -10.712 -10.712
  562    HA   GLU  69           HA       GLU  69 -12.290 -13.647 -13.647
  563   1HB   GLU  69          2HB       GLU  69 -12.433 -13.766 -13.766
  564   2HB   GLU  69          1HB       GLU  69 -13.980 -13.366 -13.366
  565   1HG   GLU  69          2HG       GLU  69 -14.066 -11.364 -11.364
  566   2HG   GLU  69          1HG       GLU  69 -12.400 -10.981 -10.981
  567    H    GLU  70           H        GLU  70 -10.337 -14.257 -14.257
  568    HA   GLU  70           HA       GLU  70  -8.219 -12.252 -12.252
  569   1HB   GLU  70          2HB       GLU  70  -7.935 -15.053 -15.053
  570   2HB   GLU  70          1HB       GLU  70  -6.678 -14.061 -14.061
  571   1HG   GLU  70          2HG       GLU  70  -7.720 -14.229 -14.229
  572   2HG   GLU  70          1HG       GLU  70  -9.144 -15.010 -15.010
  573    H    PHE  71           H        PHE  71  -6.539 -12.089 -12.089
  574    HA   PHE  71           HA       PHE  71  -7.498 -12.473 -12.473
  575   1HB   PHE  71          2HB       PHE  71  -7.412 -10.011 -10.011
  576   2HB   PHE  71          1HB       PHE  71  -8.761 -10.466 -10.466
  577    HD1  PHE  71           HD2      PHE  71  -8.521 -10.160 -10.160
  578    HD2  PHE  71           HD1      PHE  71  -5.770  -8.466  -8.466
  579    HE1  PHE  71           HE2      PHE  71  -7.709  -8.580  -8.580
  580    HE2  PHE  71           HE1      PHE  71  -4.960  -6.885  -6.885
  581    HZ   PHE  71           HZ       PHE  71  -5.927  -6.938  -6.938
  582    H    GLU  72           H        GLU  72  -5.879 -11.279 -11.279
  583    HA   GLU  72           HA       GLU  72  -3.171 -11.625 -11.625
  584   1HB   GLU  72          2HB       GLU  72  -3.620 -11.319 -11.319
  585   2HB   GLU  72          1HB       GLU  72  -2.318 -12.144 -12.144
  586   1HG   GLU  72          2HG       GLU  72  -3.977 -13.860 -13.860
  587   2HG   GLU  72          1HG       GLU  72  -5.186 -13.090 -13.090
  588    H    GLU  73           H        GLU  73  -1.679  -9.943  -9.943
  589    HA   GLU  73           HA       GLU  73  -2.298  -7.482  -7.482
  590   1HB   GLU  73          2HB       GLU  73  -2.300  -6.068  -6.068
  591   2HB   GLU  73          1HB       GLU  73  -3.716  -7.108  -7.108
  592   1HG   GLU  73          2HG       GLU  73  -3.074  -8.441  -8.441
  593   2HG   GLU  73          1HG       GLU  73  -1.355  -8.243  -8.243
  594    H    GLN  74           H        GLN  74  -0.589  -5.741  -5.741
  595    HA   GLN  74           HA       GLN  74   2.022  -7.201  -7.201
  596   1HB   GLN  74          2HB       GLN  74   1.130  -4.507  -4.507
  597   2HB   GLN  74          1HB       GLN  74   2.809  -4.706  -4.706
  598   1HG   GLN  74          2HG       GLN  74   2.655  -6.889  -6.889
  599   2HG   GLN  74          1HG       GLN  74   1.350  -5.992  -5.992
  600   1HE2  GLN  74          2HE2      GLN  74   5.049  -5.108  -5.108
  601   2HE2  GLN  74          1HE2      GLN  74   4.551  -6.580  -6.580
  602    H    THR  75           H        THR  75   3.653  -6.551  -6.551
  603    HA   THR  75           HA       THR  75   2.505  -5.565  -5.565
  604    HB   THR  75           HB       THR  75   3.984  -7.620  -7.620
  605    HG1  THR  75           HG1      THR  75   4.674  -7.246  -7.246
  606   1HG2  THR  75          1HG2      THR  75   5.748  -5.762  -5.762
  607   2HG2  THR  75          3HG2      THR  75   6.501  -6.301  -6.301
  608   3HG2  THR  75          2HG2      THR  75   5.998  -7.482  -7.482
  609    H    VAL  76           H        VAL  76   5.362  -4.511  -4.511
  610    HA   VAL  76           HA       VAL  76   4.976  -1.867  -1.867
  611    HB   VAL  76           HB       VAL  76   6.323  -2.445  -2.445
  612   1HG1  VAL  76          2HG1      VAL  76   5.429   0.092   0.092
  613   2HG1  VAL  76          1HG1      VAL  76   5.925   0.029   0.029
  614   3HG1  VAL  76          3HG1      VAL  76   7.079  -0.367  -0.367
  615   1HG2  VAL  76          1HG2      VAL  76   3.476  -1.826  -1.826
  616   2HG2  VAL  76          3HG2      VAL  76   4.092  -2.971  -2.971
  617   3HG2  VAL  76          2HG2      VAL  76   4.127  -1.240  -1.240
  618    H    ASP  77           H        ASP  77   7.228  -4.468  -4.468
  619    HA   ASP  77           HA       ASP  77   9.546  -2.822  -2.822
  620   1HB   ASP  77          2HB       ASP  77   9.362  -5.021  -5.021
  621   2HB   ASP  77          1HB       ASP  77   9.746  -5.778  -5.778
  622    H    GLY  78           H        GLY  78   7.529  -5.379  -5.379
  623   1HA   GLY  78          2HA       GLY  78   7.126  -4.848  -4.848
  624   2HA   GLY  78          1HA       GLY  78   8.879  -4.999  -4.999
  625    H    ARG  79           H        ARG  79   6.561  -6.921  -6.921
  626    HA   ARG  79           HA       ARG  79   7.329  -9.310  -9.310
  627   1HB   ARG  79          2HB       ARG  79   7.369  -8.848  -8.848
  628   2HB   ARG  79          1HB       ARG  79   7.072 -10.462 -10.462
  629   1HG   ARG  79          2HG       ARG  79   9.211  -9.749  -9.749
  630   2HG   ARG  79          1HG       ARG  79   9.549  -8.847  -8.847
  631   1HD   ARG  79          2HD       ARG  79  10.577 -11.050 -11.050
  632   2HD   ARG  79          1HD       ARG  79   9.247 -10.941 -10.941
  633    HE   ARG  79           HE       ARG  79   7.976 -12.010 -12.010
  634   1HH1  ARG  79          1HH2      ARG  79  10.997 -12.678 -12.678
  635   2HH1  ARG  79          2HH2      ARG  79  11.018 -14.346 -14.346
  636   1HH2  ARG  79          2HH1      ARG  79   7.999 -14.185 -14.185
  637   2HH2  ARG  79          1HH1      ARG  79   9.320 -15.199 -15.199
  638    HA   PRO  80           HA       PRO  80   2.908  -9.804  -9.804
  639   1HB   PRO  80          2HB       PRO  80   2.751 -12.428 -12.428
  640   2HB   PRO  80          1HB       PRO  80   3.161 -11.115 -11.115
  641   1HG   PRO  80          2HG       PRO  80   4.945 -13.180 -13.180
  642   2HG   PRO  80          1HG       PRO  80   5.112 -12.316 -12.316
  643   1HD   PRO  80          2HD       PRO  80   6.516 -11.730 -11.730
  644   2HD   PRO  80          1HD       PRO  80   6.399 -10.674 -10.674
  645    H    CYS  81           H        CYS  81   1.341 -10.519 -10.519
  646    HA   CYS  81           HA       CYS  81   1.767 -12.848 -12.848
  647   1HB   CYS  81          2HB       CYS  81   1.612 -11.541 -11.541
  648   2HB   CYS  81          1HB       CYS  81   3.125 -11.294 -11.294
  649    HG   CYS  81           HG       CYS  81   0.777  -9.224  -9.224
  650    H    LYS  82           H        LYS  82  -0.177 -13.551 -13.551
  651    HA   LYS  82           HA       LYS  82  -2.586 -12.152 -12.152
  652   1HB   LYS  82          2HB       LYS  82  -2.471 -14.574 -14.574
  653   2HB   LYS  82          1HB       LYS  82  -2.200 -14.831 -14.831
  654   1HG   LYS  82          2HG       LYS  82  -4.427 -15.070 -15.070
  655   2HG   LYS  82          1HG       LYS  82  -4.535 -13.331 -13.331
  656   1HD   LYS  82          2HD       LYS  82  -5.965 -14.170 -14.170
  657   2HD   LYS  82          1HD       LYS  82  -4.454 -13.927 -13.927
  658   1HE   LYS  82          2HE       LYS  82  -3.873 -16.298 -16.298
  659   2HE   LYS  82          1HE       LYS  82  -5.370 -16.548 -16.548
  660   1HZ   LYS  82          3HZ       LYS  82  -5.382 -15.461 -15.461
  661   2HZ   LYS  82          2HZ       LYS  82  -5.361 -17.135 -17.135
  662   3HZ   LYS  82          1HZ       LYS  82  -6.654 -16.189 -16.189
  663    H    SER  83           H        SER  83  -3.368 -10.606 -10.606
  664    HA   SER  83           HA       SER  83  -2.824 -10.797 -10.797
  665   1HB   SER  83          2HB       SER  83  -2.447  -8.723  -8.723
  666   2HB   SER  83          1HB       SER  83  -4.164  -8.469  -8.469
  667    HG   SER  83           HG       SER  83  -2.758  -7.433  -7.433
  668    H    LEU  84           H        LEU  84  -4.763  -9.787  -9.787
  669    HA   LEU  84           HA       LEU  84  -7.411 -10.549 -10.549
  670   1HB   LEU  84          2HB       LEU  84  -6.647 -12.674 -12.674
  671   2HB   LEU  84          1HB       LEU  84  -6.173 -11.865 -11.865
  672    HG   LEU  84           HG       LEU  84  -8.516 -11.301 -11.301
  673   1HD1  LEU  84          2HD1      LEU  84  -9.116 -11.277 -11.277
  674   2HD1  LEU  84          1HD1      LEU  84  -9.337 -13.011 -13.011
  675   3HD1  LEU  84          3HD1      LEU  84 -10.318 -11.891 -11.891
  676   1HD2  LEU  84          3HD2      LEU  84  -7.415 -13.628 -13.628
  677   2HD2  LEU  84          2HD2      LEU  84  -9.152 -13.433 -13.433
  678   3HD2  LEU  84          1HD2      LEU  84  -8.539 -14.207 -14.207
  679    H    VAL  85           H        VAL  85  -9.133  -9.583  -9.583
  680    HA   VAL  85           HA       VAL  85  -8.097  -7.756  -7.756
  681    HB   VAL  85           HB       VAL  85  -9.944  -6.766  -6.766
  682   1HG1  VAL  85          3HG1      VAL  85  -9.906  -5.633  -5.633
  683   2HG1  VAL  85          2HG1      VAL  85  -8.193  -5.299  -5.299
  684   3HG1  VAL  85          1HG1      VAL  85  -9.396  -4.588  -4.588
  685   1HG2  VAL  85          2HG2      VAL  85  -6.947  -6.839  -6.839
  686   2HG2  VAL  85          1HG2      VAL  85  -8.000  -7.082  -7.082
  687   3HG2  VAL  85          3HG2      VAL  85  -7.738  -5.459  -5.459
  688    H    LYS  86           H        LYS  86  -9.379  -7.695  -7.695
  689    HA   LYS  86           HA       LYS  86 -12.277  -8.316  -8.316
  690   1HB   LYS  86          2HB       LYS  86 -11.920  -9.031  -9.031
  691   2HB   LYS  86          1HB       LYS  86 -11.728 -10.185 -10.185
  692   1HG   LYS  86          2HG       LYS  86  -9.263  -9.647  -9.647
  693   2HG   LYS  86          1HG       LYS  86  -9.533  -8.668  -8.668
  694   1HD   LYS  86          2HD       LYS  86  -9.851 -10.493 -10.493
  695   2HD   LYS  86          1HD       LYS  86 -10.627 -11.430 -11.430
  696   1HE   LYS  86          2HE       LYS  86  -8.640 -12.266 -12.266
  697   2HE   LYS  86          1HE       LYS  86  -7.748 -10.797 -10.797
  698   1HZ   LYS  86          2HZ       LYS  86  -8.710 -12.809 -12.809
  699   2HZ   LYS  86          1HZ       LYS  86  -7.105 -12.636 -12.636
  700   3HZ   LYS  86          3HZ       LYS  86  -7.836 -11.400 -11.400
  701    H    TRP  87           H        TRP  87 -13.600  -7.110  -7.110
  702    HA   TRP  87           HA       TRP  87 -12.482  -4.439  -4.439
  703   1HB   TRP  87          2HB       TRP  87 -15.164  -5.737  -5.737
  704   2HB   TRP  87          1HB       TRP  87 -14.799  -4.134  -4.134
  705    HD1  TRP  87           HD1      TRP  87 -15.928  -5.946  -5.946
  706    HE1  TRP  87           HE1      TRP  87 -16.118  -4.356  -4.356
  707    HE3  TRP  87           HE3      TRP  87 -13.481  -1.897  -1.897
  708    HZ2  TRP  87           HZ2      TRP  87 -15.332  -1.702  -1.702
  709    HZ3  TRP  87           HZ3      TRP  87 -13.189   0.146   0.146
  710    HH2  TRP  87           HH2      TRP  87 -14.111   0.240   0.240
  711    H    GLU  88           H        GLU  88 -12.989  -3.455  -3.455
  712    HA   GLU  88           HA       GLU  88 -12.449  -5.345  -5.345
  713   1HB   GLU  88          2HB       GLU  88 -10.372  -4.055  -4.055
  714   2HB   GLU  88          1HB       GLU  88 -11.119  -2.648  -2.648
  715   1HG   GLU  88          2HG       GLU  88  -9.752  -3.458  -3.458
  716   2HG   GLU  88          1HG       GLU  88 -11.329  -4.143  -4.143
  717    H    SER  89           H        SER  89 -13.247  -2.059  -2.059
  718    HA   SER  89           HA       SER  89 -15.310  -1.919  -1.919
  719   1HB   SER  89          2HB       SER  89 -14.703   0.348   0.348
  720   2HB   SER  89          1HB       SER  89 -13.187  -0.550  -0.550
  721    HG   SER  89           HG       SER  89 -13.483   1.539   1.539
  722    H    GLU  90           H        GLU  90 -16.113   0.749   0.749
  723    HA   GLU  90           HA       GLU  90 -17.723  -0.171  -0.171
  724   1HB   GLU  90          2HB       GLU  90 -18.601   2.182   2.182
  725   2HB   GLU  90          1HB       GLU  90 -18.720   1.372   1.372
  726   1HG   GLU  90          2HG       GLU  90 -16.943   2.596   2.596
  727   2HG   GLU  90          1HG       GLU  90 -16.288   3.012   3.012
  728    H    ASN  91           H        ASN  91 -14.744   1.635   1.635
  729    HA   ASN  91           HA       ASN  91 -14.561   1.728   1.728
  730   1HB   ASN  91          2HB       ASN  91 -13.867   4.106   4.106
  731   2HB   ASN  91          1HB       ASN  91 -13.868   4.026   4.026
  732   1HD2  ASN  91          2HD2      ASN  91 -17.181   5.260   5.260
  733   2HD2  ASN  91          1HD2      ASN  91 -15.612   5.393   5.393
  734    H    LYS  92           H        LYS  92 -13.183   0.147   0.147
  735    HA   LYS  92           HA       LYS  92 -10.417   0.908   0.908
  736   1HB   LYS  92          2HB       LYS  92 -10.642   1.708   1.708
  737   2HB   LYS  92          1HB       LYS  92 -11.388   0.199   0.199
  738   1HG   LYS  92          2HG       LYS  92  -9.316  -1.016  -1.016
  739   2HG   LYS  92          1HG       LYS  92  -8.558   0.403   0.403
  740   1HD   LYS  92          2HD       LYS  92  -8.810   1.618   1.618
  741   2HD   LYS  92          1HD       LYS  92  -9.539   0.181   0.181
  742   1HE   LYS  92          2HE       LYS  92  -7.509  -1.079  -1.079
  743   2HE   LYS  92          1HE       LYS  92  -6.783   0.180   0.180
  744   1HZ   LYS  92          3HZ       LYS  92  -7.656   0.693   0.693
  745   2HZ   LYS  92          2HZ       LYS  92  -6.103   0.107   0.107
  746   3HZ   LYS  92          1HZ       LYS  92  -6.605   1.615   1.615
  747    H    MET  93           H        MET  93  -9.865  -0.789  -0.789
  748    HA   MET  93           HA       MET  93 -10.631  -3.527  -3.527
  749   1HB   MET  93          2HB       MET  93 -10.523  -4.227  -4.227
  750   2HB   MET  93          1HB       MET  93 -11.692  -2.935  -2.935
  751   1HG   MET  93          2HG       MET  93  -9.244  -1.644  -1.644
  752   2HG   MET  93          1HG       MET  93  -9.307  -2.982  -2.982
  753   1HE   MET  93          3HE       MET  93 -11.604  -3.699  -3.699
  754   2HE   MET  93          2HE       MET  93 -12.672  -2.620  -2.620
  755   3HE   MET  93          1HE       MET  93 -11.035  -2.904  -2.904
  756    H    VAL  94           H        VAL  94  -9.079  -5.180  -5.180
  757    HA   VAL  94           HA       VAL  94  -6.264  -4.231  -4.231
  758    HB   VAL  94           HB       VAL  94  -7.122  -7.000  -7.000
  759   1HG1  VAL  94          1HG1      VAL  94  -4.841  -5.149  -5.149
  760   2HG1  VAL  94          3HG1      VAL  94  -5.232  -6.300  -6.300
  761   3HG1  VAL  94          2HG1      VAL  94  -4.829  -6.876  -6.876
  762   1HG2  VAL  94          1HG2      VAL  94  -7.347  -4.500  -4.500
  763   2HG2  VAL  94          3HG2      VAL  94  -8.651  -5.606  -5.606
  764   3HG2  VAL  94          2HG2      VAL  94  -7.365  -6.139  -6.139
  765    H    CYS  95           H        CYS  95  -4.707  -6.033  -6.033
  766    HA   CYS  95           HA       CYS  95  -5.933  -7.470  -7.470
  767   1HB   CYS  95          2HB       CYS  95  -5.385  -5.175  -5.175
  768   2HB   CYS  95          1HB       CYS  95  -3.703  -5.459  -5.459
  769    HG   CYS  95           HG       CYS  95  -3.446  -7.050  -7.050
  770    H    GLU  96           H        GLU  96  -4.864  -9.315  -9.315
  771    HA   GLU  96           HA       GLU  96  -2.249  -9.817  -9.817
  772   1HB   GLU  96          2HB       GLU  96  -4.133 -11.856 -11.856
  773   2HB   GLU  96          1HB       GLU  96  -2.759 -12.176 -12.176
  774   1HG   GLU  96          2HG       GLU  96  -4.730 -10.321 -10.321
  775   2HG   GLU  96          1HG       GLU  96  -5.379 -11.928 -11.928
  776    H    GLN  97           H        GLN  97  -0.665 -11.132 -11.132
  777    HA   GLN  97           HA       GLN  97  -1.167 -11.053 -11.053
  778   1HB   GLN  97          2HB       GLN  97  -0.404  -8.695  -8.695
  779   2HB   GLN  97          1HB       GLN  97   1.187  -9.434  -9.434
  780   1HG   GLN  97          2HG       GLN  97   0.424 -10.100 -10.100
  781   2HG   GLN  97          1HG       GLN  97  -0.863  -8.918  -8.918
  782   1HE2  GLN  97          2HE2      GLN  97   1.245  -6.184  -6.184
  783   2HE2  GLN  97          1HE2      GLN  97  -0.336  -6.780  -6.780
  784    H    LYS  98           H        LYS  98   0.115 -12.455 -12.455
  785    HA   LYS  98           HA       LYS  98   2.694 -13.357 -13.357
  786   1HB   LYS  98          2HB       LYS  98   2.014 -15.751 -15.751
  787   2HB   LYS  98          1HB       LYS  98   1.092 -14.847 -14.847
  788   1HG   LYS  98          2HG       LYS  98  -0.501 -14.500 -14.500
  789   2HG   LYS  98          1HG       LYS  98   0.180 -16.086 -16.086
  790   1HD   LYS  98          2HD       LYS  98  -0.726 -17.067 -17.067
  791   2HD   LYS  98          1HD       LYS  98  -0.877 -15.522 -15.522
  792   1HE   LYS  98          2HE       LYS  98  -2.632 -14.862 -14.862
  793   2HE   LYS  98          1HE       LYS  98  -2.553 -16.496 -16.496
  794   1HZ   LYS  98          3HZ       LYS  98  -2.962 -17.223 -17.223
  795   2HZ   LYS  98          2HZ       LYS  98  -3.464 -15.623 -15.623
  796   3HZ   LYS  98          1HZ       LYS  98  -4.275 -16.590 -16.590
  797    H    LEU  99           H        LEU  99   4.015 -14.168 -14.168
  798    HA   LEU  99           HA       LEU  99   3.407 -13.276 -13.276
  799   1HB   LEU  99          2HB       LEU  99   5.279 -15.470 -15.470
  800   2HB   LEU  99          1HB       LEU  99   5.255 -14.784 -14.784
  801    HG   LEU  99           HG       LEU  99   5.467 -12.872 -12.872
  802   1HD1  LEU  99          2HD1      LEU  99   7.652 -14.770 -14.770
  803   2HD1  LEU  99          1HD1      LEU  99   7.989 -13.247 -13.247
  804   3HD1  LEU  99          3HD1      LEU  99   7.060 -14.504 -14.504
  805   1HD2  LEU  99          1HD2      LEU  99   6.241 -13.125 -13.125
  806   2HD2  LEU  99          3HD2      LEU  99   5.579 -11.738 -11.738
  807   3HD2  LEU  99          2HD2      LEU  99   7.288 -12.143 -12.143
  808    H    LEU 100           H        LEU 100   3.191 -14.652 -14.652
  809    HA   LEU 100           HA       LEU 100   1.429 -16.987 -16.987
  810   1HB   LEU 100          2HB       LEU 100   0.842 -16.585 -16.585
  811   2HB   LEU 100          1HB       LEU 100   0.091 -15.585 -15.585
  812    HG   LEU 100           HG       LEU 100   1.789 -13.830 -13.830
  813   1HD1  LEU 100          3HD1      LEU 100   2.888 -15.969 -15.969
  814   2HD1  LEU 100          2HD1      LEU 100   3.010 -14.313 -14.313
  815   3HD1  LEU 100          1HD1      LEU 100   3.742 -14.759 -14.759
  816   1HD2  LEU 100          3HD2      LEU 100  -0.409 -14.287 -14.287
  817   2HD2  LEU 100          2HD2      LEU 100   0.695 -12.969 -12.969
  818   3HD2  LEU 100          1HD2      LEU 100   0.780 -14.488 -14.488
  819    H    LYS 101           H        LYS 101   4.577 -16.365 -16.365
  820    HA   LYS 101           HA       LYS 101   4.993 -18.975 -18.975
  821   1HB   LYS 101          2HB       LYS 101   4.867 -16.894 -16.894
  822   2HB   LYS 101          1HB       LYS 101   6.558 -16.762 -16.762
  823   1HG   LYS 101          2HG       LYS 101   6.552 -18.221 -18.221
  824   2HG   LYS 101          1HG       LYS 101   6.741 -19.269 -19.269
  825   1HD   LYS 101          2HD       LYS 101   4.307 -19.714 -19.714
  826   2HD   LYS 101          1HD       LYS 101   4.133 -18.688 -18.688
  827   1HE   LYS 101          2HE       LYS 101   5.412 -20.175 -20.175
  828   2HE   LYS 101          1HE       LYS 101   6.001 -21.063 -21.063
  829   1HZ   LYS 101          3HZ       LYS 101   3.562 -21.575 -21.575
  830   2HZ   LYS 101          2HZ       LYS 101   3.289 -21.063 -21.063
  831   3HZ   LYS 101          1HZ       LYS 101   4.310 -22.386 -22.386
  832    H    GLY 102           H        GLY 102   6.389 -19.847 -19.847
  833   1HA   GLY 102          2HA       GLY 102   8.448 -20.089 -20.089
  834   2HA   GLY 102          1HA       GLY 102   8.895 -18.463 -18.463
  835    H    GLU 103           H        GLU 103   9.561 -18.235 -18.235
  836    HA   GLU 103           HA       GLU 103   7.617 -16.735 -16.735
  837   1HB   GLU 103          2HB       GLU 103   6.701 -19.040 -19.040
  838   2HB   GLU 103          1HB       GLU 103   8.214 -19.458 -19.458
  839   1HG   GLU 103          2HG       GLU 103   7.862 -17.808 -17.808
  840   2HG   GLU 103          1HG       GLU 103   6.495 -17.117 -17.117
  841    H    GLY 104           H        GLY 104   8.609 -15.558 -15.558
  842   1HA   GLY 104          2HA       GLY 104  11.179 -16.403 -16.403
  843   2HA   GLY 104          1HA       GLY 104  11.235 -14.945 -14.945
  844    HA   PRO 105           HA       PRO 105   9.757 -12.791 -12.791
  845   1HB   PRO 105          2HB       PRO 105   8.950 -10.456 -10.456
  846   2HB   PRO 105          1HB       PRO 105  10.653 -10.875 -10.875
  847   1HG   PRO 105          2HG       PRO 105   9.096 -10.836 -10.836
  848   2HG   PRO 105          1HG       PRO 105  10.848 -10.736 -10.736
  849   1HD   PRO 105          2HD       PRO 105   9.347 -13.047 -13.047
  850   2HD   PRO 105          1HD       PRO 105  11.079 -12.976 -12.976
  851    H    LYS 106           H        LYS 106   7.655 -11.282 -11.282
  852    HA   LYS 106           HA       LYS 106   5.272 -12.505 -12.505
  853   1HB   LYS 106          2HB       LYS 106   5.676 -13.594 -13.594
  854   2HB   LYS 106          1HB       LYS 106   5.682 -12.011 -12.011
  855   1HG   LYS 106          2HG       LYS 106   3.401 -11.679 -11.679
  856   2HG   LYS 106          1HG       LYS 106   3.339 -12.846 -12.846
  857   1HD   LYS 106          2HD       LYS 106   3.404 -14.694 -14.694
  858   2HD   LYS 106          1HD       LYS 106   4.011 -13.719 -13.719
  859   1HE   LYS 106          2HE       LYS 106   1.241 -13.548 -13.548
  860   2HE   LYS 106          1HE       LYS 106   1.642 -14.222 -14.222
  861   1HZ   LYS 106          1HZ       LYS 106   2.703 -11.900 -11.900
  862   2HZ   LYS 106          3HZ       LYS 106   1.661 -11.419 -11.419
  863   3HZ   LYS 106          2HZ       LYS 106   1.024 -12.096 -12.096
  864    H    THR 107           H        THR 107   3.608 -10.986 -10.986
  865    HA   THR 107           HA       THR 107   4.141  -8.227  -8.227
  866    HB   THR 107           HB       THR 107   2.754  -7.786  -7.786
  867    HG1  THR 107           HG1      THR 107   3.058 -10.095 -10.095
  868   1HG2  THR 107          2HG2      THR 107   4.867  -6.724  -6.724
  869   2HG2  THR 107          1HG2      THR 107   5.759  -8.062  -8.062
  870   3HG2  THR 107          3HG2      THR 107   4.834  -6.962  -6.962
  871    H    SER 108           H        SER 108   2.420  -7.014  -7.014
  872    HA   SER 108           HA       SER 108  -0.350  -7.815  -7.815
  873   1HB   SER 108          2HB       SER 108  -0.584  -7.797  -7.797
  874   2HB   SER 108          1HB       SER 108  -0.219  -9.289  -9.289
  875    HG   SER 108           HG       SER 108   1.256  -9.019  -9.019
  876    H    TRP 109           H        TRP 109  -1.624  -5.911  -5.911
  877    HA   TRP 109           HA       TRP 109  -0.416  -3.674  -3.674
  878   1HB   TRP 109          2HB       TRP 109  -0.893  -2.091  -2.091
  879   2HB   TRP 109          1HB       TRP 109   0.411  -3.228  -3.228
  880    HD1  TRP 109           HD1      TRP 109   0.122  -4.894  -4.894
  881    HE1  TRP 109           HE1      TRP 109  -1.710  -5.261  -5.261
  882    HE3  TRP 109           HE3      TRP 109  -3.584  -1.958  -1.958
  883    HZ2  TRP 109           HZ2      TRP 109  -4.394  -4.421  -4.421
  884    HZ3  TRP 109           HZ3      TRP 109  -5.751  -1.766  -1.766
  885    HH2  TRP 109           HH2      TRP 109  -6.171  -2.984  -2.984
  886    H    THR 110           H        THR 110  -2.017  -1.736  -1.736
  887    HA   THR 110           HA       THR 110  -4.831  -2.719  -2.719
  888    HB   THR 110           HB       THR 110  -5.241  -1.854  -1.854
  889    HG1  THR 110           HG1      THR 110  -4.232   0.029   0.029
  890   1HG2  THR 110          2HG2      THR 110  -3.471  -3.889  -3.889
  891   2HG2  THR 110          1HG2      THR 110  -2.505  -2.783  -2.783
  892   3HG2  THR 110          3HG2      THR 110  -4.062  -3.358  -3.358
  893    H    MET 111           H        MET 111  -6.339  -0.770  -0.770
  894    HA   MET 111           HA       MET 111  -5.350   1.847   1.847
  895   1HB   MET 111          2HB       MET 111  -6.920   1.912   1.912
  896   2HB   MET 111          1HB       MET 111  -5.564   0.804   0.804
  897   1HG   MET 111          2HG       MET 111  -7.001  -1.078  -1.078
  898   2HG   MET 111          1HG       MET 111  -8.357   0.032   0.032
  899   1HE   MET 111          1HE       MET 111  -9.657   1.104   1.104
  900   2HE   MET 111          3HE       MET 111  -8.223   2.021   2.021
  901   3HE   MET 111          2HE       MET 111  -9.207   1.213   1.213
  902    H    GLU 112           H        GLU 112  -6.605   3.355   3.355
  903    HA   GLU 112           HA       GLU 112  -9.388   2.545   2.545
  904   1HB   GLU 112          2HB       GLU 112  -9.073   3.693   3.693
  905   2HB   GLU 112          1HB       GLU 112  -8.031   2.285   2.285
  906   1HG   GLU 112          2HG       GLU 112  -6.173   3.759   3.759
  907   2HG   GLU 112          1HG       GLU 112  -7.215   5.163   5.163
  908    H    LEU 113           H        LEU 113 -10.845   4.327   4.327
  909    HA   LEU 113           HA       LEU 113  -9.943   6.790   6.790
  910   1HB   LEU 113          2HB       LEU 113 -12.001   5.036   5.036
  911   2HB   LEU 113          1HB       LEU 113 -12.841   6.285   6.285
  912    HG   LEU 113           HG       LEU 113 -12.794   6.620   6.620
  913   1HD1  LEU 113          1HD1      LEU 113 -12.139   8.542   8.542
  914   2HD1  LEU 113          3HD1      LEU 113 -11.530   9.049   9.049
  915   3HD1  LEU 113          2HD1      LEU 113 -13.241   8.692   8.692
  916   1HD2  LEU 113          1HD2      LEU 113 -10.036   6.095   6.095
  917   2HD2  LEU 113          3HD2      LEU 113 -10.870   6.526   6.526
  918   3HD2  LEU 113          2HD2      LEU 113 -10.159   7.785   7.785
  919    H    THR 114           H        THR 114 -10.453   8.805   8.805
  920    HA   THR 114           HA       THR 114 -11.092   8.600   8.600
  921    HB   THR 114           HB       THR 114 -10.239  10.807  10.807
  922    HG1  THR 114           HG1      THR 114 -10.377  12.235  12.235
  923   1HG2  THR 114          3HG2      THR 114  -8.653   9.427   9.427
  924   2HG2  THR 114          2HG2      THR 114  -8.044  10.711  10.711
  925   3HG2  THR 114          1HG2      THR 114  -8.487   9.149   9.149
  926    H    ASN 115           H        ASN 115 -12.653  10.174  10.174
  927    HA   ASN 115           HA       ASN 115 -15.208   9.995   9.995
  928   1HB   ASN 115          2HB       ASN 115 -15.916  11.634  11.634
  929   2HB   ASN 115          1HB       ASN 115 -15.005  10.269  10.269
  930   1HD2  ASN 115          2HD2      ASN 115 -13.350  14.016  14.016
  931   2HD2  ASN 115          1HD2      ASN 115 -14.737  13.722  13.722
  932    H    ASP 116           H        ASP 116 -12.648  12.312  12.312
  933    HA   ASP 116           HA       ASP 116 -14.426  14.368  14.368
  934   1HB   ASP 116          2HB       ASP 116 -12.052  14.575  14.575
  935   2HB   ASP 116          1HB       ASP 116 -11.479  14.489  14.489
  936    H    GLY 117           H        GLY 117 -12.431  11.717  11.717
  937   1HA   GLY 117          2HA       GLY 117 -13.196  10.862  10.862
  938   2HA   GLY 117          1HA       GLY 117 -13.009  12.524  12.524
  939    H    GLU 118           H        GLU 118 -10.529  12.308  12.308
  940    HA   GLU 118           HA       GLU 118  -8.492  12.176  12.176
  941   1HB   GLU 118          2HB       GLU 118  -8.349  11.659  11.659
  942   2HB   GLU 118          1HB       GLU 118  -6.945  11.888  11.888
  943   1HG   GLU 118          2HG       GLU 118  -7.582  14.138  14.138
  944   2HG   GLU 118          1HG       GLU 118  -9.178  13.920  13.920
  945    H    LEU 119           H        LEU 119  -6.665  10.437  10.437
  946    HA   LEU 119           HA       LEU 119  -7.775   7.721   7.721
  947   1HB   LEU 119          2HB       LEU 119  -8.209   8.395   8.395
  948   2HB   LEU 119          1HB       LEU 119  -6.467   8.481   8.481
  949    HG   LEU 119           HG       LEU 119  -7.837   5.991   5.991
  950   1HD1  LEU 119          2HD1      LEU 119  -7.481   7.016   7.016
  951   2HD1  LEU 119          1HD1      LEU 119  -7.464   5.281   5.281
  952   3HD1  LEU 119          3HD1      LEU 119  -8.887   6.239   6.239
  953   1HD2  LEU 119          2HD2      LEU 119  -5.122   6.738   6.738
  954   2HD2  LEU 119          1HD2      LEU 119  -5.539   5.723   5.723
  955   3HD2  LEU 119          3HD2      LEU 119  -5.712   5.096   5.096
  956    H    ILE 120           H        ILE 120  -6.291   6.938   6.938
  957    HA   ILE 120           HA       ILE 120  -3.402   7.504   7.504
  958    HB   ILE 120           HB       ILE 120  -4.121   8.205   8.205
  959   1HG1  ILE 120          2HG1      ILE 120  -2.523   5.655   5.655
  960   2HG1  ILE 120          1HG1      ILE 120  -1.841   7.107   7.107
  961   1HG2  ILE 120          1HG2      ILE 120  -4.925   5.301   5.301
  962   2HG2  ILE 120          3HG2      ILE 120  -4.882   6.479   6.479
  963   3HG2  ILE 120          2HG2      ILE 120  -6.014   6.689   6.689
  964   1HD1  ILE 120          2HD1      ILE 120  -2.722   8.309   8.309
  965   2HD1  ILE 120          1HD1      ILE 120  -2.773   6.685   6.685
  966   3HD1  ILE 120          3HD1      ILE 120  -1.245   7.353   7.353
  967    H    LEU 121           H        LEU 121  -1.967   5.703   5.703
  968    HA   LEU 121           HA       LEU 121  -3.324   3.048   3.048
  969   1HB   LEU 121          2HB       LEU 121  -3.057   3.938   3.938
  970   2HB   LEU 121          1HB       LEU 121  -1.328   4.128   4.128
  971    HG   LEU 121           HG       LEU 121  -2.071   1.435   1.435
  972   1HD1  LEU 121          3HD1      LEU 121  -3.972   2.032   2.032
  973   2HD1  LEU 121          2HD1      LEU 121  -2.727   2.086   2.086
  974   3HD1  LEU 121          1HD1      LEU 121  -3.028   0.588   0.588
  975   1HD2  LEU 121          1HD2      LEU 121  -0.271   2.838   2.838
  976   2HD2  LEU 121          3HD2      LEU 121   0.128   1.689   1.689
  977   3HD2  LEU 121          2HD2      LEU 121  -0.562   1.116   1.116
  978    H    THR 122           H        THR 122  -2.212   1.474   1.474
  979    HA   THR 122           HA       THR 122   0.583   2.108   2.108
  980    HB   THR 122           HB       THR 122  -0.408  -0.118  -0.118
  981    HG1  THR 122           HG1      THR 122  -2.240   0.879   0.879
  982   1HG2  THR 122          1HG2      THR 122   1.224   1.585   1.585
  983   2HG2  THR 122          3HG2      THR 122  -0.067   2.784   2.784
  984   3HG2  THR 122          2HG2      THR 122  -0.098   1.402   1.402
  985    H    MET 123           H        MET 123   1.966   0.070   0.070
  986    HA   MET 123           HA       MET 123   1.106  -2.010  -2.010
  987   1HB   MET 123          2HB       MET 123   3.693  -0.445  -0.445
  988   2HB   MET 123          1HB       MET 123   3.211  -1.799  -1.799
  989   1HG   MET 123          2HG       MET 123   1.049  -0.324  -0.324
  990   2HG   MET 123          1HG       MET 123   2.128   0.991   0.991
  991   1HE   MET 123          2HE       MET 123   1.370  -1.946  -1.946
  992   2HE   MET 123          1HE       MET 123   0.670  -0.551  -0.551
  993   3HE   MET 123          3HE       MET 123   1.966  -1.476  -1.476
  994    H    THR 124           H        THR 124   2.643  -3.852  -3.852
  995    HA   THR 124           HA       THR 124   4.406  -4.024  -4.024
  996    HB   THR 124           HB       THR 124   2.370  -6.178  -6.178
  997    HG1  THR 124           HG1      THR 124   1.265  -5.184  -5.184
  998   1HG2  THR 124          2HG2      THR 124   4.434  -6.684  -6.684
  999   2HG2  THR 124          1HG2      THR 124   4.038  -5.375  -5.375
 1000   3HG2  THR 124          3HG2      THR 124   2.989  -6.789  -6.789
 1001    H    ALA 125           H        ALA 125   5.928  -5.705  -5.705
 1002    HA   ALA 125           HA       ALA 125   5.894  -7.481  -7.481
 1003   1HB   ALA 125          2HB       ALA 125   6.849  -5.094  -5.094
 1004   2HB   ALA 125          1HB       ALA 125   8.296  -5.697  -5.697
 1005   3HB   ALA 125          3HB       ALA 125   7.645  -6.553  -6.553
 1006    H    ASP 126           H        ASP 126   6.138  -9.190  -9.190
 1007    HA   ASP 126           HA       ASP 126   7.382 -10.793 -10.793
 1008   1HB   ASP 126          2HB       ASP 126   9.401  -9.181  -9.181
 1009   2HB   ASP 126          1HB       ASP 126   9.860  -9.401  -9.401
 1010    H    ASP 127           H        ASP 127   8.957  -7.890  -7.890
 1011    HA   ASP 127           HA       ASP 127   7.190  -7.996  -7.996
 1012   1HB   ASP 127          2HB       ASP 127   9.115  -9.544  -9.544
 1013   2HB   ASP 127          1HB       ASP 127  10.204  -8.169  -8.169
 1014    H    VAL 128           H        VAL 128   7.890  -6.173  -6.173
 1015    HA   VAL 128           HA       VAL 128   8.697  -3.792  -3.792
 1016    HB   VAL 128           HB       VAL 128   9.553  -2.811  -2.811
 1017   1HG1  VAL 128          2HG1      VAL 128  10.509  -5.581  -5.581
 1018   2HG1  VAL 128          1HG1      VAL 128  11.317  -4.632  -4.632
 1019   3HG1  VAL 128          3HG1      VAL 128  11.236  -4.027  -4.027
 1020   1HG2  VAL 128          3HG2      VAL 128   8.059  -5.065  -5.065
 1021   2HG2  VAL 128          2HG2      VAL 128   8.505  -3.517  -3.517
 1022   3HG2  VAL 128          1HG2      VAL 128   9.665  -4.845  -4.845
 1023    H    VAL 129           H        VAL 129   7.762  -1.767  -1.767
 1024    HA   VAL 129           HA       VAL 129   5.159  -2.314  -2.314
 1025    HB   VAL 129           HB       VAL 129   5.468  -1.423  -1.423
 1026   1HG1  VAL 129          1HG1      VAL 129   3.355  -0.331  -0.331
 1027   2HG1  VAL 129          3HG1      VAL 129   3.089  -0.453  -0.453
 1028   3HG1  VAL 129          2HG1      VAL 129   4.384   0.568   0.568
 1029   1HG2  VAL 129          1HG2      VAL 129   3.787  -3.266  -3.266
 1030   2HG2  VAL 129          3HG2      VAL 129   4.566  -3.528  -3.528
 1031   3HG2  VAL 129          2HG2      VAL 129   3.070  -2.600  -2.600
 1032    H    CYS 130           H        CYS 130   5.060  -0.920  -0.920
 1033    HA   CYS 130           HA       CYS 130   6.497   1.672   1.672
 1034   1HB   CYS 130          2HB       CYS 130   6.669  -0.036  -0.036
 1035   2HB   CYS 130          1HB       CYS 130   5.161   0.714   0.714
 1036    HG   CYS 130           HG       CYS 130   7.864   1.956   1.956
 1037    H    THR 131           H        THR 131   5.240   3.321   3.321
 1038    HA   THR 131           HA       THR 131   2.332   3.313   3.313
 1039    HB   THR 131           HB       THR 131   3.792   4.873   4.873
 1040    HG1  THR 131           HG1      THR 131   2.839   3.355   3.355
 1041   1HG2  THR 131          3HG2      THR 131   1.698   5.916   5.916
 1042   2HG2  THR 131          2HG2      THR 131   0.829   4.438   4.438
 1043   3HG2  THR 131          1HG2      THR 131   1.563   5.415   5.415
 1044    H    ARG 132           H        ARG 132   1.447   5.098   5.098
 1045    HA   ARG 132           HA       ARG 132   3.063   7.491   7.491
 1046   1HB   ARG 132          2HB       ARG 132   1.894   5.781   5.781
 1047   2HB   ARG 132          1HB       ARG 132   2.725   7.322   7.322
 1048   1HG   ARG 132          2HG       ARG 132   4.698   6.180   6.180
 1049   2HG   ARG 132          1HG       ARG 132   3.869   4.670   4.670
 1050   1HD   ARG 132          2HD       ARG 132   3.774   5.913   5.913
 1051   2HD   ARG 132          1HD       ARG 132   5.297   6.541   6.541
 1052    HE   ARG 132           HE       ARG 132   5.378   3.783   3.783
 1053   1HH1  ARG 132          1HH2      ARG 132   3.893   3.365   3.365
 1054   2HH1  ARG 132          2HH2      ARG 132   5.120   3.415   3.415
 1055   1HH2  ARG 132          2HH1      ARG 132   7.462   4.953   4.953
 1056   2HH2  ARG 132          1HH1      ARG 132   7.141   4.313   4.313
 1057    H    VAL 133           H        VAL 133   1.568   8.904   8.904
 1058    HA   VAL 133           HA       VAL 133  -1.288   8.491   8.491
 1059    HB   VAL 133           HB       VAL 133   0.236  11.035  11.035
 1060   1HG1  VAL 133          3HG1      VAL 133  -2.150  11.383  11.383
 1061   2HG1  VAL 133          2HG1      VAL 133  -2.608  10.213  10.213
 1062   3HG1  VAL 133          1HG1      VAL 133  -1.840  11.731  11.731
 1063   1HG2  VAL 133          1HG2      VAL 133   0.494   8.791   8.791
 1064   2HG2  VAL 133          3HG2      VAL 133   0.402  10.369  10.369
 1065   3HG2  VAL 133          2HG2      VAL 133  -1.033   9.348   9.348
 1066    H    TYR 134           H        TYR 134  -2.679   9.118   9.118
 1067    HA   TYR 134           HA       TYR 134  -1.524  10.785  10.785
 1068   1HB   TYR 134          2HB       TYR 134  -3.281   8.348   8.348
 1069   2HB   TYR 134          1HB       TYR 134  -3.352   9.534   9.534
 1070    HD1  TYR 134           HD2      TYR 134  -1.418   9.981   9.981
 1071    HD2  TYR 134           HD1      TYR 134  -1.274   6.998   6.998
 1072    HE1  TYR 134           HE2      TYR 134   0.641   9.043   9.043
 1073    HE2  TYR 134           HE1      TYR 134   0.786   6.051   6.051
 1074    HH   TYR 134           HH       TYR 134   1.878   6.013   6.013
 1075    H    VAL 135           H        VAL 135  -2.544  12.665  12.665
 1076    HA   VAL 135           HA       VAL 135  -5.341  12.897  12.897
 1077    HB   VAL 135           HB       VAL 135  -3.086  14.511  14.511
 1078   1HG1  VAL 135          3HG1      VAL 135  -3.464  15.547  15.547
 1079   2HG1  VAL 135          2HG1      VAL 135  -5.035  16.098  16.098
 1080   3HG1  VAL 135          1HG1      VAL 135  -3.558  16.687  16.687
 1081   1HG2  VAL 135          3HG2      VAL 135  -5.282  14.106  14.106
 1082   2HG2  VAL 135          2HG2      VAL 135  -4.568  15.715  15.715
 1083   3HG2  VAL 135          1HG2      VAL 135  -5.938  15.434  15.434
 1084    H    ARG 136           H        ARG 136  -6.955  13.530  13.530
 1085    HA   ARG 136           HA       ARG 136  -6.670  12.874  12.874
 1086   1HB   ARG 136          2HB       ARG 136  -8.670  14.158  14.158
 1087   2HB   ARG 136          1HB       ARG 136  -8.564  14.968  14.968
 1088   1HG   ARG 136          2HG       ARG 136  -9.152  13.077  13.077
 1089   2HG   ARG 136          1HG       ARG 136  -8.569  11.979  11.979
 1090   1HD   ARG 136          2HD       ARG 136 -11.105  13.637  13.637
 1091   2HD   ARG 136          1HD       ARG 136 -10.980  11.879  11.879
 1092    HE   ARG 136           HE       ARG 136  -9.614  12.646  12.646
 1093   1HH1  ARG 136          1HH2      ARG 136 -12.454  11.300  11.300
 1094   2HH1  ARG 136          2HH2      ARG 136 -13.381  12.220  12.220
 1095   1HH2  ARG 136          2HH1      ARG 136 -10.932  14.636  14.636
 1096   2HH2  ARG 136          1HH1      ARG 136 -12.519  14.110  14.110
 1097    H    GLU 137           HN       GLU 137  -5.738  13.732  13.732
 1098    HA   GLU 137           HA       GLU 137  -3.997  15.913  15.913
 1099   1HB   GLU 137          2HB       GLU 137  -4.054  14.186  14.186
 1100   2HB   GLU 137          1HB       GLU 137  -5.595  14.820  14.820
 1101   1HG   GLU 137          2HG       GLU 137  -4.563  16.343  16.343
 1102   2HG   GLU 137          1HG       GLU 137  -3.724  16.983  16.983

  Start of MODEL    5
    1   1H    PRO   1          1H        PRO   1 -16.056   7.620   7.620
    2   2H    PRO   1          2H        PRO   1 -15.507   6.763   6.763
    3    HA   PRO   1           HA       PRO   1 -15.884   4.827   4.827
    4   1HB   PRO   1          2HB       PRO   1 -18.574   5.088   5.088
    5   2HB   PRO   1          1HB       PRO   1 -18.010   4.217   4.217
    6   1HG   PRO   1          2HG       PRO   1 -19.459   6.685   6.685
    7   2HG   PRO   1          1HG       PRO   1 -18.903   5.802   5.802
    8   1HD   PRO   1          1HD       PRO   1 -17.869   8.250   8.250
    9   2HD   PRO   1          2HD       PRO   1 -17.305   7.352   7.352
   10    H    ASN   2           H        ASN   2 -14.735   6.841   6.841
   11    HA   ASN   2           HA       ASN   2 -15.432   5.782   5.782
   12   1HB   ASN   2          2HB       ASN   2 -16.083   8.507   8.507
   13   2HB   ASN   2          1HB       ASN   2 -15.180   8.461   8.461
   14   1HD2  ASN   2          1HD2      ASN   2 -17.240   9.232   9.232
   15   2HD2  ASN   2          2HD2      ASN   2 -18.459   8.104   8.104
   16    H    PHE   3           H        PHE   3 -13.569   5.361   5.361
   17    HA   PHE   3           HA       PHE   3 -11.058   6.594   6.594
   18   1HB   PHE   3          2HB       PHE   3 -11.583   4.235   4.235
   19   2HB   PHE   3          1HB       PHE   3  -9.989   4.802   4.802
   20    HD1  PHE   3           HD1      PHE   3 -13.231   3.916   3.916
   21    HD2  PHE   3           HD2      PHE   3  -8.944   3.612   3.612
   22    HE1  PHE   3           HE1      PHE   3 -13.322   2.504   2.504
   23    HE2  PHE   3           HE2      PHE   3  -9.045   2.194   2.194
   24    HZ   PHE   3           HZ       PHE   3 -11.233   1.633   1.633
   25    H    SER   4           H        SER   4 -13.324   6.873   6.873
   26    HA   SER   4           HA       SER   4 -11.580   7.441   7.441
   27   1HB   SER   4          2HB       SER   4 -14.165   6.971   6.971
   28   2HB   SER   4          1HB       SER   4 -14.279   8.722   8.722
   29    HG   SER   4           HG       SER   4 -14.199   7.638   7.638
   30    H    GLY   5           H        GLY   5 -10.221   9.083   9.083
   31   1HA   GLY   5          2HA       GLY   5 -10.758  11.776  11.776
   32   2HA   GLY   5          1HA       GLY   5 -10.411  11.497  11.497
   33    H    ASN   6           H        ASN   6  -8.528  13.029  13.029
   34    HA   ASN   6           HA       ASN   6  -6.337  11.434  11.434
   35   1HB   ASN   6          2HB       ASN   6  -6.844  14.358  14.358
   36   2HB   ASN   6          1HB       ASN   6  -5.176  13.797  13.797
   37   1HD2  ASN   6          2HD2      ASN   6  -5.899  12.563  12.563
   38   2HD2  ASN   6          1HD2      ASN   6  -5.301  11.889  11.889
   39    H    TRP   7           H        TRP   7  -4.159  11.788  11.788
   40    HA   TRP   7           HA       TRP   7  -4.653  12.007  12.007
   41   1HB   TRP   7          2HB       TRP   7  -3.713   9.472   9.472
   42   2HB   TRP   7          1HB       TRP   7  -3.658   9.741   9.741
   43    HD1  TRP   7           HD1      TRP   7  -5.977   8.768   8.768
   44    HE1  TRP   7           HE1      TRP   7  -8.381   8.481   8.481
   45    HE3  TRP   7           HE3      TRP   7  -5.338  10.742  10.742
   46    HZ2  TRP   7           HZ2      TRP   7  -9.830   9.056   9.056
   47    HZ3  TRP   7           HZ3      TRP   7  -7.236  10.904  10.904
   48    HH2  TRP   7           HH2      TRP   7  -9.463  10.054  10.054
   49    H    LYS   8           H        LYS   8  -3.005  12.949  12.949
   50    HA   LYS   8           HA       LYS   8  -0.283  12.718  12.718
   51   1HB   LYS   8          2HB       LYS   8  -1.778  15.103  15.103
   52   2HB   LYS   8          1HB       LYS   8  -0.050  15.023  15.023
   53   1HG   LYS   8          2HG       LYS   8  -0.873  14.351  14.351
   54   2HG   LYS   8          1HG       LYS   8  -1.016  16.044  16.044
   55   1HD   LYS   8          2HD       LYS   8   1.275  16.272  16.272
   56   2HD   LYS   8          1HD       LYS   8   1.504  14.543  14.543
   57   1HE   LYS   8          2HE       LYS   8   1.269  14.067  14.067
   58   2HE   LYS   8          1HE       LYS   8   0.715  15.706  15.706
   59   1HZ   LYS   8          3HZ       LYS   8   3.382  15.125  15.125
   60   2HZ   LYS   8          2HZ       LYS   8   3.107  15.224  15.224
   61   3HZ   LYS   8          1HZ       LYS   8   2.835  16.578  16.578
   62    H    ILE   9           H        ILE   9   0.921  11.531  11.531
   63    HA   ILE   9           HA       ILE   9   0.210  10.747  10.747
   64    HB   ILE   9           HB       ILE   9   1.782   9.505   9.505
   65   1HG1  ILE   9          2HG1      ILE   9   3.115  10.580  10.580
   66   2HG1  ILE   9          1HG1      ILE   9   1.953   9.255   9.255
   67   1HG2  ILE   9          1HG2      ILE   9   3.509  11.972  11.972
   68   2HG2  ILE   9          3HG2      ILE   9   4.133  10.427  10.427
   69   3HG2  ILE   9          2HG2      ILE   9   2.901  11.284  11.284
   70   1HD1  ILE   9          2HD1      ILE   9   3.540   8.072   8.072
   71   2HD1  ILE   9          1HD1      ILE   9   4.726   9.322   9.322
   72   3HD1  ILE   9          3HD1      ILE   9   4.139   8.252   8.252
   73    H    ILE  10           H        ILE  10   0.745  11.506  11.506
   74    HA   ILE  10           HA       ILE  10   2.171  14.129  14.129
   75    HB   ILE  10           HB       ILE  10   0.732  14.716  14.716
   76   1HG1  ILE  10          2HG1      ILE  10  -1.407  12.998  12.998
   77   2HG1  ILE  10          1HG1      ILE  10  -0.072  11.880  11.880
   78   1HG2  ILE  10          3HG2      ILE  10  -0.732  13.812  13.812
   79   2HG2  ILE  10          2HG2      ILE  10  -1.429  14.873  14.873
   80   3HG2  ILE  10          1HG2      ILE  10  -0.024  15.400  15.400
   81   1HD1  ILE  10          1HD1      ILE  10   1.068  13.187  13.187
   82   2HD1  ILE  10          3HD1      ILE  10  -0.583  13.671  13.671
   83   3HD1  ILE  10          2HD1      ILE  10  -0.148  11.963  11.963
   84    H    ARG  11           H        ARG  11   1.863  10.902  10.902
   85    HA   ARG  11           HA       ARG  11   4.276  11.417  11.417
   86   1HB   ARG  11          2HB       ARG  11   1.585  10.855  10.855
   87   2HB   ARG  11          1HB       ARG  11   2.783   9.705   9.705
   88   1HG   ARG  11          2HG       ARG  11   4.225  11.858  11.858
   89   2HG   ARG  11          1HG       ARG  11   2.665  12.681  12.681
   90   1HD   ARG  11          2HD       ARG  11   1.864  11.558  11.558
   91   2HD   ARG  11          1HD       ARG  11   2.973  10.204  10.204
   92    HE   ARG  11           HE       ARG  11   4.381  12.676  12.676
   93   1HH1  ARG  11          2HH1      ARG  11   5.263  10.045  10.045
   94   2HH1  ARG  11          1HH1      ARG  11   4.835  10.137  10.137
   95   1HH2  ARG  11          1HH2      ARG  11   2.668  12.810  12.810
   96   2HH2  ARG  11          2HH2      ARG  11   3.366  11.703  11.703
   97    H    SER  12           H        SER  12   5.023   9.200   9.200
   98    HA   SER  12           HA       SER  12   4.335   6.718   6.718
   99   1HB   SER  12          2HB       SER  12   5.072   7.480   7.480
  100   2HB   SER  12          1HB       SER  12   6.453   8.324   8.324
  101    HG   SER  12           HG       SER  12   7.514   6.474   6.474
  102    H    GLU  13           H        GLU  13   6.083   5.045   5.045
  103    HA   GLU  13           HA       GLU  13   8.271   5.975   5.975
  104   1HB   GLU  13          2HB       GLU  13   7.440   4.715   4.715
  105   2HB   GLU  13          1HB       GLU  13   6.433   6.101   6.101
  106   1HG   GLU  13          2HG       GLU  13   5.552   3.738   3.738
  107   2HG   GLU  13          1HG       GLU  13   5.595   3.422   3.422
  108    H    ASN  14           H        ASN  14   7.739   4.146   4.146
  109    HA   ASN  14           HA       ASN  14   9.579   2.039   2.039
  110   1HB   ASN  14          2HB       ASN  14   6.733   1.441   1.441
  111   2HB   ASN  14          1HB       ASN  14   7.991   0.234   0.234
  112   1HD2  ASN  14          2HD2      ASN  14   6.277   0.446   0.446
  113   2HD2  ASN  14          1HD2      ASN  14   5.572   0.753   0.753
  114    H    PHE  15           H        PHE  15   9.290   4.225   4.225
  115    HA   PHE  15           HA       PHE  15   8.806   3.056   3.056
  116   1HB   PHE  15          2HB       PHE  15   8.965   5.544   5.544
  117   2HB   PHE  15          1HB       PHE  15  10.705   5.333   5.333
  118    HD1  PHE  15           HD2      PHE  15   9.876   3.085   3.085
  119    HD2  PHE  15           HD1      PHE  15   9.744   7.315   7.315
  120    HE1  PHE  15           HE2      PHE  15   9.954   3.476   3.476
  121    HE2  PHE  15           HE1      PHE  15   9.811   7.700   7.700
  122    HZ   PHE  15           HZ       PHE  15   9.912   5.769   5.769
  123    H    GLU  16           H        GLU  16  11.967   4.009   4.009
  124    HA   GLU  16           HA       GLU  16  13.549   2.703   2.703
  125   1HB   GLU  16          2HB       GLU  16  14.288   4.377   4.377
  126   2HB   GLU  16          1HB       GLU  16  14.318   3.029   3.029
  127   1HG   GLU  16          2HG       GLU  16  16.028   1.908   1.908
  128   2HG   GLU  16          1HG       GLU  16  15.783   2.896   2.896
  129    H    GLU  17           H        GLU  17  11.998   1.361   1.361
  130    HA   GLU  17           HA       GLU  17  13.598  -1.046  -1.046
  131   1HB   GLU  17          2HB       GLU  17  12.000  -1.992  -1.992
  132   2HB   GLU  17          1HB       GLU  17  12.517  -0.377  -0.377
  133   1HG   GLU  17          2HG       GLU  17  10.483   0.590   0.590
  134   2HG   GLU  17          1HG       GLU  17  10.022  -0.777  -0.777
  135    H    LEU  18           H        LEU  18  10.574  -0.078  -0.078
  136    HA   LEU  18           HA       LEU  18   9.889  -2.763  -2.763
  137   1HB   LEU  18          2HB       LEU  18   8.249  -0.828  -0.828
  138   2HB   LEU  18          1HB       LEU  18   8.978  -0.143  -0.143
  139    HG   LEU  18           HG       LEU  18   8.494  -2.298  -2.298
  140   1HD1  LEU  18          3HD1      LEU  18   7.202  -2.883  -2.883
  141   2HD1  LEU  18          2HD1      LEU  18   6.643  -3.670  -3.670
  142   3HD1  LEU  18          1HD1      LEU  18   8.306  -3.891  -3.891
  143   1HD2  LEU  18          2HD2      LEU  18   6.837  -0.150  -0.150
  144   2HD2  LEU  18          1HD2      LEU  18   6.494  -1.454  -1.454
  145   3HD2  LEU  18          3HD2      LEU  18   5.815  -1.500  -1.500
  146    H    LEU  19           H        LEU  19  12.059  -0.302  -0.302
  147    HA   LEU  19           HA       LEU  19  12.089  -1.427  -1.427
  148   1HB   LEU  19          2HB       LEU  19  13.985   0.673   0.673
  149   2HB   LEU  19          1HB       LEU  19  13.488   0.398   0.398
  150    HG   LEU  19           HG       LEU  19  11.912   1.652   1.652
  151   1HD1  LEU  19          2HD1      LEU  19  13.430   2.681   2.681
  152   2HD1  LEU  19          1HD1      LEU  19  11.764   2.860   2.860
  153   3HD1  LEU  19          3HD1      LEU  19  12.266   3.558   3.558
  154   1HD2  LEU  19          1HD2      LEU  19  10.452  -0.054  -0.054
  155   2HD2  LEU  19          3HD2      LEU  19   9.891   1.605   1.605
  156   3HD2  LEU  19          2HD2      LEU  19  10.742   0.816   0.816
  157    H    LYS  20           H        LYS  20  13.736  -1.858  -1.858
  158    HA   LYS  20           HA       LYS  20  16.150  -3.024  -3.024
  159   1HB   LYS  20          2HB       LYS  20  15.392  -3.455  -3.455
  160   2HB   LYS  20          1HB       LYS  20  16.994  -3.315  -3.315
  161   1HG   LYS  20          2HG       LYS  20  15.740  -0.854  -0.854
  162   2HG   LYS  20          1HG       LYS  20  15.296  -1.249  -1.249
  163   1HD   LYS  20          2HD       LYS  20  18.120  -1.201  -1.201
  164   2HD   LYS  20          1HD       LYS  20  17.397   0.044   0.044
  165   1HE   LYS  20          2HE       LYS  20  16.895  -2.162  -2.162
  166   2HE   LYS  20          1HE       LYS  20  18.413  -2.636  -2.636
  167   1HZ   LYS  20          1HZ       LYS  20  18.123   0.044   0.044
  168   2HZ   LYS  20          3HZ       LYS  20  18.473  -1.289  -1.289
  169   3HZ   LYS  20          2HZ       LYS  20  19.534  -0.863  -0.863
  170    H    VAL  21           H        VAL  21  13.090  -4.002  -4.002
  171    HA   VAL  21           HA       VAL  21  13.670  -6.843  -6.843
  172    HB   VAL  21           HB       VAL  21  11.937  -5.695  -5.695
  173   1HG1  VAL  21          2HG1      VAL  21  11.125  -4.159  -4.159
  174   2HG1  VAL  21          1HG1      VAL  21  10.361  -5.517  -5.517
  175   3HG1  VAL  21          3HG1      VAL  21   9.823  -5.032  -5.032
  176   1HG2  VAL  21          1HG2      VAL  21  11.901  -8.181  -8.181
  177   2HG2  VAL  21          3HG2      VAL  21  10.394  -7.503  -7.503
  178   3HG2  VAL  21          2HG2      VAL  21  10.619  -7.724  -7.724
  179    H    LEU  22           H        LEU  22  12.084  -4.604  -4.604
  180    HA   LEU  22           HA       LEU  22  11.161  -6.501  -6.501
  181   1HB   LEU  22          2HB       LEU  22  11.463  -3.573  -3.573
  182   2HB   LEU  22          1HB       LEU  22  11.559  -4.144  -4.144
  183    HG   LEU  22           HG       LEU  22   9.382  -5.182  -5.182
  184   1HD1  LEU  22          1HD1      LEU  22   9.635  -5.923  -5.923
  185   2HD1  LEU  22          3HD1      LEU  22   9.310  -4.266  -4.266
  186   3HD1  LEU  22          2HD1      LEU  22   8.073  -5.187  -5.187
  187   1HD2  LEU  22          1HD2      LEU  22   9.767  -2.558  -2.558
  188   2HD2  LEU  22          3HD2      LEU  22   8.136  -3.221  -3.221
  189   3HD2  LEU  22          2HD2      LEU  22   8.936  -2.588  -2.588
  190    H    GLY  23           H        GLY  23  14.011  -4.439  -4.439
  191   1HA   GLY  23          2HA       GLY  23  15.215  -5.804  -5.804
  192   2HA   GLY  23          1HA       GLY  23  15.770  -4.279  -4.279
  193    H    VAL  24           H        VAL  24  17.900  -5.260  -5.260
  194    HA   VAL  24           HA       VAL  24  18.471  -6.750  -6.750
  195    HB   VAL  24           HB       VAL  24  19.588  -7.589  -7.589
  196   1HG1  VAL  24          3HG1      VAL  24  19.840  -8.645  -8.645
  197   2HG1  VAL  24          2HG1      VAL  24  20.270  -9.604  -9.604
  198   3HG1  VAL  24          1HG1      VAL  24  21.134  -8.106  -8.106
  199   1HG2  VAL  24          2HG2      VAL  24  17.367  -8.745  -8.745
  200   2HG2  VAL  24          1HG2      VAL  24  17.266  -8.212  -8.212
  201   3HG2  VAL  24          3HG2      VAL  24  18.182  -9.661  -9.661
  202    H    ASN  25           H        ASN  25  19.774  -5.029  -5.029
  203    HA   ASN  25           HA       ASN  25  22.403  -4.576  -4.576
  204   1HB   ASN  25          2HB       ASN  25  21.117  -4.032  -4.032
  205   2HB   ASN  25          1HB       ASN  25  21.098  -2.437  -2.437
  206   1HD2  ASN  25          2HD2      ASN  25  24.436  -1.817  -1.817
  207   2HD2  ASN  25          1HD2      ASN  25  22.912  -1.210  -1.210
  208    H    VAL  26           H        VAL  26  22.692  -1.755  -1.755
  209    HA   VAL  26           HA       VAL  26  21.215  -1.018  -1.018
  210    HB   VAL  26           HB       VAL  26  23.855   0.204   0.204
  211   1HG1  VAL  26          2HG1      VAL  26  22.346   1.024   1.024
  212   2HG1  VAL  26          1HG1      VAL  26  22.664  -0.507  -0.507
  213   3HG1  VAL  26          3HG1      VAL  26  23.990   0.609   0.609
  214   1HG2  VAL  26          1HG2      VAL  26  23.372  -2.552  -2.552
  215   2HG2  VAL  26          3HG2      VAL  26  24.581  -2.021  -2.021
  216   3HG2  VAL  26          2HG2      VAL  26  24.775  -1.631  -1.631
  217    H    MET  27           H        MET  27  22.816   0.346   0.346
  218    HA   MET  27           HA       MET  27  21.615   2.957   2.957
  219   1HB   MET  27          2HB       MET  27  23.639   2.091   2.091
  220   2HB   MET  27          1HB       MET  27  22.362   1.873   1.873
  221   1HG   MET  27          2HG       MET  27  21.856   4.155   4.155
  222   2HG   MET  27          1HG       MET  27  22.555   4.460   4.460
  223   1HE   MET  27          2HE       MET  27  22.532   5.329   5.329
  224   2HE   MET  27          1HE       MET  27  24.136   5.885   5.885
  225   3HE   MET  27          3HE       MET  27  23.584   4.268   4.268
  226    H    LEU  28           H        LEU  28  20.595  -0.073  -0.073
  227    HA   LEU  28           HA       LEU  28  18.530   0.751   0.751
  228   1HB   LEU  28          2HB       LEU  28  19.377  -1.661  -1.661
  229   2HB   LEU  28          1HB       LEU  28  17.637  -1.599  -1.599
  230    HG   LEU  28           HG       LEU  28  18.754  -2.712  -2.712
  231   1HD1  LEU  28          1HD1      LEU  28  17.140  -0.286  -0.286
  232   2HD1  LEU  28          3HD1      LEU  28  18.117  -0.583  -0.583
  233   3HD1  LEU  28          2HD1      LEU  28  16.999  -1.818  -1.818
  234   1HD2  LEU  28          2HD2      LEU  28  20.834  -1.073  -1.073
  235   2HD2  LEU  28          1HD2      LEU  28  20.561  -1.840  -1.840
  236   3HD2  LEU  28          3HD2      LEU  28  20.055  -0.171  -0.171
  237    H    ARG  29           H        ARG  29  18.666   0.900   0.900
  238    HA   ARG  29           HA       ARG  29  15.725   1.077   1.077
  239   1HB   ARG  29          2HB       ARG  29  17.791   1.460   1.460
  240   2HB   ARG  29          1HB       ARG  29  16.081   1.086   1.086
  241   1HG   ARG  29          2HG       ARG  29  16.631  -1.101  -1.101
  242   2HG   ARG  29          1HG       ARG  29  17.087  -0.956  -0.956
  243   1HD   ARG  29          2HD       ARG  29  19.308  -1.008  -1.008
  244   2HD   ARG  29          1HD       ARG  29  19.130   0.050   0.050
  245    HE   ARG  29           HE       ARG  29  18.110  -2.661  -2.661
  246   1HH1  ARG  29          2HH1      ARG  29  19.903  -0.266  -0.266
  247   2HH1  ARG  29          1HH1      ARG  29  21.158  -1.281  -1.281
  248   1HH2  ARG  29          1HH2      ARG  29  20.115  -4.098  -4.098
  249   2HH2  ARG  29          2HH2      ARG  29  21.277  -3.449  -3.449
  250    H    LYS  30           H        LYS  30  18.584   3.102   3.102
  251    HA   LYS  30           HA       LYS  30  17.141   5.434   5.434
  252   1HB   LYS  30          2HB       LYS  30  19.600   5.031   5.031
  253   2HB   LYS  30          1HB       LYS  30  19.855   5.370   5.370
  254   1HG   LYS  30          2HG       LYS  30  19.406   7.613   7.613
  255   2HG   LYS  30          1HG       LYS  30  18.258   7.353   7.353
  256   1HD   LYS  30          2HD       LYS  30  20.525   6.514   6.514
  257   2HD   LYS  30          1HD       LYS  30  21.206   7.706   7.706
  258   1HE   LYS  30          2HE       LYS  30  19.218   9.206   9.206
  259   2HE   LYS  30          1HE       LYS  30  19.262   8.105   8.105
  260   1HZ   LYS  30          2HZ       LYS  30  21.762   9.290   9.290
  261   2HZ   LYS  30          1HZ       LYS  30  20.736  10.215  10.215
  262   3HZ   LYS  30          3HZ       LYS  30  21.373   8.752   8.752
  263    H    ILE  31           H        ILE  31  17.682   4.050   4.050
  264    HA   ILE  31           HA       ILE  31  17.261   6.560   6.560
  265    HB   ILE  31           HB       ILE  31  17.078   3.693   3.693
  266   1HG1  ILE  31          2HG1      ILE  31  19.364   5.532   5.532
  267   2HG1  ILE  31          1HG1      ILE  31  19.307   4.774   4.774
  268   1HG2  ILE  31          3HG2      ILE  31  16.995   6.395   6.395
  269   2HG2  ILE  31          2HG2      ILE  31  17.658   5.014   5.014
  270   3HG2  ILE  31          1HG2      ILE  31  15.989   4.979   4.979
  271   1HD1  ILE  31          3HD1      ILE  31  18.753   2.620   2.620
  272   2HD1  ILE  31          2HD1      ILE  31  19.732   3.539   3.539
  273   3HD1  ILE  31          1HD1      ILE  31  20.401   3.086   3.086
  274    H    ALA  32           H        ALA  32  15.293   3.949   3.949
  275    HA   ALA  32           HA       ALA  32  12.885   4.797   4.797
  276   1HB   ALA  32          2HB       ALA  32  13.445   2.751   2.751
  277   2HB   ALA  32          1HB       ALA  32  11.806   3.114   3.114
  278   3HB   ALA  32          3HB       ALA  32  12.986   2.464   2.464
  279    H    VAL  33           H        VAL  33  14.465   5.429   5.429
  280    HA   VAL  33           HA       VAL  33  12.149   6.577   6.577
  281    HB   VAL  33           HB       VAL  33  15.064   7.071   7.071
  282   1HG1  VAL  33          1HG1      VAL  33  12.913   8.212   8.212
  283   2HG1  VAL  33          3HG1      VAL  33  12.888   6.711   6.711
  284   3HG1  VAL  33          2HG1      VAL  33  14.307   7.756   7.756
  285   1HG2  VAL  33          1HG2      VAL  33  13.996   4.538   4.538
  286   2HG2  VAL  33          3HG2      VAL  33  15.331   4.969   4.969
  287   3HG2  VAL  33          2HG2      VAL  33  13.686   4.911   4.911
  288    H    ALA  34           H        ALA  34  14.892   7.699   7.699
  289    HA   ALA  34           HA       ALA  34  14.254  10.520  10.520
  290   1HB   ALA  34          1HB       ALA  34  16.575   9.587   9.587
  291   2HB   ALA  34          3HB       ALA  34  16.013   9.259   9.259
  292   3HB   ALA  34          2HB       ALA  34  16.077  10.918  10.918
  293    H    ALA  35           H        ALA  35  13.644   7.968   7.968
  294    HA   ALA  35           HA       ALA  35  12.575   9.572   9.572
  295   1HB   ALA  35          1HB       ALA  35  11.964   6.705   6.705
  296   2HB   ALA  35          3HB       ALA  35  11.518   7.447   7.447
  297   3HB   ALA  35          2HB       ALA  35  13.218   7.220   7.220
  298    H    ALA  36           H        ALA  36  11.131   8.037   8.037
  299    HA   ALA  36           HA       ALA  36   8.415   8.654   8.654
  300   1HB   ALA  36          1HB       ALA  36   9.944   7.698   7.698
  301   2HB   ALA  36          3HB       ALA  36   8.554   8.680   8.680
  302   3HB   ALA  36          2HB       ALA  36   8.329   7.241   7.241
  303    H    SER  37           H        SER  37  10.428  10.214  10.214
  304    HA   SER  37           HA       SER  37  10.354  12.411  12.411
  305   1HB   SER  37          2HB       SER  37  11.156  12.553  12.553
  306   2HB   SER  37          1HB       SER  37   9.658  13.468  13.468
  307    HG   SER  37           HG       SER  37  11.366  14.838  14.838
  308    H    LYS  38           H        LYS  38   8.039  11.172  11.172
  309    HA   LYS  38           HA       LYS  38   5.799  11.589  11.589
  310   1HB   LYS  38          2HB       LYS  38   6.116  14.362  14.362
  311   2HB   LYS  38          1HB       LYS  38   4.985  13.840  13.840
  312   1HG   LYS  38          2HG       LYS  38   7.339  13.188  13.188
  313   2HG   LYS  38          1HG       LYS  38   7.846  14.583  14.583
  314   1HD   LYS  38          2HD       LYS  38   5.316  14.744  14.744
  315   2HD   LYS  38          1HD       LYS  38   6.870  14.943  14.943
  316   1HE   LYS  38          2HE       LYS  38   6.934  16.508  16.508
  317   2HE   LYS  38          1HE       LYS  38   5.428  16.867  16.867
  318   1HZ   LYS  38          3HZ       LYS  38   7.957  16.736  16.736
  319   2HZ   LYS  38          2HZ       LYS  38   7.561  18.141  18.141
  320   3HZ   LYS  38          1HZ       LYS  38   6.537  17.588  17.588
  321    HA   PRO  39           HA       PRO  39   5.053  10.838  10.838
  322   1HB   PRO  39          2HB       PRO  39   4.059   8.289   8.289
  323   2HB   PRO  39          1HB       PRO  39   5.762   8.664   8.664
  324   1HG   PRO  39          2HG       PRO  39   4.433   7.855   7.855
  325   2HG   PRO  39          1HG       PRO  39   6.111   7.616   7.616
  326   1HD   PRO  39          2HD       PRO  39   5.237   9.576   9.576
  327   2HD   PRO  39          1HD       PRO  39   6.798   9.576   9.576
  328    H    ALA  40           H        ALA  40   2.975  10.689  10.689
  329    HA   ALA  40           HA       ALA  40   0.704  11.359  11.359
  330   1HB   ALA  40          3HB       ALA  40   1.510  12.847  12.847
  331   2HB   ALA  40          2HB       ALA  40   0.666  11.663  11.663
  332   3HB   ALA  40          1HB       ALA  40  -0.219  12.582  12.582
  333    H    VAL  41           H        VAL  41  -1.476  10.605  10.605
  334    HA   VAL  41           HA       VAL  41  -1.387   8.053   8.053
  335    HB   VAL  41           HB       VAL  41  -2.195   8.301   8.301
  336   1HG1  VAL  41          1HG1      VAL  41  -2.769   6.063   6.063
  337   2HG1  VAL  41          3HG1      VAL  41  -2.916   5.904   5.904
  338   3HG1  VAL  41          2HG1      VAL  41  -3.953   7.032   7.032
  339   1HG2  VAL  41          3HG2      VAL  41  -0.187   6.652   6.652
  340   2HG2  VAL  41          2HG2      VAL  41   0.121   7.798   7.798
  341   3HG2  VAL  41          1HG2      VAL  41  -0.669   6.259   6.259
  342    H    GLU  42           H        GLU  42  -3.676   7.310   7.310
  343    HA   GLU  42           HA       GLU  42  -5.787   9.327   9.327
  344   1HB   GLU  42          2HB       GLU  42  -4.705  10.100  10.100
  345   2HB   GLU  42          1HB       GLU  42  -4.945   8.511   8.511
  346   1HG   GLU  42          2HG       GLU  42  -7.387   8.778   8.778
  347   2HG   GLU  42          1HG       GLU  42  -7.152  10.356  10.356
  348    H    ILE  43           H        ILE  43  -7.308   7.999   7.999
  349    HA   ILE  43           HA       ILE  43  -7.575   5.248   5.248
  350    HB   ILE  43           HB       ILE  43  -8.522   6.586   6.586
  351   1HG1  ILE  43          2HG1      ILE  43  -7.191   4.163   4.163
  352   2HG1  ILE  43          1HG1      ILE  43  -6.291   4.883   4.883
  353   1HG2  ILE  43          2HG2      ILE  43  -9.401   3.983   3.983
  354   2HG2  ILE  43          1HG2      ILE  43  -9.273   4.128   4.128
  355   3HG2  ILE  43          3HG2      ILE  43 -10.359   5.190   5.190
  356   1HD1  ILE  43          1HD1      ILE  43  -7.075   6.613   6.613
  357   2HD1  ILE  43          3HD1      ILE  43  -5.708   5.514   5.514
  358   3HD1  ILE  43          2HD1      ILE  43  -5.686   6.751   6.751
  359    H    LYS  44           H        LYS  44  -9.436   4.497   4.497
  360    HA   LYS  44           HA       LYS  44 -11.645   6.466   6.466
  361   1HB   LYS  44          2HB       LYS  44 -11.516   4.283   4.283
  362   2HB   LYS  44          1HB       LYS  44 -11.684   6.012   6.012
  363   1HG   LYS  44          2HG       LYS  44  -9.289   6.336   6.336
  364   2HG   LYS  44          1HG       LYS  44  -9.035   4.696   4.696
  365   1HD   LYS  44          2HD       LYS  44  -9.529   3.742   3.742
  366   2HD   LYS  44          1HD       LYS  44 -10.422   5.162   5.162
  367   1HE   LYS  44          2HE       LYS  44  -7.441   5.172   5.172
  368   2HE   LYS  44          1HE       LYS  44  -8.145   4.900   4.900
  369   1HZ   LYS  44          1HZ       LYS  44  -9.399   7.065   7.065
  370   2HZ   LYS  44          3HZ       LYS  44  -8.236   7.331   7.331
  371   3HZ   LYS  44          2HZ       LYS  44  -7.755   7.167   7.167
  372    H    GLN  45           H        GLN  45 -13.338   5.774   5.774
  373    HA   GLN  45           HA       GLN  45 -13.554   2.864   2.864
  374   1HB   GLN  45          2HB       GLN  45 -13.591   4.391   4.391
  375   2HB   GLN  45          1HB       GLN  45 -15.015   5.196   5.196
  376   1HG   GLN  45          2HG       GLN  45 -16.318   3.152   3.152
  377   2HG   GLN  45          1HG       GLN  45 -14.895   2.240   2.240
  378   1HE2  GLN  45          2HE2      GLN  45 -16.179   2.860   2.860
  379   2HE2  GLN  45          1HE2      GLN  45 -16.085   1.708   1.708
  380    H    GLU  46           H        GLU  46 -14.877   1.687   1.687
  381    HA   GLU  46           HA       GLU  46 -17.371   2.969   2.969
  382   1HB   GLU  46          2HB       GLU  46 -15.294   1.685   1.685
  383   2HB   GLU  46          1HB       GLU  46 -16.632   0.540   0.540
  384   1HG   GLU  46          2HG       GLU  46 -18.002   2.794   2.794
  385   2HG   GLU  46          1HG       GLU  46 -16.446   3.224   3.224
  386    H    GLY  47           H        GLY  47 -17.455   2.020   2.020
  387   1HA   GLY  47          2HA       GLY  47 -19.095   0.691   0.691
  388   2HA   GLY  47          1HA       GLY  47 -19.186  -0.377  -0.377
  389    H    ASP  48           H        ASP  48 -18.394  -2.366  -2.366
  390    HA   ASP  48           HA       ASP  48 -16.453  -2.738  -2.738
  391   1HB   ASP  48          2HB       ASP  48 -16.413  -5.132  -5.132
  392   2HB   ASP  48          1HB       ASP  48 -17.942  -4.570  -4.570
  393    H    THR  49           H        THR  49 -16.058  -1.647  -1.647
  394    HA   THR  49           HA       THR  49 -13.527  -3.093  -3.093
  395    HB   THR  49           HB       THR  49 -15.235  -1.236  -1.236
  396    HG1  THR  49           HG1      THR  49 -14.315  -3.881  -3.881
  397   1HG2  THR  49          2HG2      THR  49 -12.369  -1.846  -1.846
  398   2HG2  THR  49          1HG2      THR  49 -13.314  -2.177  -2.177
  399   3HG2  THR  49          3HG2      THR  49 -13.323  -0.562  -0.562
  400    H    PHE  50           H        PHE  50 -11.562  -2.082  -2.082
  401    HA   PHE  50           HA       PHE  50 -11.559   0.827   0.827
  402   1HB   PHE  50          2HB       PHE  50 -10.111  -1.330  -1.330
  403   2HB   PHE  50          1HB       PHE  50  -9.871   0.407   0.407
  404    HD1  PHE  50           HD2      PHE  50 -11.800   1.851   1.851
  405    HD2  PHE  50           HD1      PHE  50 -12.025  -2.433  -2.433
  406    HE1  PHE  50           HE2      PHE  50 -13.821   1.943   1.943
  407    HE2  PHE  50           HE1      PHE  50 -14.047  -2.339  -2.339
  408    HZ   PHE  50           HZ       PHE  50 -14.956  -0.155  -0.155
  409    H    TYR  51           H        TYR  51 -10.310   1.748   1.748
  410    HA   TYR  51           HA       TYR  51  -8.057   0.242   0.242
  411   1HB   TYR  51          2HB       TYR  51  -9.819   1.199   1.199
  412   2HB   TYR  51          1HB       TYR  51  -9.439   2.801   2.801
  413    HD1  TYR  51           HD1      TYR  51  -6.934   3.510   3.510
  414    HD2  TYR  51           HD2      TYR  51  -8.683   0.389   0.389
  415    HE1  TYR  51           HE1      TYR  51  -5.118   3.729   3.729
  416    HE2  TYR  51           HE2      TYR  51  -6.865   0.618   0.618
  417    HH   TYR  51           HH       TYR  51  -4.628   1.447   1.447
  418    H    ILE  52           H        ILE  52  -5.935   1.255   1.255
  419    HA   ILE  52           HA       ILE  52  -5.755   3.732   3.732
  420    HB   ILE  52           HB       ILE  52  -3.899   1.486   1.486
  421   1HG1  ILE  52          2HG1      ILE  52  -6.776   1.753   1.753
  422   2HG1  ILE  52          1HG1      ILE  52  -6.086   0.392   0.392
  423   1HG2  ILE  52          3HG2      ILE  52  -4.123   4.054   4.054
  424   2HG2  ILE  52          2HG2      ILE  52  -5.194   3.271   3.271
  425   3HG2  ILE  52          1HG2      ILE  52  -3.511   2.762   2.762
  426   1HD1  ILE  52          2HD1      ILE  52  -4.422   0.673   0.673
  427   2HD1  ILE  52          1HD1      ILE  52  -6.044   0.957   0.957
  428   3HD1  ILE  52          3HD1      ILE  52  -5.679  -0.546  -0.546
  429    H    LYS  53           H        LYS  53  -4.723   5.036   5.036
  430    HA   LYS  53           HA       LYS  53  -2.365   3.970   3.970
  431   1HB   LYS  53          2HB       LYS  53  -4.119   5.221   5.221
  432   2HB   LYS  53          1HB       LYS  53  -3.785   6.640   6.640
  433   1HG   LYS  53          2HG       LYS  53  -1.373   5.429   5.429
  434   2HG   LYS  53          1HG       LYS  53  -2.524   6.010   6.010
  435   1HD   LYS  53          2HD       LYS  53  -2.566   8.093   8.093
  436   2HD   LYS  53          1HD       LYS  53  -0.907   7.538   7.538
  437   1HE   LYS  53          2HE       LYS  53  -0.281   8.144   8.144
  438   2HE   LYS  53          1HE       LYS  53  -1.841   7.706   7.706
  439   1HZ   LYS  53          1HZ       LYS  53  -1.416  10.089  10.089
  440   2HZ   LYS  53          3HZ       LYS  53  -1.361  10.130  10.130
  441   3HZ   LYS  53          2HZ       LYS  53  -2.803   9.703   9.703
  442    H    THR  54           H        THR  54  -0.468   4.275   4.275
  443    HA   THR  54           HA       THR  54  -0.177   6.709   6.709
  444    HB   THR  54           HB       THR  54   1.612   4.257   4.257
  445    HG1  THR  54           HG1      THR  54   0.520   3.760   3.760
  446   1HG2  THR  54          2HG2      THR  54   1.964   6.804   6.804
  447   2HG2  THR  54          1HG2      THR  54   1.567   5.713   5.713
  448   3HG2  THR  54          3HG2      THR  54   2.937   5.359   5.359
  449    H    SER  55           H        SER  55   1.484   8.191   8.191
  450    HA   SER  55           HA       SER  55   3.229   7.547   7.547
  451   1HB   SER  55          2HB       SER  55   2.720  10.142  10.142
  452   2HB   SER  55          1HB       SER  55   1.792   8.820   8.820
  453    HG   SER  55           HG       SER  55   0.454  10.411  10.411
  454    H    THR  56           H        THR  56   5.248   8.496   8.496
  455    HA   THR  56           HA       THR  56   5.875  10.062  10.062
  456    HB   THR  56           HB       THR  56   8.284   9.107   9.107
  457    HG1  THR  56           HG1      THR  56   8.187   7.432   7.432
  458   1HG2  THR  56          2HG2      THR  56   7.077   8.733   8.733
  459   2HG2  THR  56          1HG2      THR  56   6.163   7.434   7.434
  460   3HG2  THR  56          3HG2      THR  56   7.909   7.282   7.282
  461    H    THR  57           H        THR  57   7.380   9.441   9.441
  462    HA   THR  57           HA       THR  57   7.159  12.043  12.043
  463    HB   THR  57           HB       THR  57   8.581  12.827  12.827
  464    HG1  THR  57           HG1      THR  57  10.206  12.407  12.407
  465   1HG2  THR  57          2HG2      THR  57   9.489  10.555  10.555
  466   2HG2  THR  57          1HG2      THR  57  10.570  10.702  10.702
  467   3HG2  THR  57          3HG2      THR  57  10.713  11.824  11.824
  468    H    VAL  58           H        VAL  58   9.242   9.253   9.253
  469    HA   VAL  58           HA       VAL  58   9.638   9.063   9.063
  470    HB   VAL  58           HB       VAL  58  11.333   7.843   7.843
  471   1HG1  VAL  58          1HG1      VAL  58  11.489   7.927   7.927
  472   2HG1  VAL  58          3HG1      VAL  58  12.931   7.664   7.664
  473   3HG1  VAL  58          2HG1      VAL  58  11.587   6.524   6.524
  474   1HG2  VAL  58          1HG2      VAL  58  11.351  10.503  10.503
  475   2HG2  VAL  58          3HG2      VAL  58  12.099   9.976   9.976
  476   3HG2  VAL  58          2HG2      VAL  58  12.909   9.678   9.678
  477    H    ARG  59           H        ARG  59   8.062   7.689   7.689
  478    HA   ARG  59           HA       ARG  59   7.620   5.159   5.159
  479   1HB   ARG  59          2HB       ARG  59   8.968   4.831   4.831
  480   2HB   ARG  59          1HB       ARG  59   7.619   5.494   5.494
  481   1HG   ARG  59          2HG       ARG  59   6.211   3.687   3.687
  482   2HG   ARG  59          1HG       ARG  59   7.170   3.207   3.207
  483   1HD   ARG  59          2HD       ARG  59   9.041   2.943   2.943
  484   2HD   ARG  59          1HD       ARG  59   7.587   2.592   2.592
  485    HE   ARG  59           HE       ARG  59   8.490   1.043   1.043
  486   1HH1  ARG  59          1HH2      ARG  59   7.780   0.744   0.744
  487   2HH1  ARG  59          2HH2      ARG  59   6.626  -0.537  -0.537
  488   1HH2  ARG  59          2HH1      ARG  59   6.456  -0.295  -0.295
  489   2HH2  ARG  59          1HH1      ARG  59   5.876  -1.125  -1.125
  490    H    THR  60           H        THR  60   5.450   4.174   4.174
  491    HA   THR  60           HA       THR  60   3.417   5.888   5.888
  492    HB   THR  60           HB       THR  60   3.218   5.298   5.298
  493    HG1  THR  60           HG1      THR  60   3.979   7.278   7.278
  494   1HG2  THR  60          3HG2      THR  60   1.199   5.749   5.749
  495   2HG2  THR  60          2HG2      THR  60   1.710   7.426   7.426
  496   3HG2  THR  60          1HG2      THR  60   1.223   6.486   6.486
  497    H    THR  61           H        THR  61   2.861   4.053   4.053
  498    HA   THR  61           HA       THR  61   2.374   1.468   1.468
  499    HB   THR  61           HB       THR  61   1.255   1.894   1.894
  500    HG1  THR  61           HG1      THR  61   3.021   2.570   2.570
  501   1HG2  THR  61          2HG2      THR  61   1.909  -0.263  -0.263
  502   2HG2  THR  61          1HG2      THR  61   3.519   0.071   0.071
  503   3HG2  THR  61          3HG2      THR  61   2.171  -0.201  -0.201
  504    H    GLU  62           H        GLU  62   0.225   0.360   0.360
  505    HA   GLU  62           HA       GLU  62  -2.174   1.980   1.980
  506   1HB   GLU  62          2HB       GLU  62  -1.128   1.289   1.289
  507   2HB   GLU  62          1HB       GLU  62  -2.867   1.213   1.213
  508   1HG   GLU  62          2HG       GLU  62  -2.920   3.438   3.438
  509   2HG   GLU  62          1HG       GLU  62  -2.095   3.621   3.621
  510    H    ILE  63           H        ILE  63  -3.496   0.553   0.553
  511    HA   ILE  63           HA       ILE  63  -3.424  -2.314  -2.314
  512    HB   ILE  63           HB       ILE  63  -4.070  -2.878  -2.878
  513   1HG1  ILE  63          2HG1      ILE  63  -3.372   0.025   0.025
  514   2HG1  ILE  63          1HG1      ILE  63  -5.018  -0.608  -0.608
  515   1HG2  ILE  63          3HG2      ILE  63  -1.628  -2.608  -2.608
  516   2HG2  ILE  63          2HG2      ILE  63  -1.547  -1.265  -1.265
  517   3HG2  ILE  63          1HG2      ILE  63  -1.865  -2.898  -2.898
  518   1HD1  ILE  63          3HD1      ILE  63  -3.103  -2.107  -2.107
  519   2HD1  ILE  63          2HD1      ILE  63  -3.511  -0.485  -0.485
  520   3HD1  ILE  63          1HD1      ILE  63  -4.786  -1.677  -1.677
  521    H    ASN  64           H        ASN  64  -5.595  -3.435  -3.435
  522    HA   ASN  64           HA       ASN  64  -7.932  -1.721  -1.721
  523   1HB   ASN  64          2HB       ASN  64  -8.933  -2.299  -2.299
  524   2HB   ASN  64          1HB       ASN  64  -7.538  -1.235  -1.235
  525   1HD2  ASN  64          2HD2      ASN  64  -5.388  -3.756  -3.756
  526   2HD2  ASN  64          1HD2      ASN  64  -5.375  -2.426  -2.426
  527    H    PHE  65           H        PHE  65  -9.456  -3.021  -3.021
  528    HA   PHE  65           HA       PHE  65  -9.841  -5.806  -5.806
  529   1HB   PHE  65          2HB       PHE  65  -9.164  -6.843  -6.843
  530   2HB   PHE  65          1HB       PHE  65  -7.805  -5.949  -5.949
  531    HD1  PHE  65           HD2      PHE  65  -7.105  -3.766  -3.766
  532    HD2  PHE  65           HD1      PHE  65 -10.273  -6.118  -6.118
  533    HE1  PHE  65           HE2      PHE  65  -7.008  -2.401  -2.401
  534    HE2  PHE  65           HE1      PHE  65 -10.183  -4.756  -4.756
  535    HZ   PHE  65           HZ       PHE  65  -8.551  -2.891  -2.891
  536    H    LYS  66           H        LYS  66 -11.154  -6.919  -6.919
  537    HA   LYS  66           HA       LYS  66 -13.224  -5.002  -5.002
  538   1HB   LYS  66          2HB       LYS  66 -14.917  -6.877  -6.877
  539   2HB   LYS  66          1HB       LYS  66 -14.331  -6.034  -6.034
  540   1HG   LYS  66          2HG       LYS  66 -12.551  -7.886  -7.886
  541   2HG   LYS  66          1HG       LYS  66 -13.538  -8.759  -8.759
  542   1HD   LYS  66          2HD       LYS  66 -15.106  -9.290  -9.290
  543   2HD   LYS  66          1HD       LYS  66 -15.126  -7.655  -7.655
  544   1HE   LYS  66          2HE       LYS  66 -12.690  -8.494  -8.494
  545   2HE   LYS  66          1HE       LYS  66 -13.570 -10.022 -10.022
  546   1HZ   LYS  66          2HZ       LYS  66 -15.302  -8.985  -8.985
  547   2HZ   LYS  66          1HZ       LYS  66 -14.453  -7.514  -7.514
  548   3HZ   LYS  66          3HZ       LYS  66 -13.800  -8.867  -8.867
  549    H    VAL  67           H        VAL  67 -14.280  -5.777  -5.777
  550    HA   VAL  67           HA       VAL  67 -12.357  -7.295  -7.295
  551    HB   VAL  67           HB       VAL  67 -14.945  -6.668  -6.668
  552   1HG1  VAL  67          2HG1      VAL  67 -12.043  -6.013  -6.013
  553   2HG1  VAL  67          1HG1      VAL  67 -13.390  -5.716  -5.716
  554   3HG1  VAL  67          3HG1      VAL  67 -12.960  -7.368  -7.368
  555   1HG2  VAL  67          1HG2      VAL  67 -13.344  -4.552  -4.552
  556   2HG2  VAL  67          3HG2      VAL  67 -15.087  -4.659  -4.659
  557   3HG2  VAL  67          2HG2      VAL  67 -14.044  -4.191  -4.191
  558    H    GLY  68           H        GLY  68 -12.449  -9.456  -9.456
  559   1HA   GLY  68          2HA       GLY  68 -14.047 -11.299 -11.299
  560   2HA   GLY  68          1HA       GLY  68 -15.072 -10.794 -10.794
  561    H    GLU  69           H        GLU  69 -12.430 -10.371 -10.371
  562    HA   GLU  69           HA       GLU  69 -11.827 -13.268 -13.268
  563   1HB   GLU  69          2HB       GLU  69 -11.992 -12.948 -12.948
  564   2HB   GLU  69          1HB       GLU  69 -13.522 -12.558 -12.558
  565   1HG   GLU  69          2HG       GLU  69 -13.436 -10.583 -10.583
  566   2HG   GLU  69          1HG       GLU  69 -12.135 -10.139 -10.139
  567    H    GLU  70           H        GLU  70  -9.833 -13.615 -13.615
  568    HA   GLU  70           HA       GLU  70  -7.743 -11.707 -11.707
  569   1HB   GLU  70          2HB       GLU  70  -7.410 -14.264 -14.264
  570   2HB   GLU  70          1HB       GLU  70  -6.178 -13.408 -13.408
  571   1HG   GLU  70          2HG       GLU  70  -7.284 -13.942 -13.942
  572   2HG   GLU  70          1HG       GLU  70  -8.664 -14.627 -14.627
  573    H    PHE  71           H        PHE  71  -6.061 -11.104 -11.104
  574    HA   PHE  71           HA       PHE  71  -6.859 -11.038 -11.038
  575   1HB   PHE  71          2HB       PHE  71  -6.885  -8.523  -8.523
  576   2HB   PHE  71          1HB       PHE  71  -8.247  -9.211  -9.211
  577    HD1  PHE  71           HD2      PHE  71  -8.122  -9.350  -9.350
  578    HD2  PHE  71           HD1      PHE  71  -5.342  -7.075  -7.075
  579    HE1  PHE  71           HE2      PHE  71  -7.442  -8.083  -8.083
  580    HE2  PHE  71           HE1      PHE  71  -4.664  -5.808  -5.808
  581    HZ   PHE  71           HZ       PHE  71  -5.711  -6.310  -6.310
  582    H    GLU  72           H        GLU  72  -5.231  -9.537  -9.537
  583    HA   GLU  72           HA       GLU  72  -2.567  -9.984  -9.984
  584   1HB   GLU  72          2HB       GLU  72  -2.897  -9.124  -9.124
  585   2HB   GLU  72          1HB       GLU  72  -1.599 -10.051 -10.051
  586   1HG   GLU  72          2HG       GLU  72  -3.203 -11.947 -11.947
  587   2HG   GLU  72          1HG       GLU  72  -4.408 -11.033 -11.033
  588    H    GLU  73           H        GLU  73  -1.152  -8.245  -8.245
  589    HA   GLU  73           HA       GLU  73  -1.798  -5.570  -5.570
  590   1HB   GLU  73          2HB       GLU  73  -1.967  -4.585  -4.585
  591   2HB   GLU  73          1HB       GLU  73  -3.330  -5.627  -5.627
  592   1HG   GLU  73          2HG       GLU  73  -2.719  -7.253  -7.253
  593   2HG   GLU  73          1HG       GLU  73  -0.995  -6.935  -6.935
  594    H    GLN  74           H        GLN  74  -0.222  -3.989  -3.989
  595    HA   GLN  74           HA       GLN  74   2.452  -5.328  -5.328
  596   1HB   GLN  74          2HB       GLN  74   1.501  -2.479  -2.479
  597   2HB   GLN  74          1HB       GLN  74   3.182  -2.803  -2.803
  598   1HG   GLN  74          2HG       GLN  74   2.047  -4.366  -4.366
  599   2HG   GLN  74          1HG       GLN  74   2.352  -2.652  -2.652
  600   1HE2  GLN  74          2HE2      GLN  74   5.466  -5.218  -5.218
  601   2HE2  GLN  74          1HE2      GLN  74   3.856  -5.751  -5.751
  602    H    THR  75           H        THR  75   4.016  -4.893  -4.893
  603    HA   THR  75           HA       THR  75   2.678  -4.656  -4.656
  604    HB   THR  75           HB       THR  75   4.243  -6.565  -6.565
  605    HG1  THR  75           HG1      THR  75   3.749  -5.920  -5.920
  606   1HG2  THR  75          3HG2      THR  75   5.978  -4.421  -4.421
  607   2HG2  THR  75          2HG2      THR  75   6.682  -5.244  -5.244
  608   3HG2  THR  75          1HG2      THR  75   6.302  -6.151  -6.151
  609    H    VAL  76           H        VAL  76   5.464  -3.741  -3.741
  610    HA   VAL  76           HA       VAL  76   5.010  -0.868  -0.868
  611    HB   VAL  76           HB       VAL  76   6.306  -2.078  -2.078
  612   1HG1  VAL  76          1HG1      VAL  76   5.632   0.690   0.690
  613   2HG1  VAL  76          3HG1      VAL  76   5.503   0.321   0.321
  614   3HG1  VAL  76          2HG1      VAL  76   7.045   0.118   0.118
  615   1HG2  VAL  76          1HG2      VAL  76   3.468  -1.154  -1.154
  616   2HG2  VAL  76          3HG2      VAL  76   3.993  -2.764  -2.764
  617   3HG2  VAL  76          2HG2      VAL  76   4.126  -1.410  -1.410
  618    H    ASP  77           H        ASP  77   7.389  -3.407  -3.407
  619    HA   ASP  77           HA       ASP  77   9.618  -1.507  -1.507
  620   1HB   ASP  77          2HB       ASP  77  10.943  -3.618  -3.618
  621   2HB   ASP  77          1HB       ASP  77  10.169  -3.546  -3.546
  622    H    GLY  78           H        GLY  78   7.767  -3.720  -3.720
  623   1HA   GLY  78          2HA       GLY  78   7.403  -2.625  -2.625
  624   2HA   GLY  78          1HA       GLY  78   9.164  -2.659  -2.659
  625    H    ARG  79           H        ARG  79   6.896  -5.081  -5.081
  626    HA   ARG  79           HA       ARG  79   7.855  -6.986  -6.986
  627   1HB   ARG  79          2HB       ARG  79   7.761  -7.242  -7.242
  628   2HB   ARG  79          1HB       ARG  79   7.596  -8.673  -8.673
  629   1HG   ARG  79          2HG       ARG  79   9.724  -7.769  -7.769
  630   2HG   ARG  79          1HG       ARG  79   9.929  -6.799  -6.799
  631   1HD   ARG  79          2HD       ARG  79  11.168  -8.894  -8.894
  632   2HD   ARG  79          1HD       ARG  79   9.821  -8.868  -8.868
  633    HE   ARG  79           HE       ARG  79   8.846 -10.095 -10.095
  634   1HH1  ARG  79          2HH1      ARG  79  10.002 -10.884 -10.884
  635   2HH1  ARG  79          1HH1      ARG  79  10.577 -12.465 -12.465
  636   1HH2  ARG  79          1HH2      ARG  79  10.160 -12.013 -12.013
  637   2HH2  ARG  79          2HH2      ARG  79  10.667 -13.104 -13.104
  638    HA   PRO  80           HA       PRO  80   3.496  -7.752  -7.752
  639   1HB   PRO  80          2HB       PRO  80   3.569 -10.215 -10.215
  640   2HB   PRO  80          1HB       PRO  80   3.919  -8.692  -8.692
  641   1HG   PRO  80          2HG       PRO  80   5.804 -10.821 -10.821
  642   2HG   PRO  80          1HG       PRO  80   5.977  -9.648  -9.648
  643   1HD   PRO  80          2HD       PRO  80   7.201  -9.483  -9.483
  644   2HD   PRO  80          1HD       PRO  80   7.109  -8.180  -8.180
  645    H    CYS  81           H        CYS  81   1.903  -8.764  -8.764
  646    HA   CYS  81           HA       CYS  81   2.354 -11.322 -11.322
  647   1HB   CYS  81          2HB       CYS  81   1.988 -10.363 -10.363
  648   2HB   CYS  81          1HB       CYS  81   3.548  -9.952  -9.952
  649    HG   CYS  81           HG       CYS  81   1.913  -7.693  -7.693
  650    H    LYS  82           H        LYS  82   0.399 -12.254 -12.254
  651    HA   LYS  82           HA       LYS  82  -2.043 -10.797 -10.797
  652   1HB   LYS  82          2HB       LYS  82  -1.715 -13.129 -13.129
  653   2HB   LYS  82          1HB       LYS  82  -1.654 -13.669 -13.669
  654   1HG   LYS  82          2HG       LYS  82  -3.968 -12.472 -12.472
  655   2HG   LYS  82          1HG       LYS  82  -3.986 -12.621 -12.621
  656   1HD   LYS  82          2HD       LYS  82  -3.221 -15.061 -15.061
  657   2HD   LYS  82          1HD       LYS  82  -4.908 -14.562 -14.562
  658   1HE   LYS  82          2HE       LYS  82  -4.558 -14.275 -14.275
  659   2HE   LYS  82          1HE       LYS  82  -3.405 -15.573 -15.573
  660   1HZ   LYS  82          2HZ       LYS  82  -5.345 -16.581 -16.581
  661   2HZ   LYS  82          1HZ       LYS  82  -6.318 -15.543 -15.543
  662   3HZ   LYS  82          3HZ       LYS  82  -5.357 -16.712 -16.712
  663    H    SER  83           H        SER  83  -2.951  -9.574  -9.574
  664    HA   SER  83           HA       SER  83  -2.532 -10.305 -10.305
  665   1HB   SER  83          2HB       SER  83  -2.194  -7.956  -7.956
  666   2HB   SER  83          1HB       SER  83  -3.917  -7.812  -7.812
  667    HG   SER  83           HG       SER  83  -2.555  -7.046  -7.046
  668    H    LEU  84           H        LEU  84  -4.525  -9.686  -9.686
  669    HA   LEU  84           HA       LEU  84  -7.127 -10.247 -10.247
  670   1HB   LEU  84          2HB       LEU  84  -6.359 -12.507 -12.507
  671   2HB   LEU  84          1HB       LEU  84  -5.947 -11.984 -11.984
  672    HG   LEU  84           HG       LEU  84  -8.303 -11.551 -11.551
  673   1HD1  LEU  84          3HD1      LEU  84  -8.584 -11.489 -11.489
  674   2HD1  LEU  84          2HD1      LEU  84  -9.544 -12.850 -12.850
  675   3HD1  LEU  84          1HD1      LEU  84  -9.839 -11.238 -11.238
  676   1HD2  LEU  84          3HD2      LEU  84  -7.475 -14.217 -14.217
  677   2HD2  LEU  84          2HD2      LEU  84  -7.804 -13.739 -13.739
  678   3HD2  LEU  84          1HD2      LEU  84  -9.139 -13.993 -13.993
  679    H    VAL  85           H        VAL  85  -8.891  -9.535  -9.535
  680    HA   VAL  85           HA       VAL  85  -7.983  -8.152  -8.152
  681    HB   VAL  85           HB       VAL  85  -9.744  -6.766  -6.766
  682   1HG1  VAL  85          3HG1      VAL  85  -9.716  -6.128  -6.128
  683   2HG1  VAL  85          2HG1      VAL  85  -8.044  -5.625  -5.625
  684   3HG1  VAL  85          1HG1      VAL  85  -9.345  -4.828  -4.828
  685   1HG2  VAL  85          2HG2      VAL  85  -6.775  -6.951  -6.951
  686   2HG2  VAL  85          1HG2      VAL  85  -7.807  -6.742  -6.742
  687   3HG2  VAL  85          3HG2      VAL  85  -7.467  -5.373  -5.373
  688    H    LYS  86           H        LYS  86  -9.336  -8.511  -8.511
  689    HA   LYS  86           HA       LYS  86 -12.212  -9.044  -9.044
  690   1HB   LYS  86          2HB       LYS  86 -11.979 -10.239 -10.239
  691   2HB   LYS  86          1HB       LYS  86 -11.704 -11.116 -11.116
  692   1HG   LYS  86          2HG       LYS  86  -9.247 -10.567 -10.567
  693   2HG   LYS  86          1HG       LYS  86  -9.613  -9.910  -9.910
  694   1HD   LYS  86          2HD       LYS  86 -10.262 -12.019 -12.019
  695   2HD   LYS  86          1HD       LYS  86 -10.443 -12.708 -12.708
  696   1HE   LYS  86          2HE       LYS  86  -8.014 -12.557 -12.557
  697   2HE   LYS  86          1HE       LYS  86  -7.818 -11.834 -11.834
  698   1HZ   LYS  86          1HZ       LYS  86  -8.895 -13.884 -13.884
  699   2HZ   LYS  86          3HZ       LYS  86  -8.761 -14.569 -14.569
  700   3HZ   LYS  86          2HZ       LYS  86  -7.362 -14.128 -14.128
  701    H    TRP  87           H        TRP  87 -13.638  -8.171  -8.171
  702    HA   TRP  87           HA       TRP  87 -12.620  -5.624  -5.624
  703   1HB   TRP  87          2HB       TRP  87 -15.267  -7.071  -7.071
  704   2HB   TRP  87          1HB       TRP  87 -14.975  -5.604  -5.604
  705    HD1  TRP  87           HD1      TRP  87 -15.983  -6.823  -6.823
  706    HE1  TRP  87           HE1      TRP  87 -16.163  -4.878  -4.878
  707    HE3  TRP  87           HE3      TRP  87 -13.669  -3.172  -3.172
  708    HZ2  TRP  87           HZ2      TRP  87 -15.417  -2.117  -2.117
  709    HZ3  TRP  87           HZ3      TRP  87 -13.394  -0.895  -0.895
  710    HH2  TRP  87           HH2      TRP  87 -14.263  -0.368  -0.368
  711    H    GLU  88           H        GLU  88 -13.318  -5.087  -5.087
  712    HA   GLU  88           HA       GLU  88 -12.718  -7.303  -7.303
  713   1HB   GLU  88          2HB       GLU  88 -10.685  -5.790  -5.790
  714   2HB   GLU  88          1HB       GLU  88 -11.505  -4.570  -4.570
  715   1HG   GLU  88          2HG       GLU  88 -10.063  -5.660  -5.660
  716   2HG   GLU  88          1HG       GLU  88 -11.659  -6.341  -6.341
  717    H    SER  89           H        SER  89 -13.613  -3.921  -3.921
  718    HA   SER  89           HA       SER  89 -15.749  -4.215  -4.215
  719   1HB   SER  89          2HB       SER  89 -15.246  -1.979  -1.979
  720   2HB   SER  89          1HB       SER  89 -13.762  -2.926  -2.926
  721    HG   SER  89           HG       SER  89 -13.240  -1.026  -1.026
  722    H    GLU  90           H        GLU  90 -16.568  -1.409  -1.409
  723    HA   GLU  90           HA       GLU  90 -18.066  -1.965  -1.965
  724   1HB   GLU  90          2HB       GLU  90 -17.961   0.664   0.664
  725   2HB   GLU  90          1HB       GLU  90 -19.246   0.079   0.079
  726   1HG   GLU  90          2HG       GLU  90 -19.127  -1.950  -1.950
  727   2HG   GLU  90          1HG       GLU  90 -18.680  -0.578  -0.578
  728    H    ASN  91           H        ASN  91 -15.167  -0.184  -0.184
  729    HA   ASN  91           HA       ASN  91 -14.868   0.465   0.465
  730   1HB   ASN  91          2HB       ASN  91 -14.246   2.501   2.501
  731   2HB   ASN  91          1HB       ASN  91 -14.278   2.742   2.742
  732   1HD2  ASN  91          2HD2      ASN  91 -17.576   3.579   3.579
  733   2HD2  ASN  91          1HD2      ASN  91 -15.996   3.625   3.625
  734    H    LYS  92           H        LYS  92 -13.555  -1.489  -1.489
  735    HA   LYS  92           HA       LYS  92 -10.769  -0.543  -0.543
  736   1HB   LYS  92          2HB       LYS  92 -11.326  -0.255  -0.255
  737   2HB   LYS  92          1HB       LYS  92 -11.731  -1.968  -1.968
  738   1HG   LYS  92          2HG       LYS  92  -9.369  -2.425  -2.425
  739   2HG   LYS  92          1HG       LYS  92  -9.031  -0.727  -0.727
  740   1HD   LYS  92          2HD       LYS  92  -9.671  -1.052  -1.052
  741   2HD   LYS  92          1HD       LYS  92 -10.037  -2.746  -2.746
  742   1HE   LYS  92          2HE       LYS  92  -7.879  -3.067  -3.067
  743   2HE   LYS  92          1HE       LYS  92  -7.507  -2.603  -2.603
  744   1HZ   LYS  92          3HZ       LYS  92  -7.587  -0.223  -0.223
  745   2HZ   LYS  92          2HZ       LYS  92  -7.325  -1.006  -1.006
  746   3HZ   LYS  92          1HZ       LYS  92  -6.199  -1.171  -1.171
  747    H    MET  93           H        MET  93 -10.007  -1.977  -1.977
  748    HA   MET  93           HA       MET  93 -10.790  -4.850  -4.850
  749   1HB   MET  93          2HB       MET  93 -10.602  -5.119  -5.119
  750   2HB   MET  93          1HB       MET  93 -11.807  -3.910  -3.910
  751   1HG   MET  93          2HG       MET  93  -9.446  -2.457  -2.457
  752   2HG   MET  93          1HG       MET  93  -9.320  -3.621  -3.621
  753   1HE   MET  93          1HE       MET  93 -11.156  -4.308  -4.308
  754   2HE   MET  93          3HE       MET  93 -12.775  -3.829  -3.829
  755   3HE   MET  93          2HE       MET  93 -12.100  -3.172  -3.172
  756    H    VAL  94           H        VAL  94  -9.213  -6.422  -6.422
  757    HA   VAL  94           HA       VAL  94  -6.414  -5.468  -5.468
  758    HB   VAL  94           HB       VAL  94  -7.306  -8.332  -8.332
  759   1HG1  VAL  94          1HG1      VAL  94  -4.994  -6.653  -6.653
  760   2HG1  VAL  94          3HG1      VAL  94  -5.444  -7.967  -7.967
  761   3HG1  VAL  94          2HG1      VAL  94  -5.024  -8.310  -8.310
  762   1HG2  VAL  94          1HG2      VAL  94  -7.533  -6.180  -6.180
  763   2HG2  VAL  94          3HG2      VAL  94  -8.844  -7.164  -7.164
  764   3HG2  VAL  94          2HG2      VAL  94  -7.594  -7.908  -7.908
  765    H    CYS  95           H        CYS  95  -4.779  -7.015  -7.015
  766    HA   CYS  95           HA       CYS  95  -5.882  -8.040  -8.040
  767   1HB   CYS  95          2HB       CYS  95  -5.387  -5.618  -5.618
  768   2HB   CYS  95          1HB       CYS  95  -3.711  -5.925  -5.925
  769    HG   CYS  95           HG       CYS  95  -3.427  -7.370  -7.370
  770    H    GLU  96           H        GLU  96  -4.752  -9.762  -9.762
  771    HA   GLU  96           HA       GLU  96  -2.167 -10.436 -10.436
  772   1HB   GLU  96          2HB       GLU  96  -3.927 -12.265 -12.265
  773   2HB   GLU  96          1HB       GLU  96  -2.598 -12.734 -12.734
  774   1HG   GLU  96          2HG       GLU  96  -4.628 -11.169 -11.169
  775   2HG   GLU  96          1HG       GLU  96  -5.297 -12.636 -12.636
  776    H    GLN  97           H        GLN  97  -0.522 -11.489 -11.489
  777    HA   GLN  97           HA       GLN  97  -0.904 -10.837 -10.837
  778   1HB   GLN  97          2HB       GLN  97  -0.175  -8.729  -8.729
  779   2HB   GLN  97          1HB       GLN  97   1.418  -9.429  -9.429
  780   1HG   GLN  97          2HG       GLN  97   0.722  -9.578  -9.578
  781   2HG   GLN  97          1HG       GLN  97  -0.572  -8.464  -8.464
  782   1HE2  GLN  97          2HE2      GLN  97   1.555  -5.655  -5.655
  783   2HE2  GLN  97          1HE2      GLN  97  -0.030  -6.255  -6.255
  784    H    LYS  98           H        LYS  98   0.426 -11.994 -11.994
  785    HA   LYS  98           HA       LYS  98   2.907 -13.199 -13.199
  786   1HB   LYS  98          2HB       LYS  98   2.240 -15.437 -15.437
  787   2HB   LYS  98          1HB       LYS  98   1.193 -14.902 -14.902
  788   1HG   LYS  98          2HG       LYS  98  -0.263 -13.894 -13.894
  789   2HG   LYS  98          1HG       LYS  98   0.596 -15.073 -15.073
  790   1HD   LYS  98          2HD       LYS  98  -1.347 -16.219 -16.219
  791   2HD   LYS  98          1HD       LYS  98  -0.056 -16.801 -16.801
  792   1HE   LYS  98          2HE       LYS  98  -0.717 -15.166 -15.166
  793   2HE   LYS  98          1HE       LYS  98  -2.005 -14.577 -14.577
  794   1HZ   LYS  98          3HZ       LYS  98  -1.752 -17.358 -17.358
  795   2HZ   LYS  98          2HZ       LYS  98  -2.817 -16.184 -16.184
  796   3HZ   LYS  98          1HZ       LYS  98  -3.006 -16.763 -16.763
  797    H    LEU  99           H        LEU  99   4.417 -13.678 -13.678
  798    HA   LEU  99           HA       LEU  99   4.247 -11.988 -11.988
  799   1HB   LEU  99          2HB       LEU  99   5.886 -14.479 -14.479
  800   2HB   LEU  99          1HB       LEU  99   6.116 -13.401 -13.401
  801    HG   LEU  99           HG       LEU  99   6.065 -12.153 -12.153
  802   1HD1  LEU  99          3HD1      LEU  99   8.236 -13.976 -13.976
  803   2HD1  LEU  99          2HD1      LEU  99   8.591 -12.677 -12.677
  804   3HD1  LEU  99          1HD1      LEU  99   7.486 -13.973 -13.973
  805   1HD2  LEU  99          1HD2      LEU  99   7.518 -11.789 -11.789
  806   2HD2  LEU  99          3HD2      LEU  99   6.392 -10.682 -10.682
  807   3HD2  LEU  99          2HD2      LEU  99   8.006 -10.919 -10.919
  808    H    LEU 100           H        LEU 100   4.347 -12.756 -12.756
  809    HA   LEU 100           HA       LEU 100   2.275 -14.816 -14.816
  810   1HB   LEU 100          2HB       LEU 100   3.351 -12.506 -12.506
  811   2HB   LEU 100          1HB       LEU 100   2.372 -13.782 -13.782
  812    HG   LEU 100           HG       LEU 100   1.486 -12.224 -12.224
  813   1HD1  LEU 100          2HD1      LEU 100   1.062 -11.682 -11.682
  814   2HD1  LEU 100          1HD1      LEU 100  -0.024 -11.053 -11.053
  815   3HD1  LEU 100          3HD1      LEU 100   1.673 -10.575 -10.575
  816   1HD2  LEU 100          1HD2      LEU 100   0.336 -14.301 -14.301
  817   2HD2  LEU 100          3HD2      LEU 100   0.112 -14.077 -14.077
  818   3HD2  LEU 100          2HD2      LEU 100  -0.758 -13.052 -13.052
  819    H    LYS 101           H        LYS 101   5.623 -14.509 -14.509
  820    HA   LYS 101           HA       LYS 101   5.972 -16.933 -16.933
  821   1HB   LYS 101          2HB       LYS 101   6.326 -14.993 -14.993
  822   2HB   LYS 101          1HB       LYS 101   7.623 -14.437 -14.437
  823   1HG   LYS 101          2HG       LYS 101   8.976 -15.726 -15.726
  824   2HG   LYS 101          1HG       LYS 101   8.300 -17.082 -17.082
  825   1HD   LYS 101          2HD       LYS 101   7.810 -17.801 -17.801
  826   2HD   LYS 101          1HD       LYS 101   6.366 -16.830 -16.830
  827   1HE   LYS 101          2HE       LYS 101   7.297 -14.949 -14.949
  828   2HE   LYS 101          1HE       LYS 101   8.877 -15.725 -15.725
  829   1HZ   LYS 101          2HZ       LYS 101   7.786 -17.512 -17.512
  830   2HZ   LYS 101          1HZ       LYS 101   6.371 -16.572 -16.572
  831   3HZ   LYS 101          3HZ       LYS 101   7.786 -15.997 -15.997
  832    H    GLY 102           H        GLY 102   7.393 -18.267 -18.267
  833   1HA   GLY 102          2HA       GLY 102   9.019 -18.984 -18.984
  834   2HA   GLY 102          1HA       GLY 102   9.733 -17.375 -17.375
  835    H    GLU 103           H        GLU 103  10.074 -17.452 -17.452
  836    HA   GLU 103           HA       GLU 103   8.032 -16.102 -16.102
  837   1HB   GLU 103          2HB       GLU 103   7.017 -18.398 -18.398
  838   2HB   GLU 103          1HB       GLU 103   8.423 -18.995 -18.995
  839   1HG   GLU 103          2HG       GLU 103   7.916 -17.701 -17.701
  840   2HG   GLU 103          1HG       GLU 103   6.779 -16.688 -16.688
  841    H    GLY 104           H        GLY 104   8.894 -15.222 -15.222
  842   1HA   GLY 104          2HA       GLY 104  11.347 -16.340 -16.340
  843   2HA   GLY 104          1HA       GLY 104  11.481 -14.718 -14.718
  844    HA   PRO 105           HA       PRO 105   9.740 -13.280 -13.280
  845   1HB   PRO 105          2HB       PRO 105   9.012 -10.749 -10.749
  846   2HB   PRO 105          1HB       PRO 105  10.694 -11.227 -11.227
  847   1HG   PRO 105          2HG       PRO 105   9.327 -10.687 -10.687
  848   2HG   PRO 105          1HG       PRO 105  11.055 -10.643 -10.643
  849   1HD   PRO 105          2HD       PRO 105   9.648 -12.745 -12.745
  850   2HD   PRO 105          1HD       PRO 105  11.342 -12.764 -12.764
  851    H    LYS 106           H        LYS 106   7.604 -11.881 -11.881
  852    HA   LYS 106           HA       LYS 106   5.326 -12.821 -12.821
  853   1HB   LYS 106          2HB       LYS 106   5.577 -14.295 -14.295
  854   2HB   LYS 106          1HB       LYS 106   5.519 -12.881 -12.881
  855   1HG   LYS 106          2HG       LYS 106   3.268 -12.493 -12.493
  856   2HG   LYS 106          1HG       LYS 106   3.305 -13.332 -13.332
  857   1HD   LYS 106          2HD       LYS 106   3.733 -15.476 -15.476
  858   2HD   LYS 106          1HD       LYS 106   3.347 -14.561 -14.561
  859   1HE   LYS 106          2HE       LYS 106   1.531 -15.019 -15.019
  860   2HE   LYS 106          1HE       LYS 106   1.328 -15.678 -15.678
  861   1HZ   LYS 106          2HZ       LYS 106   1.267 -13.298 -13.298
  862   2HZ   LYS 106          1HZ       LYS 106   1.113 -12.853 -12.853
  863   3HZ   LYS 106          3HZ       LYS 106  -0.076 -13.817 -13.817
  864    H    THR 107           H        THR 107   3.715 -11.234 -11.234
  865    HA   THR 107           HA       THR 107   4.143  -8.712  -8.712
  866    HB   THR 107           HB       THR 107   2.898  -7.863  -7.863
  867    HG1  THR 107           HG1      THR 107   3.289 -10.059 -10.059
  868   1HG2  THR 107          1HG2      THR 107   5.030  -7.111  -7.111
  869   2HG2  THR 107          3HG2      THR 107   5.890  -8.112  -8.112
  870   3HG2  THR 107          2HG2      THR 107   4.911  -6.754  -6.754
  871    H    SER 108           H        SER 108   2.375  -7.627  -7.627
  872    HA   SER 108           HA       SER 108  -0.356  -8.323  -8.323
  873   1HB   SER 108          2HB       SER 108   0.821  -9.229  -9.229
  874   2HB   SER 108          1HB       SER 108  -0.904  -8.924  -8.924
  875    HG   SER 108           HG       SER 108   0.575 -11.038 -11.038
  876    H    TRP 109           H        TRP 109  -1.650  -6.486  -6.486
  877    HA   TRP 109           HA       TRP 109  -0.526  -4.588  -4.588
  878   1HB   TRP 109          2HB       TRP 109  -1.056  -2.678  -2.678
  879   2HB   TRP 109          1HB       TRP 109   0.319  -3.670  -3.670
  880    HD1  TRP 109           HD1      TRP 109   0.150  -5.054  -5.054
  881    HE1  TRP 109           HE1      TRP 109  -1.571  -5.121  -5.121
  882    HE3  TRP 109           HE3      TRP 109  -3.687  -2.458  -2.458
  883    HZ2  TRP 109           HZ2      TRP 109  -4.219  -4.197  -4.197
  884    HZ3  TRP 109           HZ3      TRP 109  -5.789  -2.069  -2.069
  885    HH2  TRP 109           HH2      TRP 109  -6.065  -2.933  -2.933
  886    H    THR 110           H        THR 110  -2.143  -2.740  -2.740
  887    HA   THR 110           HA       THR 110  -4.948  -3.728  -3.728
  888    HB   THR 110           HB       THR 110  -5.410  -3.346  -3.346
  889    HG1  THR 110           HG1      THR 110  -3.852  -2.381  -2.381
  890   1HG2  THR 110          1HG2      THR 110  -3.612  -5.262  -5.262
  891   2HG2  THR 110          3HG2      THR 110  -2.712  -4.428  -4.428
  892   3HG2  THR 110          2HG2      THR 110  -4.293  -5.126  -5.126
  893    H    MET 111           H        MET 111  -6.504  -1.934  -1.934
  894    HA   MET 111           HA       MET 111  -5.510   0.822   0.822
  895   1HB   MET 111          2HB       MET 111  -7.007   1.318   1.318
  896   2HB   MET 111          1HB       MET 111  -5.696   0.215   0.215
  897   1HG   MET 111          2HG       MET 111  -7.113  -1.635  -1.635
  898   2HG   MET 111          1HG       MET 111  -8.330  -0.891  -0.891
  899   1HE   MET 111          1HE       MET 111  -6.159  -0.157  -0.157
  900   2HE   MET 111          3HE       MET 111  -7.165  -0.279  -0.279
  901   3HE   MET 111          2HE       MET 111  -6.943   1.278   1.278
  902    H    GLU 112           H        GLU 112  -6.885   2.194   2.194
  903    HA   GLU 112           HA       GLU 112  -9.563   1.142   1.142
  904   1HB   GLU 112          2HB       GLU 112  -7.829   0.853   0.853
  905   2HB   GLU 112          1HB       GLU 112  -7.666   2.608   2.608
  906   1HG   GLU 112          2HG       GLU 112 -10.366   2.375   2.375
  907   2HG   GLU 112          1HG       GLU 112  -9.871   0.898   0.898
  908    H    LEU 113           H        LEU 113 -11.154   2.762   2.762
  909    HA   LEU 113           HA       LEU 113 -10.329   5.470   5.470
  910   1HB   LEU 113          2HB       LEU 113 -12.238   3.725   3.725
  911   2HB   LEU 113          1HB       LEU 113 -13.201   4.764   4.764
  912    HG   LEU 113           HG       LEU 113 -13.035   5.489   5.489
  913   1HD1  LEU 113          2HD1      LEU 113 -13.683   7.052   7.052
  914   2HD1  LEU 113          1HD1      LEU 113 -11.990   7.422   7.422
  915   3HD1  LEU 113          3HD1      LEU 113 -12.721   7.864   7.864
  916   1HD2  LEU 113          1HD2      LEU 113 -10.275   5.114   5.114
  917   2HD2  LEU 113          3HD2      LEU 113 -11.045   5.762   5.762
  918   3HD2  LEU 113          2HD2      LEU 113 -10.499   6.853   6.853
  919    H    THR 114           H        THR 114 -10.937   7.251   7.251
  920    HA   THR 114           HA       THR 114 -11.767   6.524   6.524
  921    HB   THR 114           HB       THR 114 -11.059   8.703   8.703
  922    HG1  THR 114           HG1      THR 114 -10.794  10.343  10.343
  923   1HG2  THR 114          3HG2      THR 114  -9.226   7.143   7.143
  924   2HG2  THR 114          2HG2      THR 114  -9.224   7.815   7.815
  925   3HG2  THR 114          1HG2      THR 114  -8.776   8.829   8.829
  926    H    ASN 115           H        ASN 115 -13.469   7.793   7.793
  927    HA   ASN 115           HA       ASN 115 -15.928   7.768   7.768
  928   1HB   ASN 115          2HB       ASN 115 -15.174   8.028   8.028
  929   2HB   ASN 115          1HB       ASN 115 -15.856   9.614   9.614
  930   1HD2  ASN 115          2HD2      ASN 115 -19.028   7.912   7.912
  931   2HD2  ASN 115          1HD2      ASN 115 -17.874   8.869   8.869
  932    H    ASP 116           H        ASP 116 -13.460  10.212  10.212
  933    HA   ASP 116           HA       ASP 116 -15.248  12.383  12.383
  934   1HB   ASP 116          2HB       ASP 116 -12.219  12.293  12.293
  935   2HB   ASP 116          1HB       ASP 116 -13.202  13.741  13.741
  936    H    GLY 117           H        GLY 117 -13.020  10.079  10.079
  937   1HA   GLY 117          2HA       GLY 117 -13.667   9.592   9.592
  938   2HA   GLY 117          1HA       GLY 117 -13.515  11.328  11.328
  939    H    GLU 118           H        GLU 118 -11.131  10.856  10.856
  940    HA   GLU 118           HA       GLU 118  -8.995  11.119  11.119
  941   1HB   GLU 118          2HB       GLU 118  -8.922  10.017  10.017
  942   2HB   GLU 118          1HB       GLU 118  -7.526  10.596  10.596
  943   1HG   GLU 118          2HG       GLU 118  -9.016  12.773  12.773
  944   2HG   GLU 118          1HG       GLU 118  -9.788  12.154  12.154
  945    H    LEU 119           H        LEU 119  -7.119   9.424   9.424
  946    HA   LEU 119           HA       LEU 119  -8.167   6.640   6.640
  947   1HB   LEU 119          2HB       LEU 119  -8.570   7.689   7.689
  948   2HB   LEU 119          1HB       LEU 119  -6.834   7.927   7.927
  949    HG   LEU 119           HG       LEU 119  -8.037   5.198   5.198
  950   1HD1  LEU 119          1HD1      LEU 119  -7.789   6.781   6.781
  951   2HD1  LEU 119          3HD1      LEU 119  -7.598   5.028   5.028
  952   3HD1  LEU 119          2HD1      LEU 119  -9.105   5.736   5.736
  953   1HD2  LEU 119          1HD2      LEU 119  -5.379   6.332   6.332
  954   2HD2  LEU 119          3HD2      LEU 119  -5.742   4.964   4.964
  955   3HD2  LEU 119          2HD2      LEU 119  -5.843   4.781   4.781
  956    H    ILE 120           H        ILE 120  -6.721   5.699   5.699
  957    HA   ILE 120           HA       ILE 120  -3.831   6.377   6.377
  958    HB   ILE 120           HB       ILE 120  -4.712   6.583   6.583
  959   1HG1  ILE 120          2HG1      ILE 120  -2.390   5.583   5.583
  960   2HG1  ILE 120          1HG1      ILE 120  -3.016   5.421   5.421
  961   1HG2  ILE 120          1HG2      ILE 120  -5.924   3.964   3.964
  962   2HG2  ILE 120          3HG2      ILE 120  -5.322   4.137   4.137
  963   3HG2  ILE 120          2HG2      ILE 120  -6.525   5.266   5.266
  964   1HD1  ILE 120          3HD1      ILE 120  -3.849   3.129   3.129
  965   2HD1  ILE 120          2HD1      ILE 120  -2.114   3.356   3.356
  966   3HD1  ILE 120          1HD1      ILE 120  -2.807   3.181   3.181
  967    H    LEU 121           H        LEU 121  -2.320   4.598   4.598
  968    HA   LEU 121           HA       LEU 121  -3.619   2.025   2.025
  969   1HB   LEU 121          2HB       LEU 121  -3.223   3.373   3.373
  970   2HB   LEU 121          1HB       LEU 121  -1.517   3.492   3.492
  971    HG   LEU 121           HG       LEU 121  -2.259   0.716   0.716
  972   1HD1  LEU 121          3HD1      LEU 121  -4.090   1.669   1.669
  973   2HD1  LEU 121          2HD1      LEU 121  -2.778   1.873   1.873
  974   3HD1  LEU 121          1HD1      LEU 121  -3.171   0.267   0.267
  975   1HD2  LEU 121          2HD2      LEU 121  -0.474   2.430   2.430
  976   2HD2  LEU 121          1HD2      LEU 121  -0.016   1.307   1.307
  977   3HD2  LEU 121          3HD2      LEU 121  -0.611   0.691   0.691
  978    H    THR 122           H        THR 122  -2.515   0.274   0.274
  979    HA   THR 122           HA       THR 122   0.211   0.771   0.771
  980    HB   THR 122           HB       THR 122  -0.889  -1.719  -1.719
  981    HG1  THR 122           HG1      THR 122  -2.700  -0.901  -0.901
  982   1HG2  THR 122          2HG2      THR 122   0.829  -0.145  -0.145
  983   2HG2  THR 122          1HG2      THR 122  -0.531   0.861   0.861
  984   3HG2  THR 122          3HG2      THR 122  -0.385  -0.789  -0.789
  985    H    MET 123           H        MET 123   1.557  -1.352  -1.352
  986    HA   MET 123           HA       MET 123   0.897  -2.993  -2.993
  987   1HB   MET 123          2HB       MET 123   3.472  -1.409  -1.409
  988   2HB   MET 123          1HB       MET 123   3.058  -2.527  -2.527
  989   1HG   MET 123          2HG       MET 123   0.959  -1.036  -1.036
  990   2HG   MET 123          1HG       MET 123   1.843   0.161   0.161
  991   1HE   MET 123          3HE       MET 123   0.725  -0.865  -0.865
  992   2HE   MET 123          2HE       MET 123   1.784  -0.318  -0.318
  993   3HE   MET 123          1HE       MET 123   1.992  -1.931  -1.931
  994    H    THR 124           H        THR 124   2.534  -4.757  -4.757
  995    HA   THR 124           HA       THR 124   4.143  -5.396  -5.396
  996    HB   THR 124           HB       THR 124   2.216  -7.469  -7.469
  997    HG1  THR 124           HG1      THR 124   0.702  -6.262  -6.262
  998   1HG2  THR 124          2HG2      THR 124   4.365  -7.560  -7.560
  999   2HG2  THR 124          1HG2      THR 124   3.016  -7.343  -7.343
 1000   3HG2  THR 124          3HG2      THR 124   3.031  -8.710  -8.710
 1001    H    ALA 125           H        ALA 125   5.763  -6.902  -6.902
 1002    HA   ALA 125           HA       ALA 125   5.833  -8.220  -8.220
 1003   1HB   ALA 125          1HB       ALA 125   7.469  -5.819  -5.819
 1004   2HB   ALA 125          3HB       ALA 125   8.265  -7.122  -7.122
 1005   3HB   ALA 125          2HB       ALA 125   6.833  -6.345  -6.345
 1006    H    ASP 126           H        ASP 126   6.002 -10.155 -10.155
 1007    HA   ASP 126           HA       ASP 126   7.232 -11.962 -11.962
 1008   1HB   ASP 126          2HB       ASP 126   9.281 -10.197 -10.197
 1009   2HB   ASP 126          1HB       ASP 126   9.659 -10.625 -10.625
 1010    H    ASP 127           H        ASP 127   8.663  -9.336  -9.336
 1011    HA   ASP 127           HA       ASP 127   6.827  -9.948  -9.948
 1012   1HB   ASP 127          2HB       ASP 127   9.788 -10.495 -10.495
 1013   2HB   ASP 127          1HB       ASP 127   8.957 -10.034 -10.034
 1014    H    VAL 128           H        VAL 128   7.585  -7.703  -7.703
 1015    HA   VAL 128           HA       VAL 128   8.223  -5.664  -5.664
 1016    HB   VAL 128           HB       VAL 128   9.167  -4.280  -4.280
 1017   1HG1  VAL 128          1HG1      VAL 128  10.396  -6.390  -6.390
 1018   2HG1  VAL 128          3HG1      VAL 128  10.416  -6.926  -6.926
 1019   3HG1  VAL 128          2HG1      VAL 128  11.177  -5.399  -5.399
 1020   1HG2  VAL 128          3HG2      VAL 128   7.814  -6.289  -6.289
 1021   2HG2  VAL 128          2HG2      VAL 128   8.225  -4.613  -4.613
 1022   3HG2  VAL 128          1HG2      VAL 128   9.440  -5.877  -5.877
 1023    H    VAL 129           H        VAL 129   7.297  -3.439  -3.439
 1024    HA   VAL 129           HA       VAL 129   4.776  -3.802  -3.802
 1025    HB   VAL 129           HB       VAL 129   4.928  -3.402  -3.402
 1026   1HG1  VAL 129          3HG1      VAL 129   3.034  -1.962  -1.962
 1027   2HG1  VAL 129          2HG1      VAL 129   2.380  -2.652  -2.652
 1028   3HG1  VAL 129          1HG1      VAL 129   3.679  -1.462  -1.462
 1029   1HG2  VAL 129          3HG2      VAL 129   3.385  -5.018  -5.018
 1030   2HG2  VAL 129          2HG2      VAL 129   4.187  -5.528  -5.528
 1031   3HG2  VAL 129          1HG2      VAL 129   2.642  -4.681  -4.681
 1032    H    CYS 130           H        CYS 130   4.696  -2.135  -2.135
 1033    HA   CYS 130           HA       CYS 130   6.097   0.386   0.386
 1034   1HB   CYS 130          2HB       CYS 130   6.281  -0.972  -0.972
 1035   2HB   CYS 130          1HB       CYS 130   4.834  -0.051  -0.051
 1036    HG   CYS 130           HG       CYS 130   6.367   1.815   1.815
 1037    H    THR 131           H        THR 131   4.849   1.995   1.995
 1038    HA   THR 131           HA       THR 131   1.947   2.020   2.020
 1039    HB   THR 131           HB       THR 131   3.293   3.185   3.185
 1040    HG1  THR 131           HG1      THR 131   2.330   1.418   1.418
 1041   1HG2  THR 131          3HG2      THR 131   0.478   3.100   3.100
 1042   2HG2  THR 131          2HG2      THR 131   0.762   3.069   3.069
 1043   3HG2  THR 131          1HG2      THR 131   1.342   4.427   4.427
 1044    H    ARG 132           H        ARG 132   1.061   3.944   3.944
 1045    HA   ARG 132           HA       ARG 132   2.626   6.429   6.429
 1046   1HB   ARG 132          2HB       ARG 132   1.613   5.116   5.116
 1047   2HB   ARG 132          1HB       ARG 132   2.372   6.705   6.705
 1048   1HG   ARG 132          2HG       ARG 132   4.417   5.608   5.608
 1049   2HG   ARG 132          1HG       ARG 132   3.656   4.041   4.041
 1050   1HD   ARG 132          2HD       ARG 132   3.683   5.889   5.889
 1051   2HD   ARG 132          1HD       ARG 132   5.250   5.250   5.250
 1052    HE   ARG 132           HE       ARG 132   4.115   2.947   2.947
 1053   1HH1  ARG 132          2HH1      ARG 132   1.408   3.873   3.873
 1054   2HH1  ARG 132          1HH1      ARG 132   1.444   3.803   3.803
 1055   1HH2  ARG 132          1HH2      ARG 132   4.903   3.656   3.656
 1056   2HH2  ARG 132          2HH2      ARG 132   3.423   3.680   3.680
 1057    H    VAL 133           H        VAL 133   1.052   7.622   7.622
 1058    HA   VAL 133           HA       VAL 133  -1.783   7.192   7.192
 1059    HB   VAL 133           HB       VAL 133  -0.336   9.574   9.574
 1060   1HG1  VAL 133          2HG1      VAL 133  -2.705  10.008  10.008
 1061   2HG1  VAL 133          1HG1      VAL 133  -3.206   8.660   8.660
 1062   3HG1  VAL 133          3HG1      VAL 133  -2.469  10.089  10.089
 1063   1HG2  VAL 133          3HG2      VAL 133   0.046   7.268   7.268
 1064   2HG2  VAL 133          2HG2      VAL 133  -0.584   8.512   8.512
 1065   3HG2  VAL 133          1HG2      VAL 133  -1.668   7.289   7.289
 1066    H    TYR 134           H        TYR 134  -3.106   8.090   8.090
 1067    HA   TYR 134           HA       TYR 134  -1.886  10.185  10.185
 1068   1HB   TYR 134          2HB       TYR 134  -3.554   7.778   7.778
 1069   2HB   TYR 134          1HB       TYR 134  -3.601   9.192   9.192
 1070    HD1  TYR 134           HD2      TYR 134  -1.612   9.956   9.956
 1071    HD2  TYR 134           HD1      TYR 134  -1.522   6.433   6.433
 1072    HE1  TYR 134           HE2      TYR 134   0.530   9.284   9.284
 1073    HE2  TYR 134           HE1      TYR 134   0.622   5.755   5.755
 1074    HH   TYR 134           HH       TYR 134   1.738   6.908   6.908
 1075    H    VAL 135           H        VAL 135  -2.919  12.069  12.069
 1076    HA   VAL 135           HA       VAL 135  -5.774  12.052  12.052
 1077    HB   VAL 135           HB       VAL 135  -3.589  13.577  13.577
 1078   1HG1  VAL 135          1HG1      VAL 135  -5.450  15.334  15.334
 1079   2HG1  VAL 135          3HG1      VAL 135  -4.247  15.920  15.920
 1080   3HG1  VAL 135          2HG1      VAL 135  -3.733  15.076  15.076
 1081   1HG2  VAL 135          3HG2      VAL 135  -5.613  12.971  12.971
 1082   2HG2  VAL 135          2HG2      VAL 135  -5.306  14.704  14.704
 1083   3HG2  VAL 135          1HG2      VAL 135  -6.559  14.097  14.097
 1084    H    ARG 136           H        ARG 136  -7.331  12.938  12.938
 1085    HA   ARG 136           HA       ARG 136  -6.906  12.810  12.810
 1086   1HB   ARG 136          2HB       ARG 136  -9.010  13.719  13.719
 1087   2HB   ARG 136          1HB       ARG 136  -8.860  14.818  14.818
 1088   1HG   ARG 136          2HG       ARG 136  -9.343  13.186  13.186
 1089   2HG   ARG 136          1HG       ARG 136  -8.778  11.878  11.878
 1090   1HD   ARG 136          2HD       ARG 136 -11.365  13.435  13.435
 1091   2HD   ARG 136          1HD       ARG 136 -11.181  11.717  11.717
 1092    HE   ARG 136           HE       ARG 136  -9.944  12.052  12.052
 1093   1HH1  ARG 136          2HH1      ARG 136 -12.785  10.891  10.891
 1094   2HH1  ARG 136          1HH1      ARG 136 -13.759  11.535  11.535
 1095   1HH2  ARG 136          1HH2      ARG 136 -11.298  13.699  13.699
 1096   2HH2  ARG 136          2HH2      ARG 136 -12.917  13.128  13.128
 1097    H    GLU 137           HN       GLU 137  -5.930  14.002  14.002
 1098    HA   GLU 137           HA       GLU 137  -4.237  16.155  16.155
 1099   1HB   GLU 137          2HB       GLU 137  -4.227  14.790  14.790
 1100   2HB   GLU 137          1HB       GLU 137  -5.731  15.558  15.558
 1101   1HG   GLU 137          2HG       GLU 137  -4.524  17.152  17.152
 1102   2HG   GLU 137          1HG       GLU 137  -4.021  17.685  17.685

  Start of MODEL    6
    1   1H    PRO   1          1H        PRO   1  16.696   7.419   7.419
    2   2H    PRO   1          2H        PRO   1  16.255   6.619   6.619
    3    HA   PRO   1           HA       PRO   1  16.492   4.645   4.645
    4   1HB   PRO   1          2HB       PRO   1  19.091   4.802   4.802
    5   2HB   PRO   1          1HB       PRO   1  18.634   3.989   3.989
    6   1HG   PRO   1          2HG       PRO   1  20.133   6.410   6.410
    7   2HG   PRO   1          1HG       PRO   1  19.676   5.590   5.590
    8   1HD   PRO   1          1HD       PRO   1  18.619   8.031   8.031
    9   2HD   PRO   1          2HD       PRO   1  18.162   7.203   7.203
   10    H    ASN   2           H        ASN   2  15.233   6.615   6.615
   11    HA   ASN   2           HA       ASN   2  15.669   5.466   5.466
   12   1HB   ASN   2          2HB       ASN   2  16.296   8.295   8.295
   13   2HB   ASN   2          1HB       ASN   2  15.540   7.996   7.996
   14   1HD2  ASN   2          2HD2      ASN   2  18.400   6.374   6.374
   15   2HD2  ASN   2          1HD2      ASN   2  16.730   6.627   6.627
   16    H    PHE   3           H        PHE   3  13.704   5.034   5.034
   17    HA   PHE   3           HA       PHE   3  11.334   6.440   6.440
   18   1HB   PHE   3          2HB       PHE   3  11.618   3.942   3.942
   19   2HB   PHE   3          1HB       PHE   3  10.091   4.600   4.600
   20    HD1  PHE   3           HD1      PHE   3  13.436   3.703   3.703
   21    HD2  PHE   3           HD2      PHE   3   9.156   3.565   3.565
   22    HE1  PHE   3           HE1      PHE   3  13.647   2.414   2.414
   23    HE2  PHE   3           HE2      PHE   3   9.376   2.265   2.265
   24    HZ   PHE   3           HZ       PHE   3  11.624   1.684   1.684
   25    H    SER   4           H        SER   4  13.399   6.556   6.556
   26    HA   SER   4           HA       SER   4  11.507   6.975   6.975
   27   1HB   SER   4          2HB       SER   4  13.394   7.746   7.746
   28   2HB   SER   4          1HB       SER   4  13.922   6.388   6.388
   29    HG   SER   4           HG       SER   4  15.000   7.744   7.744
   30    H    GLY   5           H        GLY   5  10.140   8.618   8.618
   31   1HA   GLY   5          2HA       GLY   5  10.685  11.292  11.292
   32   2HA   GLY   5          1HA       GLY   5  10.454  11.129  11.129
   33    H    ASN   6           H        ASN   6   8.548  12.620  12.620
   34    HA   ASN   6           HA       ASN   6   6.238  11.027  11.027
   35   1HB   ASN   6          2HB       ASN   6   6.800  13.972  13.972
   36   2HB   ASN   6          1HB       ASN   6   5.129  13.406  13.406
   37   1HD2  ASN   6          2HD2      ASN   6   5.641  12.064  12.064
   38   2HD2  ASN   6          1HD2      ASN   6   5.116  11.453  11.453
   39    H    TRP   7           H        TRP   7   4.170  11.435  11.435
   40    HA   TRP   7           HA       TRP   7   4.857  11.823  11.823
   41   1HB   TRP   7          2HB       TRP   7   3.828   9.224   9.224
   42   2HB   TRP   7          1HB       TRP   7   3.889   9.588   9.588
   43    HD1  TRP   7           HD1      TRP   7   6.001   8.438   8.438
   44    HE1  TRP   7           HE1      TRP   7   8.466   8.191   8.191
   45    HE3  TRP   7           HE3      TRP   7   5.715  10.740  10.740
   46    HZ2  TRP   7           HZ2      TRP   7  10.093   8.922   8.922
   47    HZ3  TRP   7           HZ3      TRP   7   7.721  10.996  10.996
   48    HH2  TRP   7           HH2      TRP   7   9.893  10.086  10.086
   49    H    LYS   8           H        LYS   8   3.309  12.988  12.988
   50    HA   LYS   8           HA       LYS   8   0.512  12.685  12.685
   51   1HB   LYS   8          2HB       LYS   8   1.869  15.082  15.082
   52   2HB   LYS   8          1HB       LYS   8   0.150  14.995  14.995
   53   1HG   LYS   8          2HG       LYS   8   0.611  14.787  14.787
   54   2HG   LYS   8          1HG       LYS   8   2.338  14.589  14.589
   55   1HD   LYS   8          2HD       LYS   8   2.316  16.839  16.839
   56   2HD   LYS   8          1HD       LYS   8   2.007  16.942  16.942
   57   1HE   LYS   8          2HE       LYS   8   0.234  18.214  18.214
   58   2HE   LYS   8          1HE       LYS   8  -0.524  16.628  16.628
   59   1HZ   LYS   8          2HZ       LYS   8   0.543  16.674  16.674
   60   2HZ   LYS   8          1HZ       LYS   8   0.591  18.356  18.356
   61   3HZ   LYS   8          3HZ       LYS   8  -0.894  17.538  17.538
   62    H    ILE   9           H        ILE   9  -0.579  11.456  11.456
   63    HA   ILE   9           HA       ILE   9   0.223  10.777  10.777
   64    HB   ILE   9           HB       ILE   9  -1.407   9.496   9.496
   65   1HG1  ILE   9          2HG1      ILE   9  -2.622  10.666  10.666
   66   2HG1  ILE   9          1HG1      ILE   9  -1.488   9.317   9.317
   67   1HG2  ILE   9          3HG2      ILE   9  -3.117  11.977  11.977
   68   2HG2  ILE   9          2HG2      ILE   9  -3.761  10.417  10.417
   69   3HG2  ILE   9          1HG2      ILE   9  -2.560  11.245  11.245
   70   1HD1  ILE   9          2HD1      ILE   9  -3.320   8.343   8.343
   71   2HD1  ILE   9          1HD1      ILE   9  -4.379   9.405   9.405
   72   3HD1  ILE   9          3HD1      ILE   9  -3.472   8.132   8.132
   73    H    ILE  10           H        ILE  10  -0.366  11.515  11.515
   74    HA   ILE  10           HA       ILE  10  -1.769  14.147  14.147
   75    HB   ILE  10           HB       ILE  10  -0.212  14.828  14.828
   76   1HG1  ILE  10          2HG1      ILE  10   1.974  13.165  13.165
   77   2HG1  ILE  10          1HG1      ILE  10   0.645  12.012  12.012
   78   1HG2  ILE  10          3HG2      ILE  10   0.233  15.266  15.266
   79   2HG2  ILE  10          2HG2      ILE  10   1.321  13.878  13.878
   80   3HG2  ILE  10          1HG2      ILE  10   1.667  15.286  15.286
   81   1HD1  ILE  10          2HD1      ILE  10  -0.309  13.406  13.406
   82   2HD1  ILE  10          1HD1      ILE  10   1.384  13.853  13.853
   83   3HD1  ILE  10          3HD1      ILE  10   0.907  12.156  12.156
   84    H    ARG  11           H        ARG  11  -1.305  10.974  10.974
   85    HA   ARG  11           HA       ARG  11  -3.588  11.524  11.524
   86   1HB   ARG  11          2HB       ARG  11  -1.003  11.521  11.521
   87   2HB   ARG  11          1HB       ARG  11  -1.508   9.856   9.856
   88   1HG   ARG  11          2HG       ARG  11  -3.649  10.843  10.843
   89   2HG   ARG  11          1HG       ARG  11  -2.806  12.391  12.391
   90   1HD   ARG  11          2HD       ARG  11  -0.911  10.763  10.763
   91   2HD   ARG  11          1HD       ARG  11  -2.396  10.030  10.030
   92    HE   ARG  11           HE       ARG  11  -1.513  12.821  12.821
   93   1HH1  ARG  11          2HH1      ARG  11  -4.545  11.965  11.965
   94   2HH1  ARG  11          1HH1      ARG  11  -4.943  11.860  11.860
   95   1HH2  ARG  11          1HH2      ARG  11  -1.642  11.922  11.922
   96   2HH2  ARG  11          2HH2      ARG  11  -3.300  11.836  11.836
   97    H    SER  12           H        SER  12  -4.267   9.355   9.355
   98    HA   SER  12           HA       SER  12  -3.666   6.796   6.796
   99   1HB   SER  12          2HB       SER  12  -4.222   7.341   7.341
  100   2HB   SER  12          1HB       SER  12  -5.637   8.266   8.266
  101    HG   SER  12           HG       SER  12  -6.428   6.332   6.332
  102    H    GLU  13           H        GLU  13  -5.661   5.271   5.271
  103    HA   GLU  13           HA       GLU  13  -7.863   6.485   6.485
  104   1HB   GLU  13          2HB       GLU  13  -7.269   5.580   5.580
  105   2HB   GLU  13          1HB       GLU  13  -6.004   6.661   6.661
  106   1HG   GLU  13          2HG       GLU  13  -5.355   4.071   4.071
  107   2HG   GLU  13          1HG       GLU  13  -5.804   3.874   3.874
  108    H    ASN  14           H        ASN  14  -7.433   4.420   4.420
  109    HA   ASN  14           HA       ASN  14  -9.391   2.517   2.517
  110   1HB   ASN  14          2HB       ASN  14  -7.274   0.824   0.824
  111   2HB   ASN  14          1HB       ASN  14  -8.094   0.745   0.745
  112   1HD2  ASN  14          2HD2      ASN  14  -5.094   1.643   1.643
  113   2HD2  ASN  14          1HD2      ASN  14  -6.462   0.655   0.655
  114    H    PHE  15           H        PHE  15  -9.079   4.437   4.437
  115    HA   PHE  15           HA       PHE  15  -8.569   3.109   3.109
  116   1HB   PHE  15          2HB       PHE  15  -8.635   5.614   5.614
  117   2HB   PHE  15          1HB       PHE  15 -10.379   5.476   5.476
  118    HD1  PHE  15           HD2      PHE  15  -9.707   3.091   3.091
  119    HD2  PHE  15           HD1      PHE  15  -9.497   7.341   7.341
  120    HE1  PHE  15           HE2      PHE  15  -9.919   3.382   3.382
  121    HE2  PHE  15           HE1      PHE  15  -9.695   7.625   7.625
  122    HZ   PHE  15           HZ       PHE  15  -9.907   5.629   5.629
  123    H    GLU  16           H        GLU  16 -11.705   4.184   4.184
  124    HA   GLU  16           HA       GLU  16 -13.308   2.792   2.792
  125   1HB   GLU  16          2HB       GLU  16 -15.128   3.070   3.070
  126   2HB   GLU  16          1HB       GLU  16 -14.218   4.557   4.557
  127   1HG   GLU  16          2HG       GLU  16 -12.758   3.560   3.560
  128   2HG   GLU  16          1HG       GLU  16 -14.292   2.778   2.778
  129    H    GLU  17           H        GLU  17 -11.805   1.643   1.643
  130    HA   GLU  17           HA       GLU  17 -13.442  -0.731  -0.731
  131   1HB   GLU  17          2HB       GLU  17 -11.900  -1.566  -1.566
  132   2HB   GLU  17          1HB       GLU  17 -12.245   0.133   0.133
  133   1HG   GLU  17          2HG       GLU  17 -10.095   0.732   0.732
  134   2HG   GLU  17          1HG       GLU  17  -9.937  -0.245  -0.245
  135    H    LEU  18           H        LEU  18 -10.557   0.073   0.073
  136    HA   LEU  18           HA       LEU  18  -9.913  -2.702  -2.702
  137   1HB   LEU  18          2HB       LEU  18  -8.300  -0.631  -0.631
  138   2HB   LEU  18          1HB       LEU  18  -8.900  -0.349  -0.349
  139    HG   LEU  18           HG       LEU  18  -8.314  -2.720  -2.720
  140   1HD1  LEU  18          1HD1      LEU  18  -7.548  -2.651  -2.651
  141   2HD1  LEU  18          3HD1      LEU  18  -6.445  -3.502  -3.502
  142   3HD1  LEU  18          2HD1      LEU  18  -8.134  -3.995  -3.995
  143   1HD2  LEU  18          2HD2      LEU  18  -6.174  -0.804  -0.804
  144   2HD2  LEU  18          1HD2      LEU  18  -6.748  -1.065  -1.065
  145   3HD2  LEU  18          3HD2      LEU  18  -5.783  -2.303  -2.303
  146    H    LEU  19           H        LEU  19 -11.970  -0.226  -0.226
  147    HA   LEU  19           HA       LEU  19 -12.084  -1.555  -1.555
  148   1HB   LEU  19          2HB       LEU  19 -13.956   0.629   0.629
  149   2HB   LEU  19          1HB       LEU  19 -13.461   0.244   0.244
  150    HG   LEU  19           HG       LEU  19 -11.853   1.613   1.613
  151   1HD1  LEU  19          2HD1      LEU  19 -13.431   2.578   2.578
  152   2HD1  LEU  19          1HD1      LEU  19 -11.804   2.666   2.666
  153   3HD1  LEU  19          3HD1      LEU  19 -12.174   3.474   3.474
  154   1HD2  LEU  19          1HD2      LEU  19 -10.850  -0.156  -0.156
  155   2HD2  LEU  19          3HD2      LEU  19  -9.967   0.634   0.634
  156   3HD2  LEU  19          2HD2      LEU  19 -10.243   1.480   1.480
  157    H    LYS  20           H        LYS  20 -13.680  -1.777  -1.777
  158    HA   LYS  20           HA       LYS  20 -16.128  -2.986  -2.986
  159   1HB   LYS  20          2HB       LYS  20 -15.426  -3.343  -3.343
  160   2HB   LYS  20          1HB       LYS  20 -16.991  -3.030  -3.030
  161   1HG   LYS  20          2HG       LYS  20 -15.625  -0.716  -0.716
  162   2HG   LYS  20          1HG       LYS  20 -14.970  -1.145  -1.145
  163   1HD   LYS  20          2HD       LYS  20 -17.920  -0.917  -0.917
  164   2HD   LYS  20          1HD       LYS  20 -16.973   0.303   0.303
  165   1HE   LYS  20          2HE       LYS  20 -16.430  -1.363  -1.363
  166   2HE   LYS  20          1HE       LYS  20 -17.454  -2.540  -2.540
  167   1HZ   LYS  20          3HZ       LYS  20 -19.263  -0.801  -0.801
  168   2HZ   LYS  20          2HZ       LYS  20 -18.252  -0.005  -0.005
  169   3HZ   LYS  20          1HZ       LYS  20 -18.805  -1.577  -1.577
  170    H    VAL  21           H        VAL  21 -13.092  -3.910  -3.910
  171    HA   VAL  21           HA       VAL  21 -13.698  -6.735  -6.735
  172    HB   VAL  21           HB       VAL  21 -11.969  -5.533  -5.533
  173   1HG1  VAL  21          1HG1      VAL  21 -11.129  -4.092  -4.092
  174   2HG1  VAL  21          3HG1      VAL  21 -10.375  -5.488  -5.488
  175   3HG1  VAL  21          2HG1      VAL  21  -9.837  -4.944  -4.944
  176   1HG2  VAL  21          3HG2      VAL  21 -10.938  -7.792  -7.792
  177   2HG2  VAL  21          2HG2      VAL  21 -11.858  -7.978  -7.978
  178   3HG2  VAL  21          1HG2      VAL  21 -10.231  -7.298  -7.298
  179    H    LEU  22           H        LEU  22 -12.054  -4.652  -4.652
  180    HA   LEU  22           HA       LEU  22 -11.166  -6.684  -6.684
  181   1HB   LEU  22          2HB       LEU  22 -11.448  -3.733  -3.733
  182   2HB   LEU  22          1HB       LEU  22 -11.517  -4.438  -4.438
  183    HG   LEU  22           HG       LEU  22  -9.344  -5.450  -5.450
  184   1HD1  LEU  22          2HD1      LEU  22  -9.653  -6.013  -6.013
  185   2HD1  LEU  22          1HD1      LEU  22  -9.286  -4.333  -4.333
  186   3HD1  LEU  22          3HD1      LEU  22  -8.071  -5.349  -5.349
  187   1HD2  LEU  22          2HD2      LEU  22  -9.709  -2.848  -2.848
  188   2HD2  LEU  22          1HD2      LEU  22  -8.083  -3.495  -3.495
  189   3HD2  LEU  22          3HD2      LEU  22  -8.935  -2.760  -2.760
  190    H    GLY  23           H        GLY  23 -13.978  -4.557  -4.557
  191   1HA   GLY  23          2HA       GLY  23 -15.235  -6.075  -6.075
  192   2HA   GLY  23          1HA       GLY  23 -15.752  -4.489  -4.489
  193    H    VAL  24           H        VAL  24 -17.902  -5.512  -5.512
  194    HA   VAL  24           HA       VAL  24 -18.422  -6.765  -6.765
  195    HB   VAL  24           HB       VAL  24 -20.039  -8.344  -8.344
  196   1HG1  VAL  24          3HG1      VAL  24 -17.492  -8.770  -8.770
  197   2HG1  VAL  24          2HG1      VAL  24 -17.345  -8.781  -8.781
  198   3HG1  VAL  24          1HG1      VAL  24 -18.398  -9.945  -9.945
  199   1HG2  VAL  24          3HG2      VAL  24 -18.731  -7.266  -7.266
  200   2HG2  VAL  24          2HG2      VAL  24 -20.433  -7.129  -7.129
  201   3HG2  VAL  24          1HG2      VAL  24 -19.746  -8.707  -8.707
  202    H    ASN  25           H        ASN  25 -19.746  -5.121  -5.121
  203    HA   ASN  25           HA       ASN  25 -22.358  -4.613  -4.613
  204   1HB   ASN  25          2HB       ASN  25 -21.107  -4.159  -4.159
  205   2HB   ASN  25          1HB       ASN  25 -21.071  -2.540  -2.540
  206   1HD2  ASN  25          2HD2      ASN  25 -24.436  -1.951  -1.951
  207   2HD2  ASN  25          1HD2      ASN  25 -22.905  -1.322  -1.322
  208    H    VAL  26           H        VAL  26 -22.493  -1.725  -1.725
  209    HA   VAL  26           HA       VAL  26 -20.926  -0.949  -0.949
  210    HB   VAL  26           HB       VAL  26 -23.611   0.263   0.263
  211   1HG1  VAL  26          3HG1      VAL  26 -21.739   0.757   0.757
  212   2HG1  VAL  26          2HG1      VAL  26 -22.609  -0.532  -0.532
  213   3HG1  VAL  26          1HG1      VAL  26 -23.462   0.930   0.930
  214   1HG2  VAL  26          1HG2      VAL  26 -23.106  -2.483  -2.483
  215   2HG2  VAL  26          3HG2      VAL  26 -24.253  -2.032  -2.032
  216   3HG2  VAL  26          2HG2      VAL  26 -24.544  -1.547  -1.547
  217    H    MET  27           H        MET  27 -22.728   0.284   0.284
  218    HA   MET  27           HA       MET  27 -21.565   2.928   2.928
  219   1HB   MET  27          2HB       MET  27 -23.640   1.879   1.879
  220   2HB   MET  27          1HB       MET  27 -22.403   1.823   1.823
  221   1HG   MET  27          2HG       MET  27 -22.110   4.144   4.144
  222   2HG   MET  27          1HG       MET  27 -22.768   4.326   4.326
  223   1HE   MET  27          1HE       MET  27 -23.344   6.158   6.158
  224   2HE   MET  27          3HE       MET  27 -24.922   6.094   6.094
  225   3HE   MET  27          2HE       MET  27 -23.568   5.167   5.167
  226    H    LEU  28           H        LEU  28 -20.591  -0.137  -0.137
  227    HA   LEU  28           HA       LEU  28 -18.629   0.684   0.684
  228   1HB   LEU  28          2HB       LEU  28 -19.387  -1.724  -1.724
  229   2HB   LEU  28          1HB       LEU  28 -17.663  -1.652  -1.652
  230    HG   LEU  28           HG       LEU  28 -18.857  -2.789  -2.789
  231   1HD1  LEU  28          3HD1      LEU  28 -16.883  -1.121  -1.121
  232   2HD1  LEU  28          2HD1      LEU  28 -18.115  -0.090  -0.090
  233   3HD1  LEU  28          1HD1      LEU  28 -17.792  -1.688  -1.688
  234   1HD2  LEU  28          2HD2      LEU  28 -20.389  -0.180  -0.180
  235   2HD2  LEU  28          1HD2      LEU  28 -21.043  -1.779  -1.779
  236   3HD2  LEU  28          3HD2      LEU  28 -20.429  -1.414  -1.414
  237    H    ARG  29           H        ARG  29 -18.586   0.861   0.861
  238    HA   ARG  29           HA       ARG  29 -15.634   1.069   1.069
  239   1HB   ARG  29          2HB       ARG  29 -17.643   1.232   1.232
  240   2HB   ARG  29          1HB       ARG  29 -15.893   1.090   1.090
  241   1HG   ARG  29          2HG       ARG  29 -16.244  -1.148  -1.148
  242   2HG   ARG  29          1HG       ARG  29 -16.514  -1.038  -1.038
  243   1HD   ARG  29          2HD       ARG  29 -18.428  -2.161  -2.161
  244   2HD   ARG  29          1HD       ARG  29 -18.956  -0.506  -0.506
  245    HE   ARG  29           HE       ARG  29 -18.461  -0.159  -0.159
  246   1HH1  ARG  29          1HH2      ARG  29 -18.086  -3.382  -3.382
  247   2HH1  ARG  29          2HH2      ARG  29 -19.349  -3.928  -3.928
  248   1HH2  ARG  29          2HH1      ARG  29 -20.647  -0.757  -0.757
  249   2HH2  ARG  29          1HH1      ARG  29 -20.797  -2.443  -2.443
  250    H    LYS  30           H        LYS  30 -18.493   3.019   3.019
  251    HA   LYS  30           HA       LYS  30 -17.059   5.359   5.359
  252   1HB   LYS  30          2HB       LYS  30 -19.571   4.766   4.766
  253   2HB   LYS  30          1HB       LYS  30 -19.781   5.468   5.468
  254   1HG   LYS  30          2HG       LYS  30 -20.128   7.284   7.284
  255   2HG   LYS  30          1HG       LYS  30 -18.470   7.493   7.493
  256   1HD   LYS  30          2HD       LYS  30 -18.093   7.692   7.692
  257   2HD   LYS  30          1HD       LYS  30 -17.969   5.938   5.938
  258   1HE   LYS  30          2HE       LYS  30 -20.175   5.605   5.605
  259   2HE   LYS  30          1HE       LYS  30 -20.610   7.295   7.295
  260   1HZ   LYS  30          2HZ       LYS  30 -18.523   6.413   6.413
  261   2HZ   LYS  30          1HZ       LYS  30 -20.144   6.672   6.672
  262   3HZ   LYS  30          3HZ       LYS  30 -19.208   7.961   7.961
  263    H    ILE  31           H        ILE  31 -17.789   4.060   4.060
  264    HA   ILE  31           HA       ILE  31 -17.411   6.603   6.603
  265    HB   ILE  31           HB       ILE  31 -17.408   3.747   3.747
  266   1HG1  ILE  31          2HG1      ILE  31 -19.571   5.832   5.832
  267   2HG1  ILE  31          1HG1      ILE  31 -19.527   4.769   4.769
  268   1HG2  ILE  31          1HG2      ILE  31 -17.429   6.442   6.442
  269   2HG2  ILE  31          3HG2      ILE  31 -17.861   4.933   4.933
  270   3HG2  ILE  31          2HG2      ILE  31 -16.230   5.160   5.160
  271   1HD1  ILE  31          1HD1      ILE  31 -19.270   3.543   3.543
  272   2HD1  ILE  31          3HD1      ILE  31 -20.865   4.068   4.068
  273   3HD1  ILE  31          2HD1      ILE  31 -19.971   2.867   2.867
  274    H    ALA  32           H        ALA  32 -15.409   3.948   3.948
  275    HA   ALA  32           HA       ALA  32 -13.087   4.771   4.771
  276   1HB   ALA  32          3HB       ALA  32 -13.536   2.728   2.728
  277   2HB   ALA  32          2HB       ALA  32 -11.927   3.077   3.077
  278   3HB   ALA  32          1HB       ALA  32 -13.176   2.441   2.441
  279    H    VAL  33           H        VAL  33 -14.463   5.416   5.416
  280    HA   VAL  33           HA       VAL  33 -12.065   6.531   6.531
  281    HB   VAL  33           HB       VAL  33 -14.929   7.080   7.080
  282   1HG1  VAL  33          3HG1      VAL  33 -12.320   6.944   6.944
  283   2HG1  VAL  33          2HG1      VAL  33 -13.902   7.281   7.281
  284   3HG1  VAL  33          1HG1      VAL  33 -13.185   8.416   8.416
  285   1HG2  VAL  33          1HG2      VAL  33 -13.849   4.523   4.523
  286   2HG2  VAL  33          3HG2      VAL  33 -15.201   4.969   4.969
  287   3HG2  VAL  33          2HG2      VAL  33 -13.567   4.916   4.916
  288    H    ALA  34           H        ALA  34 -14.916   7.715   7.715
  289    HA   ALA  34           HA       ALA  34 -14.185  10.516  10.516
  290   1HB   ALA  34          1HB       ALA  34 -16.547   9.799   9.799
  291   2HB   ALA  34          3HB       ALA  34 -16.144   9.172   9.172
  292   3HB   ALA  34          2HB       ALA  34 -16.045  10.904  10.904
  293    H    ALA  35           H        ALA  35 -13.725   7.929   7.929
  294    HA   ALA  35           HA       ALA  35 -12.779   9.492   9.492
  295   1HB   ALA  35          1HB       ALA  35 -13.454   7.098   7.098
  296   2HB   ALA  35          3HB       ALA  35 -12.036   6.652   6.652
  297   3HB   ALA  35          2HB       ALA  35 -11.837   7.379   7.379
  298    H    ALA  36           H        ALA  36 -11.146   7.995   7.995
  299    HA   ALA  36           HA       ALA  36  -8.492   8.665   8.665
  300   1HB   ALA  36          2HB       ALA  36  -9.785   7.524   7.524
  301   2HB   ALA  36          1HB       ALA  36  -8.496   8.628   8.628
  302   3HB   ALA  36          3HB       ALA  36  -8.147   7.268   7.268
  303    H    SER  37           H        SER  37 -10.382  10.133  10.133
  304    HA   SER  37           HA       SER  37 -10.254  12.284  12.284
  305   1HB   SER  37          2HB       SER  37 -10.209  14.118  14.118
  306   2HB   SER  37          1HB       SER  37 -11.603  13.049  13.049
  307    HG   SER  37           HG       SER  37  -9.465  13.054  13.054
  308    H    LYS  38           H        LYS  38  -7.922  11.155  11.155
  309    HA   LYS  38           HA       LYS  38  -5.666  11.635  11.635
  310   1HB   LYS  38          2HB       LYS  38  -6.070  14.353  14.353
  311   2HB   LYS  38          1HB       LYS  38  -4.871  13.891  13.891
  312   1HG   LYS  38          2HG       LYS  38  -7.029  13.308  13.308
  313   2HG   LYS  38          1HG       LYS  38  -7.784  14.483  14.483
  314   1HD   LYS  38          2HD       LYS  38  -5.158  15.258  15.258
  315   2HD   LYS  38          1HD       LYS  38  -6.519  15.197  15.197
  316   1HE   LYS  38          2HE       LYS  38  -6.683  16.638  16.638
  317   2HE   LYS  38          1HE       LYS  38  -6.129  17.437  17.437
  318   1HZ   LYS  38          1HZ       LYS  38  -8.229  16.729  16.729
  319   2HZ   LYS  38          3HZ       LYS  38  -8.760  16.135  16.135
  320   3HZ   LYS  38          2HZ       LYS  38  -8.464  17.796  17.796
  321    HA   PRO  39           HA       PRO  39  -5.158  10.681  10.681
  322   1HB   PRO  39          2HB       PRO  39  -4.143   8.151   8.151
  323   2HB   PRO  39          1HB       PRO  39  -5.857   8.512   8.512
  324   1HG   PRO  39          2HG       PRO  39  -4.398   7.829   7.829
  325   2HG   PRO  39          1HG       PRO  39  -6.097   7.555   7.555
  326   1HD   PRO  39          2HD       PRO  39  -5.159   9.602   9.602
  327   2HD   PRO  39          1HD       PRO  39  -6.754   9.559   9.559
  328    H    ALA  40           H        ALA  40  -3.086  10.253  10.253
  329    HA   ALA  40           HA       ALA  40  -0.743  11.058  11.058
  330   1HB   ALA  40          1HB       ALA  40  -1.577  11.653  11.653
  331   2HB   ALA  40          3HB       ALA  40   0.145  11.609  11.609
  332   3HB   ALA  40          2HB       ALA  40  -0.915  12.738  12.738
  333    H    VAL  41           H        VAL  41   1.389  10.248  10.248
  334    HA   VAL  41           HA       VAL  41   1.188   7.640   7.640
  335    HB   VAL  41           HB       VAL  41   2.183   8.014   8.014
  336   1HG1  VAL  41          1HG1      VAL  41   2.599   5.690   5.690
  337   2HG1  VAL  41          3HG1      VAL  41   2.821   5.578   5.578
  338   3HG1  VAL  41          2HG1      VAL  41   3.847   6.651   6.651
  339   1HG2  VAL  41          3HG2      VAL  41   0.075   6.296   6.296
  340   2HG2  VAL  41          2HG2      VAL  41  -0.170   7.563   7.563
  341   3HG2  VAL  41          1HG2      VAL  41   0.619   6.054   6.054
  342    H    GLU  42           H        GLU  42   3.449   6.844   6.844
  343    HA   GLU  42           HA       GLU  42   5.600   8.856   8.856
  344   1HB   GLU  42          2HB       GLU  42   4.404   9.498   9.498
  345   2HB   GLU  42          1HB       GLU  42   4.581   7.859   7.859
  346   1HG   GLU  42          2HG       GLU  42   7.060   8.126   8.126
  347   2HG   GLU  42          1HG       GLU  42   6.827   9.795   9.795
  348    H    ILE  43           H        ILE  43   7.142   7.568   7.568
  349    HA   ILE  43           HA       ILE  43   7.299   4.740   4.740
  350    HB   ILE  43           HB       ILE  43   8.498   6.242   6.242
  351   1HG1  ILE  43          2HG1      ILE  43   6.914   3.854   3.854
  352   2HG1  ILE  43          1HG1      ILE  43   5.999   5.001   5.001
  353   1HG2  ILE  43          3HG2      ILE  43   9.113   3.524   3.524
  354   2HG2  ILE  43          2HG2      ILE  43   9.040   3.724   3.724
  355   3HG2  ILE  43          1HG2      ILE  43  10.178   4.679   4.679
  356   1HD1  ILE  43          3HD1      ILE  43   7.469   6.339   6.339
  357   2HD1  ILE  43          2HD1      ILE  43   6.367   5.115   5.115
  358   3HD1  ILE  43          1HD1      ILE  43   5.752   6.411   6.411
  359    H    LYS  44           H        LYS  44   9.002   3.944   3.944
  360    HA   LYS  44           HA       LYS  44  11.229   5.824   5.824
  361   1HB   LYS  44          2HB       LYS  44  10.918   3.544   3.544
  362   2HB   LYS  44          1HB       LYS  44  11.082   5.254   5.254
  363   1HG   LYS  44          2HG       LYS  44   8.699   5.615   5.615
  364   2HG   LYS  44          1HG       LYS  44   8.484   4.000   4.000
  365   1HD   LYS  44          2HD       LYS  44   8.858   2.968   2.968
  366   2HD   LYS  44          1HD       LYS  44   9.636   4.403   4.403
  367   1HE   LYS  44          2HE       LYS  44   6.742   4.428   4.428
  368   2HE   LYS  44          1HE       LYS  44   7.222   3.934   3.934
  369   1HZ   LYS  44          1HZ       LYS  44   8.509   6.114   6.114
  370   2HZ   LYS  44          3HZ       LYS  44   7.572   6.562   6.562
  371   3HZ   LYS  44          2HZ       LYS  44   6.818   6.204   6.204
  372    H    GLN  45           H        GLN  45  13.008   5.172   5.172
  373    HA   GLN  45           HA       GLN  45  13.222   2.293   2.293
  374   1HB   GLN  45          2HB       GLN  45  13.438   3.933   3.933
  375   2HB   GLN  45          1HB       GLN  45  14.821   4.665   4.665
  376   1HG   GLN  45          2HG       GLN  45  16.091   2.598   2.598
  377   2HG   GLN  45          1HG       GLN  45  14.696   1.760   1.760
  378   1HE2  GLN  45          2HE2      GLN  45  16.237   2.562   2.562
  379   2HE2  GLN  45          1HE2      GLN  45  15.994   1.329   1.329
  380    H    GLU  46           H        GLU  46  14.500   0.993   0.993
  381    HA   GLU  46           HA       GLU  46  16.895   2.175   2.175
  382   1HB   GLU  46          2HB       GLU  46  14.854   0.189   0.189
  383   2HB   GLU  46          1HB       GLU  46  16.514   0.051   0.051
  384   1HG   GLU  46          2HG       GLU  46  16.455   2.125   2.125
  385   2HG   GLU  46          1HG       GLU  46  15.142   2.724   2.724
  386    H    GLY  47           H        GLY  47  17.216   1.396   1.396
  387   1HA   GLY  47          2HA       GLY  47  18.902   0.096   0.096
  388   2HA   GLY  47          1HA       GLY  47  18.882  -1.041  -1.041
  389    H    ASP  48           H        ASP  48  18.122  -2.994  -2.994
  390    HA   ASP  48           HA       ASP  48  16.340  -3.235  -3.235
  391   1HB   ASP  48          2HB       ASP  48  16.234  -5.677  -5.677
  392   2HB   ASP  48          1HB       ASP  48  17.803  -5.088  -5.088
  393    H    THR  49           H        THR  49  15.713  -2.299  -2.299
  394    HA   THR  49           HA       THR  49  13.165  -3.776  -3.776
  395    HB   THR  49           HB       THR  49  14.749  -2.020  -2.020
  396    HG1  THR  49           HG1      THR  49  15.424  -3.993  -3.993
  397   1HG2  THR  49          2HG2      THR  49  11.869  -2.847  -2.847
  398   2HG2  THR  49          1HG2      THR  49  12.830  -2.736  -2.736
  399   3HG2  THR  49          3HG2      THR  49  12.617  -1.315  -1.315
  400    H    PHE  50           H        PHE  50  11.191  -2.717  -2.717
  401    HA   PHE  50           HA       PHE  50  11.259   0.206   0.206
  402   1HB   PHE  50          2HB       PHE  50   9.954  -1.887  -1.887
  403   2HB   PHE  50          1HB       PHE  50   9.683  -0.147  -0.147
  404    HD1  PHE  50           HD2      PHE  50  11.636   1.371   1.371
  405    HD2  PHE  50           HD1      PHE  50  11.958  -2.903  -2.903
  406    HE1  PHE  50           HE2      PHE  50  13.767   1.572   1.572
  407    HE2  PHE  50           HE1      PHE  50  14.085  -2.705  -2.705
  408    HZ   PHE  50           HZ       PHE  50  15.000  -0.473  -0.473
  409    H    TYR  51           H        TYR  51   9.959   1.063   1.063
  410    HA   TYR  51           HA       TYR  51   7.580  -0.421  -0.421
  411   1HB   TYR  51          2HB       TYR  51   9.260   0.491   0.491
  412   2HB   TYR  51          1HB       TYR  51   8.910   2.106   2.106
  413    HD1  TYR  51           HD1      TYR  51   6.319   2.750   2.750
  414    HD2  TYR  51           HD2      TYR  51   8.089  -0.308  -0.308
  415    HE1  TYR  51           HE1      TYR  51   4.427   2.914   2.914
  416    HE2  TYR  51           HE2      TYR  51   6.211  -0.125  -0.125
  417    HH   TYR  51           HH       TYR  51   3.968   2.449   2.449
  418    H    ILE  52           H        ILE  52   5.497   0.622   0.622
  419    HA   ILE  52           HA       ILE  52   5.473   3.162   3.162
  420    HB   ILE  52           HB       ILE  52   3.650   0.932   0.932
  421   1HG1  ILE  52          2HG1      ILE  52   6.522   1.336   1.336
  422   2HG1  ILE  52          1HG1      ILE  52   5.917  -0.052  -0.052
  423   1HG2  ILE  52          3HG2      ILE  52   3.509   3.384   3.384
  424   2HG2  ILE  52          2HG2      ILE  52   5.015   3.091   3.091
  425   3HG2  ILE  52          1HG2      ILE  52   3.567   2.173   2.173
  426   1HD1  ILE  52          2HD1      ILE  52   4.220   0.185   0.185
  427   2HD1  ILE  52          1HD1      ILE  52   5.852   0.440   0.440
  428   3HD1  ILE  52          3HD1      ILE  52   5.464  -1.037  -1.037
  429    H    LYS  53           H        LYS  53   4.441   4.385   4.385
  430    HA   LYS  53           HA       LYS  53   1.992   3.297   3.297
  431   1HB   LYS  53          2HB       LYS  53   4.083   4.754   4.754
  432   2HB   LYS  53          1HB       LYS  53   2.881   6.008   6.008
  433   1HG   LYS  53          2HG       LYS  53   1.268   4.209   4.209
  434   2HG   LYS  53          1HG       LYS  53   2.780   3.667   3.667
  435   1HD   LYS  53          2HD       LYS  53   3.046   6.321   6.321
  436   2HD   LYS  53          1HD       LYS  53   1.286   6.207   6.207
  437   1HE   LYS  53          2HE       LYS  53   1.787   4.134   4.134
  438   2HE   LYS  53          1HE       LYS  53   3.283   5.020   5.020
  439   1HZ   LYS  53          1HZ       LYS  53   0.624   6.308   6.308
  440   2HZ   LYS  53          3HZ       LYS  53   1.344   5.548   5.548
  441   3HZ   LYS  53          2HZ       LYS  53   2.108   6.877   6.877
  442    H    THR  54           H        THR  54   0.126   3.735   3.735
  443    HA   THR  54           HA       THR  54  -0.052   6.222   6.222
  444    HB   THR  54           HB       THR  54  -2.095   3.989   3.989
  445    HG1  THR  54           HG1      THR  54   0.117   4.203   4.203
  446   1HG2  THR  54          1HG2      THR  54  -2.096   6.455   6.455
  447   2HG2  THR  54          3HG2      THR  54  -1.613   5.329   5.329
  448   3HG2  THR  54          2HG2      THR  54  -3.125   5.081   5.081
  449    H    SER  55           H        SER  55  -1.600   7.808   7.808
  450    HA   SER  55           HA       SER  55  -3.299   7.267   7.267
  451   1HB   SER  55          2HB       SER  55  -2.682   9.794   9.794
  452   2HB   SER  55          1HB       SER  55  -1.656   8.470   8.470
  453    HG   SER  55           HG       SER  55  -1.211  10.410  10.410
  454    H    THR  56           H        THR  56  -5.347   7.647   7.647
  455    HA   THR  56           HA       THR  56  -5.947   9.583   9.583
  456    HB   THR  56           HB       THR  56  -8.340   8.462   8.462
  457    HG1  THR  56           HG1      THR  56  -8.178   6.619   6.619
  458   1HG2  THR  56          2HG2      THR  56  -7.107   8.450   8.450
  459   2HG2  THR  56          1HG2      THR  56  -6.136   7.099   7.099
  460   3HG2  THR  56          3HG2      THR  56  -7.871   6.898   6.898
  461    H    THR  57           H        THR  57  -8.480  10.372  10.372
  462    HA   THR  57           HA       THR  57  -8.173  12.525  12.525
  463    HB   THR  57           HB       THR  57 -10.033  12.351  12.351
  464    HG1  THR  57           HG1      THR  57 -11.648  13.054  13.054
  465   1HG2  THR  57          2HG2      THR  57 -10.350   9.876   9.876
  466   2HG2  THR  57          1HG2      THR  57 -11.170  10.232  10.232
  467   3HG2  THR  57          3HG2      THR  57 -11.852  10.800  10.800
  468    H    VAL  58           H        VAL  58  -9.440   9.274   9.274
  469    HA   VAL  58           HA       VAL  58  -9.059   9.975   9.975
  470    HB   VAL  58           HB       VAL  58 -11.325   8.325   8.325
  471   1HG1  VAL  58          2HG1      VAL  58 -10.561   9.338   9.338
  472   2HG1  VAL  58          1HG1      VAL  58 -12.216   8.863   8.863
  473   3HG1  VAL  58          3HG1      VAL  58 -10.912   7.681   7.681
  474   1HG2  VAL  58          3HG2      VAL  58 -10.987  11.234  11.234
  475   2HG2  VAL  58          2HG2      VAL  58 -12.197  10.334  10.334
  476   3HG2  VAL  58          1HG2      VAL  58 -12.422  10.609  10.609
  477    H    ARG  59           H        ARG  59  -8.272   7.754   7.754
  478    HA   ARG  59           HA       ARG  59  -7.830   5.602   5.602
  479   1HB   ARG  59          2HB       ARG  59  -9.068   5.230   5.230
  480   2HB   ARG  59          1HB       ARG  59  -7.428   5.169   5.169
  481   1HG   ARG  59          2HG       ARG  59  -6.895   3.236   3.236
  482   2HG   ARG  59          1HG       ARG  59  -7.975   3.594   3.594
  483   1HD   ARG  59          2HD       ARG  59  -9.895   2.888   2.888
  484   2HD   ARG  59          1HD       ARG  59  -9.054   2.955   2.955
  485    HE   ARG  59           HE       ARG  59  -7.763   0.947   0.947
  486   1HH1  ARG  59          1HH2      ARG  59  -8.700   1.285   1.285
  487   2HH1  ARG  59          2HH2      ARG  59  -9.826  -0.025  -0.025
  488   1HH2  ARG  59          2HH1      ARG  59 -10.048  -0.506  -0.506
  489   2HH2  ARG  59          1HH1      ARG  59 -10.591  -1.038  -1.038
  490    H    THR  60           H        THR  60  -5.763   4.260   4.260
  491    HA   THR  60           HA       THR  60  -3.516   5.708   5.708
  492    HB   THR  60           HB       THR  60  -3.492   5.205   5.205
  493    HG1  THR  60           HG1      THR  60  -4.146   7.210   7.210
  494   1HG2  THR  60          3HG2      THR  60  -1.393   5.431   5.431
  495   2HG2  THR  60          2HG2      THR  60  -1.736   7.150   7.150
  496   3HG2  THR  60          1HG2      THR  60  -1.383   6.156   6.156
  497    H    THR  61           H        THR  61  -3.167   3.738   3.738
  498    HA   THR  61           HA       THR  61  -2.767   1.250   1.250
  499    HB   THR  61           HB       THR  61  -2.318   0.332   0.332
  500    HG1  THR  61           HG1      THR  61  -2.008   2.120   2.120
  501   1HG2  THR  61          2HG2      THR  61  -4.947   1.440   1.440
  502   2HG2  THR  61          1HG2      THR  61  -4.842   0.529   0.529
  503   3HG2  THR  61          3HG2      THR  61  -4.384  -0.232  -0.232
  504    H    GLU  62           H        GLU  62  -0.754  -0.071  -0.071
  505    HA   GLU  62           HA       GLU  62   1.551   1.387   1.387
  506   1HB   GLU  62          2HB       GLU  62   2.788   1.714   1.714
  507   2HB   GLU  62          1HB       GLU  62   1.171   2.292   2.292
  508   1HG   GLU  62          2HG       GLU  62   0.920  -0.304  -0.304
  509   2HG   GLU  62          1HG       GLU  62   2.641  -0.055  -0.055
  510    H    ILE  63           H        ILE  63   3.182  -0.019  -0.019
  511    HA   ILE  63           HA       ILE  63   2.913  -2.871  -2.871
  512    HB   ILE  63           HB       ILE  63   3.592  -3.511  -3.511
  513   1HG1  ILE  63          2HG1      ILE  63   3.047  -0.587  -0.587
  514   2HG1  ILE  63          1HG1      ILE  63   4.657  -1.304  -1.304
  515   1HG2  ILE  63          1HG2      ILE  63   1.140  -3.123  -3.123
  516   2HG2  ILE  63          3HG2      ILE  63   1.145  -1.789  -1.789
  517   3HG2  ILE  63          2HG2      ILE  63   1.407  -3.441  -3.441
  518   1HD1  ILE  63          3HD1      ILE  63   2.663  -2.692  -2.692
  519   2HD1  ILE  63          2HD1      ILE  63   3.238  -1.126  -1.126
  520   3HD1  ILE  63          1HD1      ILE  63   4.387  -2.427  -2.427
  521    H    ASN  64           H        ASN  64   5.084  -4.061  -4.061
  522    HA   ASN  64           HA       ASN  64   7.463  -2.385  -2.385
  523   1HB   ASN  64          2HB       ASN  64   8.396  -3.046  -3.046
  524   2HB   ASN  64          1HB       ASN  64   7.011  -1.968  -1.968
  525   1HD2  ASN  64          2HD2      ASN  64   4.802  -4.527  -4.527
  526   2HD2  ASN  64          1HD2      ASN  64   4.822  -3.167  -3.167
  527    H    PHE  65           H        PHE  65   9.058  -3.677  -3.677
  528    HA   PHE  65           HA       PHE  65   9.258  -6.524  -6.524
  529   1HB   PHE  65          2HB       PHE  65   8.744  -7.385  -7.385
  530   2HB   PHE  65          1HB       PHE  65   7.359  -6.510  -6.510
  531    HD1  PHE  65           HD2      PHE  65   6.813  -4.218  -4.218
  532    HD2  PHE  65           HD1      PHE  65   9.984  -6.572  -6.572
  533    HE1  PHE  65           HE2      PHE  65   6.898  -2.702  -2.702
  534    HE2  PHE  65           HE1      PHE  65  10.078  -5.061  -5.061
  535    HZ   PHE  65           HZ       PHE  65   8.536  -3.124  -3.124
  536    H    LYS  66           H        LYS  66  10.675  -7.577  -7.577
  537    HA   LYS  66           HA       LYS  66  12.948  -5.736  -5.736
  538   1HB   LYS  66          2HB       LYS  66  14.438  -7.792  -7.792
  539   2HB   LYS  66          1HB       LYS  66  13.785  -7.075  -7.075
  540   1HG   LYS  66          2HG       LYS  66  11.893  -8.753  -8.753
  541   2HG   LYS  66          1HG       LYS  66  12.780  -9.542  -9.542
  542   1HD   LYS  66          2HD       LYS  66  13.333 -10.666 -10.666
  543   2HD   LYS  66          1HD       LYS  66  14.747  -9.754  -9.754
  544   1HE   LYS  66          2HE       LYS  66  14.529  -8.174  -8.174
  545   2HE   LYS  66          1HE       LYS  66  12.785  -8.396  -8.396
  546   1HZ   LYS  66          3HZ       LYS  66  13.455 -10.747 -10.747
  547   2HZ   LYS  66          2HZ       LYS  66  14.953 -10.021 -10.021
  548   3HZ   LYS  66          1HZ       LYS  66  13.537  -9.440  -9.440
  549    H    VAL  67           H        VAL  67  14.079  -6.353  -6.353
  550    HA   VAL  67           HA       VAL  67  12.209  -7.620  -7.620
  551    HB   VAL  67           HB       VAL  67  14.915  -7.016  -7.016
  552   1HG1  VAL  67          3HG1      VAL  67  12.090  -6.219  -6.219
  553   2HG1  VAL  67          2HG1      VAL  67  13.523  -5.867  -5.867
  554   3HG1  VAL  67          1HG1      VAL  67  13.028  -7.538  -7.538
  555   1HG2  VAL  67          3HG2      VAL  67  13.278  -4.935  -4.935
  556   2HG2  VAL  67          2HG2      VAL  67  15.031  -5.104  -5.104
  557   3HG2  VAL  67          1HG2      VAL  67  14.134  -4.497  -4.497
  558    H    GLY  68           H        GLY  68  12.148  -9.832  -9.832
  559   1HA   GLY  68          2HA       GLY  68  13.626 -11.707 -11.707
  560   2HA   GLY  68          1HA       GLY  68  14.724 -11.303 -11.303
  561    H    GLU  69           H        GLU  69  12.535 -10.818 -10.818
  562    HA   GLU  69           HA       GLU  69  11.742 -13.675 -13.675
  563   1HB   GLU  69          2HB       GLU  69  12.114 -11.499 -11.499
  564   2HB   GLU  69          1HB       GLU  69  11.784 -13.203 -13.203
  565   1HG   GLU  69          2HG       GLU  69  13.958 -13.539 -13.539
  566   2HG   GLU  69          1HG       GLU  69  14.309 -11.903 -11.903
  567    H    GLU  70           H        GLU  70   9.630 -14.044 -14.044
  568    HA   GLU  70           HA       GLU  70   7.619 -12.115 -12.115
  569   1HB   GLU  70          2HB       GLU  70   7.256 -14.781 -14.781
  570   2HB   GLU  70          1HB       GLU  70   5.997 -13.857 -13.857
  571   1HG   GLU  70          2HG       GLU  70   6.737 -14.443 -14.443
  572   2HG   GLU  70          1HG       GLU  70   8.430 -14.472 -14.472
  573    H    PHE  71           H        PHE  71   5.740 -11.620 -11.620
  574    HA   PHE  71           HA       PHE  71   6.349 -11.619 -11.619
  575   1HB   PHE  71          2HB       PHE  71   6.327  -9.120  -9.120
  576   2HB   PHE  71          1HB       PHE  71   7.740  -9.742  -9.742
  577    HD1  PHE  71           HD2      PHE  71   7.677  -9.827  -9.827
  578    HD2  PHE  71           HD1      PHE  71   4.845  -7.621  -7.621
  579    HE1  PHE  71           HE2      PHE  71   7.055  -8.490  -8.490
  580    HE2  PHE  71           HE1      PHE  71   4.223  -6.285  -6.285
  581    HZ   PHE  71           HZ       PHE  71   5.325  -6.715  -6.715
  582    H    GLU  72           H        GLU  72   4.633 -10.215 -10.215
  583    HA   GLU  72           HA       GLU  72   2.054 -10.594 -10.594
  584   1HB   GLU  72          2HB       GLU  72   2.187  -9.993  -9.993
  585   2HB   GLU  72          1HB       GLU  72   0.957 -10.863 -10.863
  586   1HG   GLU  72          2HG       GLU  72   2.638 -12.695 -12.695
  587   2HG   GLU  72          1HG       GLU  72   3.728 -11.862 -11.862
  588    H    GLU  73           H        GLU  73   0.652  -8.836  -8.836
  589    HA   GLU  73           HA       GLU  73   1.232  -6.258  -6.258
  590   1HB   GLU  73          2HB       GLU  73   1.551  -5.082  -5.082
  591   2HB   GLU  73          1HB       GLU  73   2.883  -6.165  -6.165
  592   1HG   GLU  73          2HG       GLU  73   2.411  -7.600  -7.600
  593   2HG   GLU  73          1HG       GLU  73   0.668  -7.406  -7.406
  594    H    GLN  74           H        GLN  74  -0.230  -4.566  -4.566
  595    HA   GLN  74           HA       GLN  74  -2.921  -5.875  -5.875
  596   1HB   GLN  74          2HB       GLN  74  -1.996  -3.017  -3.017
  597   2HB   GLN  74          1HB       GLN  74  -3.671  -3.389  -3.389
  598   1HG   GLN  74          2HG       GLN  74  -3.384  -5.130  -5.130
  599   2HG   GLN  74          1HG       GLN  74  -2.159  -3.967  -3.967
  600   1HE2  GLN  74          2HE2      GLN  74  -6.102  -3.002  -3.002
  601   2HE2  GLN  74          1HE2      GLN  74  -5.614  -4.479  -4.479
  602    H    THR  75           H        THR  75  -4.378  -5.300  -5.300
  603    HA   THR  75           HA       THR  75  -2.869  -4.974  -4.974
  604    HB   THR  75           HB       THR  75  -4.476  -6.896  -6.896
  605    HG1  THR  75           HG1      THR  75  -4.651  -6.906  -6.906
  606   1HG2  THR  75          1HG2      THR  75  -6.238  -4.776  -4.776
  607   2HG2  THR  75          3HG2      THR  75  -6.867  -5.525  -5.525
  608   3HG2  THR  75          2HG2      THR  75  -6.576  -6.504  -6.504
  609    H    VAL  76           H        VAL  76  -5.577  -3.981  -3.981
  610    HA   VAL  76           HA       VAL  76  -5.123  -1.140  -1.140
  611    HB   VAL  76           HB       VAL  76  -6.361  -2.236  -2.236
  612   1HG1  VAL  76          2HG1      VAL  76  -6.955   0.105   0.105
  613   2HG1  VAL  76          1HG1      VAL  76  -5.236   0.502   0.502
  614   3HG1  VAL  76          3HG1      VAL  76  -6.021   0.021   0.021
  615   1HG2  VAL  76          1HG2      VAL  76  -3.520  -1.449  -1.449
  616   2HG2  VAL  76          3HG2      VAL  76  -4.087  -2.971  -2.971
  617   3HG2  VAL  76          2HG2      VAL  76  -4.114  -1.502  -1.502
  618    H    ASP  77           H        ASP  77  -7.527  -3.652  -3.652
  619    HA   ASP  77           HA       ASP  77  -9.753  -1.738  -1.738
  620   1HB   ASP  77          2HB       ASP  77  -9.647  -4.220  -4.220
  621   2HB   ASP  77          1HB       ASP  77 -10.193  -4.614  -4.614
  622    H    GLY  78           H        GLY  78  -7.952  -4.019  -4.019
  623   1HA   GLY  78          2HA       GLY  78  -7.668  -3.068  -3.068
  624   2HA   GLY  78          1HA       GLY  78  -9.431  -3.069  -3.069
  625    H    ARG  79           H        ARG  79  -7.192  -5.484  -5.484
  626    HA   ARG  79           HA       ARG  79  -8.262  -7.463  -7.463
  627   1HB   ARG  79          2HB       ARG  79  -8.141  -7.530  -7.530
  628   2HB   ARG  79          1HB       ARG  79  -7.855  -9.032  -9.032
  629   1HG   ARG  79          2HG       ARG  79 -10.096  -7.873  -7.873
  630   2HG   ARG  79          1HG       ARG  79 -10.356  -7.630  -7.630
  631   1HD   ARG  79          2HD       ARG  79  -9.514 -10.311 -10.311
  632   2HD   ARG  79          1HD       ARG  79 -11.211  -9.841  -9.841
  633    HE   ARG  79           HE       ARG  79  -9.408 -10.131 -10.131
  634   1HH1  ARG  79          1HH2      ARG  79 -11.317  -8.565  -8.565
  635   2HH1  ARG  79          2HH2      ARG  79 -12.711  -9.558  -9.558
  636   1HH2  ARG  79          2HH1      ARG  79 -11.724 -12.011 -12.011
  637   2HH2  ARG  79          1HH1      ARG  79 -12.941 -11.508 -11.508
  638    HA   PRO  80           HA       PRO  80  -3.952  -8.370  -8.370
  639   1HB   PRO  80          2HB       PRO  80  -4.136 -10.909 -10.909
  640   2HB   PRO  80          1HB       PRO  80  -4.496  -9.439  -9.439
  641   1HG   PRO  80          2HG       PRO  80  -6.378 -11.457 -11.457
  642   2HG   PRO  80          1HG       PRO  80  -6.592 -10.370 -10.370
  643   1HD   PRO  80          2HD       PRO  80  -7.682 -10.006 -10.006
  644   2HD   PRO  80          1HD       PRO  80  -7.625  -8.790  -8.790
  645    H    CYS  81           H        CYS  81  -2.327  -9.318  -9.318
  646    HA   CYS  81           HA       CYS  81  -2.753 -11.767 -11.767
  647   1HB   CYS  81          2HB       CYS  81  -2.250 -10.653 -10.653
  648   2HB   CYS  81          1HB       CYS  81  -3.839 -10.262 -10.262
  649    HG   CYS  81           HG       CYS  81  -2.787  -7.982  -7.982
  650    H    LYS  82           H        LYS  82  -0.787 -12.697 -12.697
  651    HA   LYS  82           HA       LYS  82   1.633 -11.320 -11.320
  652   1HB   LYS  82          2HB       LYS  82   1.209 -13.686 -13.686
  653   2HB   LYS  82          1HB       LYS  82   1.284 -14.142 -14.142
  654   1HG   LYS  82          2HG       LYS  82   3.600 -12.940 -12.940
  655   2HG   LYS  82          1HG       LYS  82   3.481 -13.188 -13.188
  656   1HD   LYS  82          2HD       LYS  82   4.610 -15.118 -15.118
  657   2HD   LYS  82          1HD       LYS  82   2.942 -15.643 -15.643
  658   1HE   LYS  82          2HE       LYS  82   2.486 -15.292 -15.292
  659   2HE   LYS  82          1HE       LYS  82   4.140 -14.729 -14.729
  660   1HZ   LYS  82          1HZ       LYS  82   3.492 -17.400 -17.400
  661   2HZ   LYS  82          3HZ       LYS  82   3.715 -17.122 -17.122
  662   3HZ   LYS  82          2HZ       LYS  82   4.992 -16.845 -16.845
  663    H    SER  83           H        SER  83   2.638 -10.049 -10.049
  664    HA   SER  83           HA       SER  83   2.403 -10.719 -10.719
  665   1HB   SER  83          2HB       SER  83   1.891  -8.401  -8.401
  666   2HB   SER  83          1HB       SER  83   3.627  -8.193  -8.193
  667    HG   SER  83           HG       SER  83   2.021  -7.595  -7.595
  668    H    LEU  84           H        LEU  84   4.486  -9.883  -9.883
  669    HA   LEU  84           HA       LEU  84   6.993 -10.395 -10.395
  670   1HB   LEU  84          2HB       LEU  84   6.378 -12.689 -12.689
  671   2HB   LEU  84          1HB       LEU  84   6.027 -12.207 -12.207
  672    HG   LEU  84           HG       LEU  84   8.395 -11.636 -11.636
  673   1HD1  LEU  84          1HD1      LEU  84   8.520 -11.495 -11.495
  674   2HD1  LEU  84          3HD1      LEU  84   9.404 -12.971 -12.971
  675   3HD1  LEU  84          2HD1      LEU  84   9.897 -11.443 -11.443
  676   1HD2  LEU  84          3HD2      LEU  84   7.595 -13.931 -13.931
  677   2HD2  LEU  84          2HD2      LEU  84   9.280 -13.927 -13.927
  678   3HD2  LEU  84          1HD2      LEU  84   8.009 -14.394 -14.394
  679    H    VAL  85           H        VAL  85   8.824  -9.653  -9.653
  680    HA   VAL  85           HA       VAL  85   8.045  -8.256  -8.256
  681    HB   VAL  85           HB       VAL  85   9.664  -6.887  -6.887
  682   1HG1  VAL  85          3HG1      VAL  85   9.799  -6.213  -6.213
  683   2HG1  VAL  85          2HG1      VAL  85   8.113  -5.716  -5.716
  684   3HG1  VAL  85          1HG1      VAL  85   9.351  -4.932  -4.932
  685   1HG2  VAL  85          3HG2      VAL  85   6.724  -7.129  -7.129
  686   2HG2  VAL  85          2HG2      VAL  85   7.659  -6.857  -6.857
  687   3HG2  VAL  85          1HG2      VAL  85   7.340  -5.521  -5.521
  688    H    LYS  86           H        LYS  86   9.496  -8.551  -8.551
  689    HA   LYS  86           HA       LYS  86  12.329  -9.123  -9.123
  690   1HB   LYS  86          2HB       LYS  86  12.240 -10.201 -10.201
  691   2HB   LYS  86          1HB       LYS  86  11.853 -11.145 -11.145
  692   1HG   LYS  86          2HG       LYS  86   9.437 -10.603 -10.603
  693   2HG   LYS  86          1HG       LYS  86   9.880  -9.774  -9.774
  694   1HD   LYS  86          2HD       LYS  86  10.850 -12.576 -12.576
  695   2HD   LYS  86          1HD       LYS  86   9.146 -12.339 -12.339
  696   1HE   LYS  86          2HE       LYS  86   9.593 -11.594 -11.594
  697   2HE   LYS  86          1HE       LYS  86  11.063 -10.756 -10.756
  698   1HZ   LYS  86          1HZ       LYS  86  12.078 -13.014 -13.014
  699   2HZ   LYS  86          3HZ       LYS  86  10.712 -13.655 -13.655
  700   3HZ   LYS  86          2HZ       LYS  86  11.725 -12.569 -12.569
  701    H    TRP  87           H        TRP  87  13.868  -8.199  -8.199
  702    HA   TRP  87           HA       TRP  87  12.933  -5.596  -5.596
  703   1HB   TRP  87          2HB       TRP  87  15.590  -7.046  -7.046
  704   2HB   TRP  87          1HB       TRP  87  15.356  -5.520  -5.520
  705    HD1  TRP  87           HD1      TRP  87  16.146  -6.967  -6.967
  706    HE1  TRP  87           HE1      TRP  87  16.224  -5.140  -5.140
  707    HE3  TRP  87           HE3      TRP  87  14.029  -3.118  -3.118
  708    HZ2  TRP  87           HZ2      TRP  87  15.482  -2.396  -2.396
  709    HZ3  TRP  87           HZ3      TRP  87  13.707  -0.905  -0.905
  710    HH2  TRP  87           HH2      TRP  87  14.428  -0.548  -0.548
  711    H    GLU  88           H        GLU  88  13.675  -4.950  -4.950
  712    HA   GLU  88           HA       GLU  88  13.252  -7.132  -7.132
  713   1HB   GLU  88          2HB       GLU  88  11.188  -5.608  -5.608
  714   2HB   GLU  88          1HB       GLU  88  12.097  -4.377  -4.377
  715   1HG   GLU  88          2HG       GLU  88  10.850  -5.373  -5.373
  716   2HG   GLU  88          1HG       GLU  88  12.400  -6.207  -6.207
  717    H    SER  89           H        SER  89  14.151  -3.775  -3.775
  718    HA   SER  89           HA       SER  89  16.456  -4.077  -4.077
  719   1HB   SER  89          2HB       SER  89  16.037  -1.941  -1.941
  720   2HB   SER  89          1HB       SER  89  14.466  -2.739  -2.739
  721    HG   SER  89           HG       SER  89  14.127  -1.650  -1.650
  722    H    GLU  90           H        GLU  90  17.223  -1.267  -1.267
  723    HA   GLU  90           HA       GLU  90  18.521  -1.855  -1.855
  724   1HB   GLU  90          2HB       GLU  90  19.545   0.398   0.398
  725   2HB   GLU  90          1HB       GLU  90  19.743  -0.616  -0.616
  726   1HG   GLU  90          2HG       GLU  90  17.989   0.525   0.525
  727   2HG   GLU  90          1HG       GLU  90  17.464   1.351   1.351
  728    H    ASN  91           H        ASN  91  15.699  -0.015  -0.015
  729    HA   ASN  91           HA       ASN  91  15.225   0.577   0.577
  730   1HB   ASN  91          2HB       ASN  91  14.813   2.596   2.596
  731   2HB   ASN  91          1HB       ASN  91  14.546   2.850   2.850
  732   1HD2  ASN  91          2HD2      ASN  91  18.074   3.843   3.843
  733   2HD2  ASN  91          1HD2      ASN  91  16.592   3.951   3.951
  734    H    LYS  92           H        LYS  92  13.989  -1.329  -1.329
  735    HA   LYS  92           HA       LYS  92  11.193  -0.418  -0.418
  736   1HB   LYS  92          2HB       LYS  92  11.696   0.022   0.022
  737   2HB   LYS  92          1HB       LYS  92  12.207  -1.649  -1.649
  738   1HG   LYS  92          2HG       LYS  92   9.880  -2.331  -2.331
  739   2HG   LYS  92          1HG       LYS  92   9.429  -0.638  -0.638
  740   1HD   LYS  92          2HD       LYS  92  10.085  -0.691  -0.691
  741   2HD   LYS  92          1HD       LYS  92  10.567  -2.379  -2.379
  742   1HE   LYS  92          2HE       LYS  92   8.325  -2.274  -2.274
  743   2HE   LYS  92          1HE       LYS  92   8.232  -2.943  -2.943
  744   1HZ   LYS  92          2HZ       LYS  92   7.787  -0.085  -0.085
  745   2HZ   LYS  92          1HZ       LYS  92   6.545  -1.224  -1.224
  746   3HZ   LYS  92          3HZ       LYS  92   7.562  -0.823  -0.823
  747    H    MET  93           H        MET  93  10.442  -1.895  -1.895
  748    HA   MET  93           HA       MET  93  11.194  -4.759  -4.759
  749   1HB   MET  93          2HB       MET  93  10.845  -5.133  -5.133
  750   2HB   MET  93          1HB       MET  93  12.098  -3.939  -3.939
  751   1HG   MET  93          2HG       MET  93   9.777  -2.423  -2.423
  752   2HG   MET  93          1HG       MET  93   9.522  -3.653  -3.653
  753   1HE   MET  93          1HE       MET  93  11.241  -4.498  -4.498
  754   2HE   MET  93          3HE       MET  93  12.919  -3.985  -3.985
  755   3HE   MET  93          2HE       MET  93  12.006  -3.441  -3.441
  756    H    VAL  94           H        VAL  94   9.566  -6.327  -6.327
  757    HA   VAL  94           HA       VAL  94   6.804  -5.296  -5.296
  758    HB   VAL  94           HB       VAL  94   7.620  -8.167  -8.167
  759   1HG1  VAL  94          3HG1      VAL  94   5.430  -6.354  -6.354
  760   2HG1  VAL  94          2HG1      VAL  94   5.908  -7.598  -7.598
  761   3HG1  VAL  94          1HG1      VAL  94   5.367  -8.050  -8.050
  762   1HG2  VAL  94          2HG2      VAL  94   8.358  -5.841  -5.841
  763   2HG2  VAL  94          1HG2      VAL  94   9.248  -7.332  -7.332
  764   3HG2  VAL  94          3HG2      VAL  94   7.863  -7.339  -7.339
  765    H    CYS  95           H        CYS  95   5.083  -6.905  -6.905
  766    HA   CYS  95           HA       CYS  95   6.029  -8.078  -8.078
  767   1HB   CYS  95          2HB       CYS  95   5.507  -5.685  -5.685
  768   2HB   CYS  95          1HB       CYS  95   3.867  -5.953  -5.953
  769    HG   CYS  95           HG       CYS  95   3.321  -6.802  -6.802
  770    H    GLU  96           H        GLU  96   4.926  -9.908  -9.908
  771    HA   GLU  96           HA       GLU  96   2.368 -10.416 -10.416
  772   1HB   GLU  96          2HB       GLU  96   2.773 -12.820 -12.820
  773   2HB   GLU  96          1HB       GLU  96   3.971 -12.182 -12.182
  774   1HG   GLU  96          2HG       GLU  96   5.560 -11.823 -11.823
  775   2HG   GLU  96          1HG       GLU  96   4.347 -12.125 -12.125
  776    H    GLN  97           H        GLN  97   0.639 -11.549 -11.549
  777    HA   GLN  97           HA       GLN  97   0.963 -11.167 -11.167
  778   1HB   GLN  97          2HB       GLN  97   0.401  -8.907  -8.907
  779   2HB   GLN  97          1HB       GLN  97  -1.226  -9.571  -9.571
  780   1HG   GLN  97          2HG       GLN  97  -0.873 -10.082 -10.082
  781   2HG   GLN  97          1HG       GLN  97   0.434  -8.905  -8.905
  782   1HE2  GLN  97          2HE2      GLN  97  -1.724  -6.110  -6.110
  783   2HE2  GLN  97          1HE2      GLN  97  -0.122  -6.666  -6.666
  784    H    LYS  98           H        LYS  98  -0.541 -12.273 -12.273
  785    HA   LYS  98           HA       LYS  98  -2.956 -13.382 -13.382
  786   1HB   LYS  98          2HB       LYS  98  -2.404 -15.671 -15.671
  787   2HB   LYS  98          1HB       LYS  98  -1.253 -15.107 -15.107
  788   1HG   LYS  98          2HG       LYS  98   0.212 -14.315 -14.315
  789   2HG   LYS  98          1HG       LYS  98  -0.870 -15.193 -15.193
  790   1HD   LYS  98          2HD       LYS  98   0.656 -16.871 -16.871
  791   2HD   LYS  98          1HD       LYS  98  -0.421 -17.150 -17.150
  792   1HE   LYS  98          2HE       LYS  98   1.015 -15.868 -15.868
  793   2HE   LYS  98          1HE       LYS  98   2.029 -15.369 -15.369
  794   1HZ   LYS  98          3HZ       LYS  98   2.288 -17.905 -17.905
  795   2HZ   LYS  98          2HZ       LYS  98   1.809 -18.007 -18.007
  796   3HZ   LYS  98          1HZ       LYS  98   3.201 -17.131 -17.131
  797    H    LEU  99           H        LEU  99  -4.571 -13.973 -13.973
  798    HA   LEU  99           HA       LEU  99  -4.538 -12.355 -12.355
  799   1HB   LEU  99          2HB       LEU  99  -6.184 -14.790 -14.790
  800   2HB   LEU  99          1HB       LEU  99  -6.496 -13.753 -13.753
  801    HG   LEU  99           HG       LEU  99  -6.224 -12.416 -12.416
  802   1HD1  LEU  99          2HD1      LEU  99  -8.379 -14.358 -14.358
  803   2HD1  LEU  99          1HD1      LEU  99  -8.823 -12.909 -12.909
  804   3HD1  LEU  99          3HD1      LEU  99  -7.662 -14.050 -14.050
  805   1HD2  LEU  99          3HD2      LEU  99  -6.781 -11.500 -11.500
  806   2HD2  LEU  99          2HD2      LEU  99  -7.561 -10.810 -10.810
  807   3HD2  LEU  99          1HD2      LEU  99  -8.416 -11.997 -11.997
  808    H    LEU 100           H        LEU 100  -4.807 -13.216 -13.216
  809    HA   LEU 100           HA       LEU 100  -2.822 -15.349 -15.349
  810   1HB   LEU 100          2HB       LEU 100  -3.970 -13.100 -13.100
  811   2HB   LEU 100          1HB       LEU 100  -3.059 -14.428 -14.428
  812    HG   LEU 100           HG       LEU 100  -1.976 -12.797 -12.797
  813   1HD1  LEU 100          1HD1      LEU 100  -1.860 -12.288 -12.288
  814   2HD1  LEU 100          3HD1      LEU 100  -0.601 -11.697 -11.697
  815   3HD1  LEU 100          2HD1      LEU 100  -2.267 -11.156 -11.156
  816   1HD2  LEU 100          1HD2      LEU 100  -0.966 -14.884 -14.884
  817   2HD2  LEU 100          3HD2      LEU 100  -0.639 -14.681 -14.681
  818   3HD2  LEU 100          2HD2      LEU 100   0.164 -13.644 -13.644
  819    H    LYS 101           H        LYS 101  -6.148 -14.942 -14.942
  820    HA   LYS 101           HA       LYS 101  -6.668 -17.440 -17.440
  821   1HB   LYS 101          2HB       LYS 101  -7.089 -15.608 -15.608
  822   2HB   LYS 101          1HB       LYS 101  -8.263 -14.913 -14.913
  823   1HG   LYS 101          2HG       LYS 101  -9.157 -17.482 -17.482
  824   2HG   LYS 101          1HG       LYS 101  -8.491 -17.308 -17.308
  825   1HD   LYS 101          2HD       LYS 101 -10.296 -15.195 -15.195
  826   2HD   LYS 101          1HD       LYS 101 -10.964 -16.620 -16.620
  827   1HE   LYS 101          2HE       LYS 101  -8.792 -15.204 -15.204
  828   2HE   LYS 101          1HE       LYS 101 -10.334 -14.356 -14.356
  829   1HZ   LYS 101          3HZ       LYS 101 -10.095 -17.173 -17.173
  830   2HZ   LYS 101          2HZ       LYS 101 -10.089 -15.857 -15.857
  831   3HZ   LYS 101          1HZ       LYS 101 -11.454 -16.164 -16.164
  832    H    GLY 102           H        GLY 102  -8.206 -18.651 -18.651
  833   1HA   GLY 102          2HA       GLY 102  -9.756 -19.238 -19.238
  834   2HA   GLY 102          1HA       GLY 102 -10.320 -17.566 -17.566
  835    H    GLU 103           H        GLU 103 -10.487 -17.644 -17.644
  836    HA   GLU 103           HA       GLU 103  -8.238 -16.518 -16.518
  837   1HB   GLU 103          2HB       GLU 103  -7.425 -18.886 -18.886
  838   2HB   GLU 103          1HB       GLU 103  -8.820 -19.386 -19.386
  839   1HG   GLU 103          2HG       GLU 103  -8.087 -18.203 -18.203
  840   2HG   GLU 103          1HG       GLU 103  -6.944 -17.240 -17.240
  841    H    GLY 104           H        GLY 104  -8.907 -15.595 -15.595
  842   1HA   GLY 104          2HA       GLY 104 -11.259 -16.559 -16.559
  843   2HA   GLY 104          1HA       GLY 104 -11.500 -15.012 -15.012
  844    HA   PRO 105           HA       PRO 105  -9.446 -13.158 -13.158
  845   1HB   PRO 105          2HB       PRO 105  -8.780 -10.739 -10.739
  846   2HB   PRO 105          1HB       PRO 105 -10.434 -11.168 -11.168
  847   1HG   PRO 105          2HG       PRO 105  -9.269 -10.938 -10.938
  848   2HG   PRO 105          1HG       PRO 105 -10.963 -10.839 -10.839
  849   1HD   PRO 105          2HD       PRO 105  -9.656 -13.091 -13.091
  850   2HD   PRO 105          1HD       PRO 105 -11.306 -13.038 -13.038
  851    H    LYS 106           H        LYS 106  -7.283 -11.710 -11.710
  852    HA   LYS 106           HA       LYS 106  -5.117 -12.748 -12.748
  853   1HB   LYS 106          2HB       LYS 106  -5.189 -14.204 -14.204
  854   2HB   LYS 106          1HB       LYS 106  -5.170 -12.795 -12.795
  855   1HG   LYS 106          2HG       LYS 106  -2.944 -12.390 -12.390
  856   2HG   LYS 106          1HG       LYS 106  -2.984 -12.985 -12.985
  857   1HD   LYS 106          2HD       LYS 106  -2.474 -15.116 -15.116
  858   2HD   LYS 106          1HD       LYS 106  -3.517 -15.052 -15.052
  859   1HE   LYS 106          2HE       LYS 106  -1.067 -15.258 -15.258
  860   2HE   LYS 106          1HE       LYS 106  -1.839 -13.841 -13.841
  861   1HZ   LYS 106          1HZ       LYS 106  -0.544 -13.653 -13.653
  862   2HZ   LYS 106          3HZ       LYS 106   0.393 -13.571 -13.571
  863   3HZ   LYS 106          2HZ       LYS 106  -0.835 -12.429 -12.429
  864    H    THR 107           H        THR 107  -3.467 -11.194 -11.194
  865    HA   THR 107           HA       THR 107  -3.850  -8.619  -8.619
  866    HB   THR 107           HB       THR 107  -2.658  -7.861  -7.861
  867    HG1  THR 107           HG1      THR 107  -3.125 -10.084 -10.084
  868   1HG2  THR 107          3HG2      THR 107  -4.702  -6.986  -6.986
  869   2HG2  THR 107          2HG2      THR 107  -5.649  -8.067  -8.067
  870   3HG2  THR 107          1HG2      THR 107  -4.699  -6.771  -6.771
  871    H    SER 108           H        SER 108  -2.053  -7.518  -7.518
  872    HA   SER 108           HA       SER 108   0.652  -8.281  -8.281
  873   1HB   SER 108          2HB       SER 108   1.245  -8.776  -8.776
  874   2HB   SER 108          1HB       SER 108   0.441 -10.056 -10.056
  875    HG   SER 108           HG       SER 108  -1.061  -9.940  -9.940
  876    H    TRP 109           H        TRP 109   1.853  -6.375  -6.375
  877    HA   TRP 109           HA       TRP 109   0.942  -4.398  -4.398
  878   1HB   TRP 109          2HB       TRP 109   1.310  -2.576  -2.576
  879   2HB   TRP 109          1HB       TRP 109  -0.089  -3.599  -3.599
  880    HD1  TRP 109           HD1      TRP 109  -0.117  -5.028  -5.028
  881    HE1  TRP 109           HE1      TRP 109   1.472  -5.232  -5.232
  882    HE3  TRP 109           HE3      TRP 109   3.924  -2.490  -2.490
  883    HZ2  TRP 109           HZ2      TRP 109   4.115  -4.421  -4.421
  884    HZ3  TRP 109           HZ3      TRP 109   5.952  -2.225  -2.225
  885    HH2  TRP 109           HH2      TRP 109   6.061  -3.178  -3.178
  886    H    THR 110           H        THR 110   2.601  -2.527  -2.527
  887    HA   THR 110           HA       THR 110   5.364  -3.573  -3.573
  888    HB   THR 110           HB       THR 110   6.059  -3.076  -3.076
  889    HG1  THR 110           HG1      THR 110   4.933  -1.779  -1.779
  890   1HG2  THR 110          3HG2      THR 110   4.093  -4.928  -4.928
  891   2HG2  THR 110          2HG2      THR 110   3.370  -3.931  -3.931
  892   3HG2  THR 110          1HG2      THR 110   4.937  -4.692  -4.692
  893    H    MET 111           H        MET 111   6.989  -1.740  -1.740
  894    HA   MET 111           HA       MET 111   5.996   0.998   0.998
  895   1HB   MET 111          2HB       MET 111   7.401   1.298   1.298
  896   2HB   MET 111          1HB       MET 111   5.964   0.302   0.302
  897   1HG   MET 111          2HG       MET 111   7.337  -1.733  -1.733
  898   2HG   MET 111          1HG       MET 111   8.774  -0.730  -0.730
  899   1HE   MET 111          1HE       MET 111   9.956   0.264   0.264
  900   2HE   MET 111          3HE       MET 111   9.361   1.205   1.205
  901   3HE   MET 111          2HE       MET 111  10.246  -0.292  -0.292
  902    H    GLU 112           H        GLU 112   7.324   2.273   2.273
  903    HA   GLU 112           HA       GLU 112  10.125   1.321   1.321
  904   1HB   GLU 112          2HB       GLU 112   8.651   1.152   1.152
  905   2HB   GLU 112          1HB       GLU 112   8.367   2.887   2.887
  906   1HG   GLU 112          2HG       GLU 112  10.530   3.425   3.425
  907   2HG   GLU 112          1HG       GLU 112  11.198   1.908   1.908
  908    H    LEU 113           H        LEU 113  11.724   2.973   2.973
  909    HA   LEU 113           HA       LEU 113  10.897   5.611   5.611
  910   1HB   LEU 113          2HB       LEU 113  12.716   3.778   3.778
  911   2HB   LEU 113          1HB       LEU 113  13.754   4.851   4.851
  912    HG   LEU 113           HG       LEU 113  13.459   5.444   5.444
  913   1HD1  LEU 113          1HD1      LEU 113  14.212   7.080   7.080
  914   2HD1  LEU 113          3HD1      LEU 113  12.535   7.538   7.538
  915   3HD1  LEU 113          2HD1      LEU 113  13.275   7.834   7.834
  916   1HD2  LEU 113          1HD2      LEU 113  10.941   4.910   4.910
  917   2HD2  LEU 113          3HD2      LEU 113  11.434   6.348   6.348
  918   3HD2  LEU 113          2HD2      LEU 113  10.758   6.503   6.503
  919    H    THR 114           H        THR 114  11.637   7.460   7.460
  920    HA   THR 114           HA       THR 114  12.647   6.865   6.865
  921    HB   THR 114           HB       THR 114  11.988   9.069   9.069
  922    HG1  THR 114           HG1      THR 114  11.953  10.669  10.669
  923   1HG2  THR 114          2HG2      THR 114  10.102   7.509   7.509
  924   2HG2  THR 114          1HG2      THR 114  10.007   8.141   8.141
  925   3HG2  THR 114          3HG2      THR 114   9.660   9.195   9.195
  926    H    ASN 115           H        ASN 115  14.449   8.158   8.158
  927    HA   ASN 115           HA       ASN 115  16.779   8.046   8.046
  928   1HB   ASN 115          2HB       ASN 115  16.157   9.424   9.424
  929   2HB   ASN 115          1HB       ASN 115  17.746   9.557   9.557
  930   1HD2  ASN 115          2HD2      ASN 115  17.295   6.450   6.450
  931   2HD2  ASN 115          1HD2      ASN 115  16.669   8.012   8.012
  932    H    ASP 116           H        ASP 116  14.355  10.525  10.525
  933    HA   ASP 116           HA       ASP 116  16.067  12.647  12.647
  934   1HB   ASP 116          2HB       ASP 116  14.149  13.053  13.053
  935   2HB   ASP 116          1HB       ASP 116  13.051  12.638  12.638
  936    H    GLY 117           H        GLY 117  13.738  10.292  10.292
  937   1HA   GLY 117          2HA       GLY 117  14.194   9.687   9.687
  938   2HA   GLY 117          1HA       GLY 117  14.042  11.411  11.411
  939    H    GLU 118           H        GLU 118  11.818  11.064  11.064
  940    HA   GLU 118           HA       GLU 118   9.553  11.268  11.268
  941   1HB   GLU 118          2HB       GLU 118   9.736  10.355  10.355
  942   2HB   GLU 118          1HB       GLU 118   8.233  10.774  10.774
  943   1HG   GLU 118          2HG       GLU 118   8.945  13.048  13.048
  944   2HG   GLU 118          1HG       GLU 118  10.583  12.670  12.670
  945    H    LEU 119           H        LEU 119   7.667   9.589   9.589
  946    HA   LEU 119           HA       LEU 119   8.682   6.793   6.793
  947   1HB   LEU 119          2HB       LEU 119   8.919   7.759   7.759
  948   2HB   LEU 119          1HB       LEU 119   7.172   7.972   7.972
  949    HG   LEU 119           HG       LEU 119   8.447   5.287   5.287
  950   1HD1  LEU 119          3HD1      LEU 119   7.977   6.732   6.732
  951   2HD1  LEU 119          2HD1      LEU 119   7.824   4.976   4.976
  952   3HD1  LEU 119          1HD1      LEU 119   9.354   5.744   5.744
  953   1HD2  LEU 119          3HD2      LEU 119   5.722   6.336   6.336
  954   2HD2  LEU 119          2HD2      LEU 119   6.161   5.132   5.132
  955   3HD2  LEU 119          1HD2      LEU 119   6.174   4.707   4.707
  956    H    ILE 120           H        ILE 120   7.310   5.882   5.882
  957    HA   ILE 120           HA       ILE 120   4.409   6.621   6.621
  958    HB   ILE 120           HB       ILE 120   5.340   6.993   6.993
  959   1HG1  ILE 120          2HG1      ILE 120   3.741   4.417   4.417
  960   2HG1  ILE 120          1HG1      ILE 120   3.025   6.000   6.000
  961   1HG2  ILE 120          1HG2      ILE 120   6.231   4.107   4.107
  962   2HG2  ILE 120          3HG2      ILE 120   6.229   5.000   5.000
  963   3HG2  ILE 120          2HG2      ILE 120   7.258   5.528   5.528
  964   1HD1  ILE 120          2HD1      ILE 120   4.732   5.490   5.490
  965   2HD1  ILE 120          1HD1      ILE 120   3.001   5.154   5.154
  966   3HD1  ILE 120          3HD1      ILE 120   3.580   6.797   6.797
  967    H    LEU 121           H        LEU 121   2.865   4.882   4.882
  968    HA   LEU 121           HA       LEU 121   4.092   2.240   2.240
  969   1HB   LEU 121          2HB       LEU 121   3.513   3.459   3.459
  970   2HB   LEU 121          1HB       LEU 121   1.859   3.648   3.648
  971    HG   LEU 121           HG       LEU 121   2.693   0.852   0.852
  972   1HD1  LEU 121          1HD1      LEU 121   2.977   2.360   2.360
  973   2HD1  LEU 121          3HD1      LEU 121   2.594   0.639   0.639
  974   3HD1  LEU 121          2HD1      LEU 121   4.105   1.219   1.219
  975   1HD2  LEU 121          2HD2      LEU 121   0.357   1.754   1.754
  976   2HD2  LEU 121          1HD2      LEU 121   0.594   0.537   0.537
  977   3HD2  LEU 121          3HD2      LEU 121   0.542   2.246   2.246
  978    H    THR 122           H        THR 122   2.858   0.460   0.460
  979    HA   THR 122           HA       THR 122   0.321   1.033   1.033
  980    HB   THR 122           HB       THR 122   1.497  -1.387  -1.387
  981    HG1  THR 122           HG1      THR 122   3.189   0.890   0.890
  982   1HG2  THR 122          3HG2      THR 122   0.829   1.339   1.339
  983   2HG2  THR 122          2HG2      THR 122   1.585   0.119   0.119
  984   3HG2  THR 122          1HG2      THR 122   0.014  -0.198  -0.198
  985    H    MET 123           H        MET 123  -1.009  -1.096  -1.096
  986    HA   MET 123           HA       MET 123  -0.473  -2.871  -2.871
  987   1HB   MET 123          2HB       MET 123  -3.010  -1.217  -1.217
  988   2HB   MET 123          1HB       MET 123  -2.634  -2.402  -2.402
  989   1HG   MET 123          2HG       MET 123  -0.581  -1.007  -1.007
  990   2HG   MET 123          1HG       MET 123  -1.244   0.234   0.234
  991   1HE   MET 123          1HE       MET 123  -0.805  -1.004  -1.004
  992   2HE   MET 123          3HE       MET 123  -2.282  -0.784  -0.784
  993   3HE   MET 123          2HE       MET 123  -2.161  -2.111  -2.111
  994    H    THR 124           H        THR 124  -2.087  -4.638  -4.638
  995    HA   THR 124           HA       THR 124  -3.663  -5.042  -5.042
  996    HB   THR 124           HB       THR 124  -1.781  -7.194  -7.194
  997    HG1  THR 124           HG1      THR 124  -0.458  -5.578  -5.578
  998   1HG2  THR 124          3HG2      THR 124  -3.792  -7.803  -7.803
  999   2HG2  THR 124          2HG2      THR 124  -3.234  -6.724  -6.724
 1000   3HG2  THR 124          1HG2      THR 124  -2.287  -8.148  -8.148
 1001    H    ALA 125           H        ALA 125  -5.274  -6.640  -6.640
 1002    HA   ALA 125           HA       ALA 125  -5.551  -8.082  -8.082
 1003   1HB   ALA 125          3HB       ALA 125  -6.371  -5.593  -5.593
 1004   2HB   ALA 125          2HB       ALA 125  -7.790  -6.175  -6.175
 1005   3HB   ALA 125          1HB       ALA 125  -7.331  -6.914  -6.914
 1006    H    ASP 126           H        ASP 126  -5.845  -9.955  -9.955
 1007    HA   ASP 126           HA       ASP 126  -7.130 -11.616 -11.616
 1008   1HB   ASP 126          2HB       ASP 126  -9.087  -9.697  -9.697
 1009   2HB   ASP 126          1HB       ASP 126  -9.401 -10.107 -10.107
 1010    H    ASP 127           H        ASP 127  -8.273  -8.831  -8.831
 1011    HA   ASP 127           HA       ASP 127  -6.320  -9.444  -9.444
 1012   1HB   ASP 127          2HB       ASP 127  -9.277  -9.919  -9.919
 1013   2HB   ASP 127          1HB       ASP 127  -8.363  -9.393  -9.393
 1014    H    VAL 128           H        VAL 128  -7.114  -7.225  -7.225
 1015    HA   VAL 128           HA       VAL 128  -7.538  -5.110  -5.110
 1016    HB   VAL 128           HB       VAL 128  -8.589  -3.746  -3.746
 1017   1HG1  VAL 128          1HG1      VAL 128  -9.766  -5.814  -5.814
 1018   2HG1  VAL 128          3HG1      VAL 128  -9.966  -6.355  -6.355
 1019   3HG1  VAL 128          2HG1      VAL 128 -10.629  -4.802  -4.802
 1020   1HG2  VAL 128          2HG2      VAL 128  -7.470  -5.865  -5.865
 1021   2HG2  VAL 128          1HG2      VAL 128  -7.796  -4.171  -4.171
 1022   3HG2  VAL 128          3HG2      VAL 128  -9.103  -5.353  -5.353
 1023    H    VAL 129           H        VAL 129  -6.618  -2.931  -2.931
 1024    HA   VAL 129           HA       VAL 129  -4.251  -3.426  -3.426
 1025    HB   VAL 129           HB       VAL 129  -4.103  -3.043  -3.043
 1026   1HG1  VAL 129          1HG1      VAL 129  -2.184  -1.729  -1.729
 1027   2HG1  VAL 129          3HG1      VAL 129  -1.698  -2.178  -2.178
 1028   3HG1  VAL 129          2HG1      VAL 129  -2.987  -1.001  -1.001
 1029   1HG2  VAL 129          2HG2      VAL 129  -2.788  -4.638  -4.638
 1030   2HG2  VAL 129          1HG2      VAL 129  -3.383  -5.147  -5.147
 1031   3HG2  VAL 129          3HG2      VAL 129  -1.846  -4.293  -4.293
 1032    H    CYS 130           H        CYS 130  -4.307  -1.762  -1.762
 1033    HA   CYS 130           HA       CYS 130  -5.404   0.855   0.855
 1034   1HB   CYS 130          2HB       CYS 130  -6.157  -0.384  -0.384
 1035   2HB   CYS 130          1HB       CYS 130  -4.638   0.215   0.215
 1036    HG   CYS 130           HG       CYS 130  -6.252   2.433   2.433
 1037    H    THR 131           H        THR 131  -4.025   2.581   2.581
 1038    HA   THR 131           HA       THR 131  -1.221   2.269   2.269
 1039    HB   THR 131           HB       THR 131  -2.222   3.552   3.552
 1040    HG1  THR 131           HG1      THR 131  -2.207   1.262   1.262
 1041   1HG2  THR 131          3HG2      THR 131   0.565   3.228   3.228
 1042   2HG2  THR 131          2HG2      THR 131   0.225   3.706   3.706
 1043   3HG2  THR 131          1HG2      THR 131  -0.276   4.743   4.743
 1044    H    ARG 132           H        ARG 132  -0.592   3.913   3.913
 1045    HA   ARG 132           HA       ARG 132  -2.061   6.506   6.506
 1046   1HB   ARG 132          2HB       ARG 132  -1.080   5.024   5.024
 1047   2HB   ARG 132          1HB       ARG 132  -1.657   6.691   6.691
 1048   1HG   ARG 132          2HG       ARG 132  -3.827   5.919   5.919
 1049   2HG   ARG 132          1HG       ARG 132  -3.249   4.256   4.256
 1050   1HD   ARG 132          2HD       ARG 132  -2.748   5.023   5.023
 1051   2HD   ARG 132          1HD       ARG 132  -4.102   6.097   6.097
 1052    HE   ARG 132           HE       ARG 132  -4.450   3.215   3.215
 1053   1HH1  ARG 132          1HH1      ARG 132  -7.210   5.136   5.136
 1054   2HH1  ARG 132          2HH1      ARG 132  -6.407   5.682   5.682
 1055   1HH2  ARG 132          1HH2      ARG 132  -4.911   2.623   2.623
 1056   2HH2  ARG 132          2HH2      ARG 132  -6.363   3.404   3.404
 1057    H    VAL 133           H        VAL 133  -0.522   7.720   7.720
 1058    HA   VAL 133           HA       VAL 133   2.326   7.390   7.390
 1059    HB   VAL 133           HB       VAL 133   0.802   9.777   9.777
 1060   1HG1  VAL 133          1HG1      VAL 133   3.705   8.939   8.939
 1061   2HG1  VAL 133          3HG1      VAL 133   2.964  10.251  10.251
 1062   3HG1  VAL 133          2HG1      VAL 133   3.095  10.367  10.367
 1063   1HG2  VAL 133          1HG2      VAL 133   1.658   7.166   7.166
 1064   2HG2  VAL 133          3HG2      VAL 133   0.226   8.133   8.133
 1065   3HG2  VAL 133          2HG2      VAL 133   1.790   8.597   8.597
 1066    H    TYR 134           H        TYR 134   3.635   8.310   8.310
 1067    HA   TYR 134           HA       TYR 134   2.341  10.297  10.297
 1068   1HB   TYR 134          2HB       TYR 134   4.013   7.884   7.884
 1069   2HB   TYR 134          1HB       TYR 134   4.038   9.265   9.265
 1070    HD1  TYR 134           HD2      TYR 134   1.975  10.015  10.015
 1071    HD2  TYR 134           HD1      TYR 134   2.046   6.507   6.507
 1072    HE1  TYR 134           HE2      TYR 134  -0.176   9.274   9.274
 1073    HE2  TYR 134           HE1      TYR 134  -0.108   5.766   5.766
 1074    HH   TYR 134           HH       TYR 134  -1.382   7.054   7.054
 1075    H    VAL 135           H        VAL 135   3.419  12.143  12.143
 1076    HA   VAL 135           HA       VAL 135   6.281  12.219  12.219
 1077    HB   VAL 135           HB       VAL 135   4.102  13.789  13.789
 1078   1HG1  VAL 135          1HG1      VAL 135   4.379  15.135  15.135
 1079   2HG1  VAL 135          3HG1      VAL 135   5.999  15.555  15.555
 1080   3HG1  VAL 135          2HG1      VAL 135   4.588  16.063  16.063
 1081   1HG2  VAL 135          2HG2      VAL 135   7.088  13.884  13.884
 1082   2HG2  VAL 135          1HG2      VAL 135   5.879  13.438  13.438
 1083   3HG2  VAL 135          3HG2      VAL 135   6.104  15.132  15.132
 1084    H    ARG 136           H        ARG 136   7.762  12.989  12.989
 1085    HA   ARG 136           HA       ARG 136   7.181  12.719  12.719
 1086   1HB   ARG 136          2HB       ARG 136   9.383  13.733  13.733
 1087   2HB   ARG 136          1HB       ARG 136   9.137  14.747  14.747
 1088   1HG   ARG 136          2HG       ARG 136   9.526  13.026  13.026
 1089   2HG   ARG 136          1HG       ARG 136   9.029  11.783  11.783
 1090   1HD   ARG 136          2HD       ARG 136  11.620  13.356  13.356
 1091   2HD   ARG 136          1HD       ARG 136  11.429  11.625  11.625
 1092    HE   ARG 136           HE       ARG 136  10.321  12.083  12.083
 1093   1HH1  ARG 136          2HH1      ARG 136  12.963  10.621  10.621
 1094   2HH1  ARG 136          1HH1      ARG 136  14.079  11.318  11.318
 1095   1HH2  ARG 136          1HH2      ARG 136  11.915  13.846  13.846
 1096   2HH2  ARG 136          2HH2      ARG 136  13.485  13.147  13.147
 1097    H    GLU 137           HN       GLU 137   6.053  13.781  13.781
 1098    HA   GLU 137           HA       GLU 137   4.560  15.360  15.360
 1099   1HB   GLU 137          2HB       GLU 137   7.000  16.069  16.069
 1100   2HB   GLU 137          1HB       GLU 137   6.684  17.347  17.347
 1101   1HG   GLU 137          2HG       GLU 137   4.640  17.964  17.964
 1102   2HG   GLU 137          1HG       GLU 137   5.146  16.797  16.797

  Start of MODEL    7
    1   1H    PRO   1          1H        PRO   1 -16.545   7.633   7.633
    2   2H    PRO   1          2H        PRO   1 -16.188   6.857   6.857
    3    HA   PRO   1           HA       PRO   1 -16.685   4.885   4.885
    4   1HB   PRO   1          2HB       PRO   1 -19.261   5.304   5.304
    5   2HB   PRO   1          1HB       PRO   1 -18.886   4.516   4.516
    6   1HG   PRO   1          2HG       PRO   1 -20.075   7.088   7.088
    7   2HG   PRO   1          1HG       PRO   1 -19.700   6.294   6.294
    8   1HD   PRO   1          1HD       PRO   1 -18.364   8.527   8.527
    9   2HD   PRO   1          2HD       PRO   1 -17.991   7.725   7.725
   10    H    ASN   2           H        ASN   2 -15.206   6.580   6.580
   11    HA   ASN   2           HA       ASN   2 -15.645   5.281   5.281
   12   1HB   ASN   2          2HB       ASN   2 -16.422   8.139   8.139
   13   2HB   ASN   2          1HB       ASN   2 -15.647   7.712   7.712
   14   1HD2  ASN   2          2HD2      ASN   2 -19.511   6.743   6.743
   15   2HD2  ASN   2          1HD2      ASN   2 -18.645   7.725   7.725
   16    H    PHE   3           H        PHE   3 -13.643   4.863   4.863
   17    HA   PHE   3           HA       PHE   3 -11.368   6.508   6.508
   18   1HB   PHE   3          2HB       PHE   3 -11.517   3.828   3.828
   19   2HB   PHE   3          1HB       PHE   3 -10.021   4.622   4.622
   20    HD1  PHE   3           HD1      PHE   3 -13.298   3.803   3.803
   21    HD2  PHE   3           HD2      PHE   3  -9.005   3.768   3.768
   22    HE1  PHE   3           HE1      PHE   3 -13.411   2.751   2.751
   23    HE2  PHE   3           HE2      PHE   3  -9.127   2.710   2.710
   24    HZ   PHE   3           HZ       PHE   3 -11.332   2.191   2.191
   25    H    SER   4           H        SER   4 -13.438   6.451   6.451
   26    HA   SER   4           HA       SER   4 -11.604   6.604   6.604
   27   1HB   SER   4          2HB       SER   4 -13.579   7.522   7.522
   28   2HB   SER   4          1HB       SER   4 -13.918   6.017   6.017
   29    HG   SER   4           HG       SER   4 -15.181   7.059   7.059
   30    H    GLY   5           H        GLY   5 -10.197   8.192   8.192
   31   1HA   GLY   5          2HA       GLY   5 -10.705  10.836  10.836
   32   2HA   GLY   5          1HA       GLY   5 -10.437  10.834  10.834
   33    H    ASN   6           H        ASN   6  -8.535  12.226  12.226
   34    HA   ASN   6           HA       ASN   6  -6.260  10.525  10.525
   35   1HB   ASN   6          2HB       ASN   6  -6.792  13.496  13.496
   36   2HB   ASN   6          1HB       ASN   6  -5.126  12.913  12.913
   37   1HD2  ASN   6          2HD2      ASN   6  -5.712  11.250  11.250
   38   2HD2  ASN   6          1HD2      ASN   6  -5.162  10.783  10.783
   39    H    TRP   7           H        TRP   7  -4.165  11.006  11.006
   40    HA   TRP   7           HA       TRP   7  -4.766  11.710  11.710
   41   1HB   TRP   7          2HB       TRP   7  -3.850   8.970   8.970
   42   2HB   TRP   7          1HB       TRP   7  -3.857   9.516   9.516
   43    HD1  TRP   7           HD1      TRP   7  -6.062   8.137   8.137
   44    HE1  TRP   7           HE1      TRP   7  -8.516   8.046   8.046
   45    HE3  TRP   7           HE3      TRP   7  -5.615  10.903  10.903
   46    HZ2  TRP   7           HZ2      TRP   7 -10.069   9.067   9.067
   47    HZ3  TRP   7           HZ3      TRP   7  -7.577  11.366  11.366
   48    HH2  TRP   7           HH2      TRP   7  -9.785  10.449  10.449
   49    H    LYS   8           H        LYS   8  -3.129  12.843  12.843
   50    HA   LYS   8           HA       LYS   8  -0.377  12.272  12.272
   51   1HB   LYS   8          2HB       LYS   8  -1.767  14.880  14.880
   52   2HB   LYS   8          1HB       LYS   8  -0.026  14.767  14.767
   53   1HG   LYS   8          2HG       LYS   8  -0.328  13.533  13.533
   54   2HG   LYS   8          1HG       LYS   8  -1.546  14.806  14.806
   55   1HD   LYS   8          2HD       LYS   8   1.219  15.450  15.450
   56   2HD   LYS   8          1HD       LYS   8   0.913  15.338  15.338
   57   1HE   LYS   8          2HE       LYS   8  -0.412  17.213  17.213
   58   2HE   LYS   8          1HE       LYS   8  -1.028  16.930  16.930
   59   1HZ   LYS   8          3HZ       LYS   8   1.734  17.825  17.825
   60   2HZ   LYS   8          2HZ       LYS   8   0.470  18.860  18.860
   61   3HZ   LYS   8          1HZ       LYS   8   1.039  17.673  17.673
   62    H    ILE   9           H        ILE   9   0.714  11.315  11.315
   63    HA   ILE   9           HA       ILE   9  -0.070  11.057  11.057
   64    HB   ILE   9           HB       ILE   9   1.532   9.581   9.581
   65   1HG1  ILE   9          2HG1      ILE   9   2.738  11.086  11.086
   66   2HG1  ILE   9          1HG1      ILE   9   1.626   9.723   9.723
   67   1HG2  ILE   9          1HG2      ILE   9   3.311  12.038  12.038
   68   2HG2  ILE   9          3HG2      ILE   9   3.882  10.408  10.408
   69   3HG2  ILE   9          2HG2      ILE   9   2.690  11.170  11.170
   70   1HD1  ILE   9          1HD1      ILE   9   3.515   8.597   8.597
   71   2HD1  ILE   9          3HD1      ILE   9   4.526   9.756   9.756
   72   3HD1  ILE   9          2HD1      ILE   9   3.599   8.554   8.554
   73    H    ILE  10           H        ILE  10   0.332  12.212  12.212
   74    HA   ILE  10           HA       ILE  10   1.812  14.789  14.789
   75    HB   ILE  10           HB       ILE  10   0.328  15.714  15.714
   76   1HG1  ILE  10          2HG1      ILE  10  -1.824  13.980  13.980
   77   2HG1  ILE  10          1HG1      ILE  10  -0.450  12.878  12.878
   78   1HG2  ILE  10          1HG2      ILE  10  -0.251  15.441  15.441
   79   2HG2  ILE  10          3HG2      ILE  10  -1.565  14.459  14.459
   80   3HG2  ILE  10          2HG2      ILE  10  -1.408  16.148  16.148
   81   1HD1  ILE  10          3HD1      ILE  10   0.547  14.233  14.233
   82   2HD1  ILE  10          2HD1      ILE  10  -0.858  15.298  15.298
   83   3HD1  ILE  10          1HD1      ILE  10  -1.043  13.612  13.612
   84    H    ARG  11           H        ARG  11   1.432  11.852  11.852
   85    HA   ARG  11           HA       ARG  11   3.809  12.641  12.641
   86   1HB   ARG  11          2HB       ARG  11   1.082  12.060  12.060
   87   2HB   ARG  11          1HB       ARG  11   2.429  11.335  11.335
   88   1HG   ARG  11          2HG       ARG  11   2.449  14.255  14.255
   89   2HG   ARG  11          1HG       ARG  11   1.673  13.700  13.700
   90   1HD   ARG  11          2HD       ARG  11   4.509  12.921  12.921
   91   2HD   ARG  11          1HD       ARG  11   4.144  14.422  14.422
   92    HE   ARG  11           HE       ARG  11   2.803  12.306  12.306
   93   1HH1  ARG  11          1HH2      ARG  11   5.271  14.406  14.406
   94   2HH1  ARG  11          2HH2      ARG  11   6.290  13.352  13.352
   95   1HH2  ARG  11          2HH1      ARG  11   4.415  10.515  10.515
   96   2HH2  ARG  11          1HH1      ARG  11   5.805  11.149  11.149
   97    H    SER  12           H        SER  12   4.527  10.618  10.618
   98    HA   SER  12           HA       SER  12   3.833   7.974   7.974
   99   1HB   SER  12          2HB       SER  12   4.639   8.467   8.467
  100   2HB   SER  12          1HB       SER  12   6.091   9.231   9.231
  101    HG   SER  12           HG       SER  12   6.853   7.272   7.272
  102    H    GLU  13           H        GLU  13   5.580   6.404   6.404
  103    HA   GLU  13           HA       GLU  13   7.719   7.592   7.592
  104   1HB   GLU  13          2HB       GLU  13   6.830   6.626   6.626
  105   2HB   GLU  13          1HB       GLU  13   5.847   7.943   7.943
  106   1HG   GLU  13          2HG       GLU  13   4.981   5.408   5.408
  107   2HG   GLU  13          1HG       GLU  13   4.981   5.333   5.333
  108    H    ASN  14           H        ASN  14   7.273   5.460   5.460
  109    HA   ASN  14           HA       ASN  14   9.056   3.456   3.456
  110   1HB   ASN  14          2HB       ASN  14   6.216   2.833   2.833
  111   2HB   ASN  14          1HB       ASN  14   7.453   1.586   1.586
  112   1HD2  ASN  14          2HD2      ASN  14   5.644   2.256   2.256
  113   2HD2  ASN  14          1HD2      ASN  14   4.993   2.386   2.386
  114    H    PHE  15           H        PHE  15   8.905   5.372   5.372
  115    HA   PHE  15           HA       PHE  15   8.523   3.867   3.867
  116   1HB   PHE  15          2HB       PHE  15   8.762   6.419   6.419
  117   2HB   PHE  15          1HB       PHE  15  10.493   6.137   6.137
  118    HD1  PHE  15           HD2      PHE  15   9.793   3.567   3.567
  119    HD2  PHE  15           HD1      PHE  15   9.461   7.847   7.847
  120    HE1  PHE  15           HE2      PHE  15   9.932   3.562   3.562
  121    HE2  PHE  15           HE1      PHE  15   9.589   7.828   7.828
  122    HZ   PHE  15           HZ       PHE  15   9.824   5.669   5.669
  123    H    GLU  16           H        GLU  16  11.659   4.932   4.932
  124    HA   GLU  16           HA       GLU  16  13.262   3.162   3.162
  125   1HB   GLU  16          2HB       GLU  16  13.888   5.131   5.131
  126   2HB   GLU  16          1HB       GLU  16  14.019   3.824   3.824
  127   1HG   GLU  16          2HG       GLU  16  15.850   2.895   2.895
  128   2HG   GLU  16          1HG       GLU  16  15.319   3.378   3.378
  129    H    GLU  17           H        GLU  17  11.352   2.594   2.594
  130    HA   GLU  17           HA       GLU  17  12.584   0.187   0.187
  131   1HB   GLU  17          2HB       GLU  17   9.744   1.194   1.194
  132   2HB   GLU  17          1HB       GLU  17  10.361  -0.221  -0.221
  133   1HG   GLU  17          2HG       GLU  17  12.307   1.582   1.582
  134   2HG   GLU  17          1HG       GLU  17  10.906   2.647   2.647
  135    H    LEU  18           H        LEU  18   9.984   0.791   0.791
  136    HA   LEU  18           HA       LEU  18   9.577  -2.038  -2.038
  137   1HB   LEU  18          2HB       LEU  18   7.952   0.063   0.063
  138   2HB   LEU  18          1HB       LEU  18   8.656   0.004   0.004
  139    HG   LEU  18           HG       LEU  18   8.110  -2.450  -2.450
  140   1HD1  LEU  18          3HD1      LEU  18   7.129  -1.748  -1.748
  141   2HD1  LEU  18          2HD1      LEU  18   6.104  -2.831  -2.831
  142   3HD1  LEU  18          1HD1      LEU  18   7.778  -3.271  -3.271
  143   1HD2  LEU  18          1HD2      LEU  18   6.244  -0.189  -0.189
  144   2HD2  LEU  18          3HD2      LEU  18   6.428  -1.538  -1.538
  145   3HD2  LEU  18          2HD2      LEU  18   5.430  -1.720  -1.720
  146    H    LEU  19           H        LEU  19  11.794   0.342   0.342
  147    HA   LEU  19           HA       LEU  19  12.228  -1.141  -1.141
  148   1HB   LEU  19          2HB       LEU  19  13.875   1.194   1.194
  149   2HB   LEU  19          1HB       LEU  19  13.700   0.628   0.628
  150    HG   LEU  19           HG       LEU  19  11.702   2.135   2.135
  151   1HD1  LEU  19          1HD1      LEU  19  13.501   2.812   2.812
  152   2HD1  LEU  19          3HD1      LEU  19  11.867   2.971   2.971
  153   3HD1  LEU  19          2HD1      LEU  19  12.325   3.839   3.839
  154   1HD2  LEU  19          1HD2      LEU  19  10.522   0.179   0.179
  155   2HD2  LEU  19          3HD2      LEU  19   9.968   1.739   1.739
  156   3HD2  LEU  19          2HD2      LEU  19  11.072   0.766   0.766
  157    H    LYS  20           H        LYS  20  13.393  -1.076  -1.076
  158    HA   LYS  20           HA       LYS  20  15.994  -2.299  -2.299
  159   1HB   LYS  20          2HB       LYS  20  14.691  -2.111  -2.111
  160   2HB   LYS  20          1HB       LYS  20  16.400  -2.351  -2.351
  161   1HG   LYS  20          2HG       LYS  20  15.447   0.053   0.053
  162   2HG   LYS  20          1HG       LYS  20  15.059   0.106   0.106
  163   1HD   LYS  20          2HD       LYS  20  17.805  -0.518  -0.518
  164   2HD   LYS  20          1HD       LYS  20  17.307   1.058   1.058
  165   1HE   LYS  20          2HE       LYS  20  16.665  -0.204  -0.204
  166   2HE   LYS  20          1HE       LYS  20  17.646  -1.523  -1.523
  167   1HZ   LYS  20          1HZ       LYS  20  18.586   1.267   1.267
  168   2HZ   LYS  20          3HZ       LYS  20  18.918  -0.026  -0.026
  169   3HZ   LYS  20          2HZ       LYS  20  19.523  -0.042  -0.042
  170    H    VAL  21           H        VAL  21  12.765  -3.196  -3.196
  171    HA   VAL  21           HA       VAL  21  13.407  -5.972  -5.972
  172    HB   VAL  21           HB       VAL  21  11.468  -4.724  -4.724
  173   1HG1  VAL  21          2HG1      VAL  21  10.861  -3.470  -3.470
  174   2HG1  VAL  21          1HG1      VAL  21  10.247  -4.959  -4.959
  175   3HG1  VAL  21          3HG1      VAL  21   9.486  -4.284  -4.284
  176   1HG2  VAL  21          1HG2      VAL  21  11.618  -7.301  -7.301
  177   2HG2  VAL  21          3HG2      VAL  21  10.074  -6.610  -6.610
  178   3HG2  VAL  21          2HG2      VAL  21  10.366  -6.985  -6.985
  179    H    LEU  22           H        LEU  22  12.071  -4.126  -4.126
  180    HA   LEU  22           HA       LEU  22  11.469  -6.307  -6.307
  181   1HB   LEU  22          2HB       LEU  22  11.689  -3.357  -3.357
  182   2HB   LEU  22          1HB       LEU  22  12.020  -4.154  -4.154
  183    HG   LEU  22           HG       LEU  22   9.853  -5.221  -5.221
  184   1HD1  LEU  22          1HD1      LEU  22   9.778  -5.612  -5.612
  185   2HD1  LEU  22          3HD1      LEU  22   9.363  -3.913  -3.913
  186   3HD1  LEU  22          2HD1      LEU  22   8.271  -4.985  -4.985
  187   1HD2  LEU  22          2HD2      LEU  22  10.184  -2.685  -2.685
  188   2HD2  LEU  22          1HD2      LEU  22   8.540  -3.303  -3.303
  189   3HD2  LEU  22          3HD2      LEU  22   9.293  -2.425  -2.425
  190    H    GLY  23           H        GLY  23  14.206  -4.093  -4.093
  191   1HA   GLY  23          2HA       GLY  23  15.761  -5.760  -5.760
  192   2HA   GLY  23          1HA       GLY  23  16.166  -4.113  -4.113
  193    H    VAL  24           H        VAL  24  18.307  -4.848  -4.848
  194    HA   VAL  24           HA       VAL  24  18.599  -5.878  -5.878
  195    HB   VAL  24           HB       VAL  24  20.321  -7.543  -7.543
  196   1HG1  VAL  24          3HG1      VAL  24  17.740  -7.946  -7.946
  197   2HG1  VAL  24          2HG1      VAL  24  17.752  -8.190  -8.190
  198   3HG1  VAL  24          1HG1      VAL  24  18.738  -9.217  -9.217
  199   1HG2  VAL  24          1HG2      VAL  24  19.227  -6.796  -6.796
  200   2HG2  VAL  24          3HG2      VAL  24  20.887  -6.598  -6.598
  201   3HG2  VAL  24          2HG2      VAL  24  20.228  -8.214  -8.214
  202    H    ASN  25           H        ASN  25  20.142  -4.545  -4.545
  203    HA   ASN  25           HA       ASN  25  22.665  -3.893  -3.893
  204   1HB   ASN  25          2HB       ASN  25  21.671  -3.790  -3.790
  205   2HB   ASN  25          1HB       ASN  25  21.467  -2.100  -2.100
  206   1HD2  ASN  25          2HD2      ASN  25  24.852  -1.379  -1.379
  207   2HD2  ASN  25          1HD2      ASN  25  23.259  -0.812  -0.812
  208    H    VAL  26           H        VAL  26  22.595  -0.966  -0.966
  209    HA   VAL  26           HA       VAL  26  20.978   0.047   0.047
  210    HB   VAL  26           HB       VAL  26  22.949   1.613   1.613
  211   1HG1  VAL  26          3HG1      VAL  26  22.646  -1.241  -1.241
  212   2HG1  VAL  26          2HG1      VAL  26  24.264  -0.598  -0.598
  213   3HG1  VAL  26          1HG1      VAL  26  22.872   0.148   0.148
  214   1HG2  VAL  26          1HG2      VAL  26  24.272  -0.412  -0.412
  215   2HG2  VAL  26          3HG2      VAL  26  24.298   1.347   1.347
  216   3HG2  VAL  26          2HG2      VAL  26  25.182   0.545   0.545
  217    H    MET  27           H        MET  27  22.911   0.968   0.968
  218    HA   MET  27           HA       MET  27  21.656   3.574   3.574
  219   1HB   MET  27          2HB       MET  27  23.888   2.579   2.579
  220   2HB   MET  27          1HB       MET  27  22.787   2.131   2.131
  221   1HG   MET  27          2HG       MET  27  22.054   4.446   4.446
  222   2HG   MET  27          1HG       MET  27  23.043   4.926   4.926
  223   1HE   MET  27          1HE       MET  27  23.989   6.700   6.700
  224   2HE   MET  27          3HE       MET  27  25.208   6.671   6.671
  225   3HE   MET  27          2HE       MET  27  23.500   6.515   6.515
  226    H    LEU  28           H        LEU  28  21.047   0.339   0.339
  227    HA   LEU  28           HA       LEU  28  19.188   0.615   0.615
  228   1HB   LEU  28          2HB       LEU  28  19.761  -1.304  -1.304
  229   2HB   LEU  28          1HB       LEU  28  18.155  -1.443  -1.443
  230    HG   LEU  28           HG       LEU  28  19.092  -1.772  -1.772
  231   1HD1  LEU  28          2HD1      LEU  28  21.751  -1.191  -1.191
  232   2HD1  LEU  28          1HD1      LEU  28  21.608  -1.888  -1.888
  233   3HD1  LEU  28          3HD1      LEU  28  20.991  -0.267  -0.267
  234   1HD2  LEU  28          3HD2      LEU  28  19.833  -3.445  -3.445
  235   2HD2  LEU  28          2HD2      LEU  28  19.195  -3.919  -3.919
  236   3HD2  LEU  28          1HD2      LEU  28  20.926  -3.662  -3.662
  237    H    ARG  29           H        ARG  29  18.661   1.101   1.101
  238    HA   ARG  29           HA       ARG  29  15.769   1.384   1.384
  239   1HB   ARG  29          2HB       ARG  29  17.468   2.279   2.279
  240   2HB   ARG  29          1HB       ARG  29  15.752   1.883   1.883
  241   1HG   ARG  29          2HG       ARG  29  16.265  -0.250  -0.250
  242   2HG   ARG  29          1HG       ARG  29  17.101  -0.396  -0.396
  243   1HD   ARG  29          2HD       ARG  29  18.516  -0.924  -0.924
  244   2HD   ARG  29          1HD       ARG  29  19.187   0.297   0.297
  245    HE   ARG  29           HE       ARG  29  17.579   1.469   1.469
  246   1HH1  ARG  29          2HH1      ARG  29  19.786  -0.444  -0.444
  247   2HH1  ARG  29          1HH1      ARG  29  21.033   0.709   0.709
  248   1HH2  ARG  29          1HH2      ARG  29  19.563   3.238   3.238
  249   2HH2  ARG  29          2HH2      ARG  29  20.909   2.793   2.793
  250    H    LYS  30           H        LYS  30  18.533   3.572   3.572
  251    HA   LYS  30           HA       LYS  30  17.036   5.977   5.977
  252   1HB   LYS  30          2HB       LYS  30  19.596   5.496   5.496
  253   2HB   LYS  30          1HB       LYS  30  19.731   5.954   5.954
  254   1HG   LYS  30          2HG       LYS  30  18.802   8.118   8.118
  255   2HG   LYS  30          1HG       LYS  30  18.273   7.660   7.660
  256   1HD   LYS  30          2HD       LYS  30  20.210   8.715   8.715
  257   2HD   LYS  30          1HD       LYS  30  20.920   7.147   7.147
  258   1HE   LYS  30          2HE       LYS  30  21.797   7.885   7.885
  259   2HE   LYS  30          1HE       LYS  30  20.560   9.126   9.126
  260   1HZ   LYS  30          3HZ       LYS  30  21.648  10.155  10.155
  261   2HZ   LYS  30          2HZ       LYS  30  22.981   9.178   9.178
  262   3HZ   LYS  30          1HZ       LYS  30  22.418  10.340  10.340
  263    H    ILE  31           H        ILE  31  17.706   3.988   3.988
  264    HA   ILE  31           HA       ILE  31  17.301   6.147   6.147
  265    HB   ILE  31           HB       ILE  31  17.316   3.130   3.130
  266   1HG1  ILE  31          2HG1      ILE  31  19.456   4.079   4.079
  267   2HG1  ILE  31          1HG1      ILE  31  19.604   3.487   3.487
  268   1HG2  ILE  31          3HG2      ILE  31  17.342   5.420   5.420
  269   2HG2  ILE  31          2HG2      ILE  31  17.709   3.747   3.747
  270   3HG2  ILE  31          1HG2      ILE  31  16.104   4.176   4.176
  271   1HD1  ILE  31          3HD1      ILE  31  18.788   6.168   6.168
  272   2HD1  ILE  31          2HD1      ILE  31  20.000   6.176   6.176
  273   3HD1  ILE  31          1HD1      ILE  31  20.401   5.522   5.522
  274    H    ALA  32           H        ALA  32  15.357   3.758   3.758
  275    HA   ALA  32           HA       ALA  32  13.001   4.208   4.208
  276   1HB   ALA  32          2HB       ALA  32  13.528   2.627   2.627
  277   2HB   ALA  32          1HB       ALA  32  11.897   2.832   2.832
  278   3HB   ALA  32          3HB       ALA  32  13.128   2.020   2.020
  279    H    VAL  33           H        VAL  33  14.395   5.483   5.483
  280    HA   VAL  33           HA       VAL  33  11.981   6.778   6.778
  281    HB   VAL  33           HB       VAL  33  14.837   7.525   7.525
  282   1HG1  VAL  33          1HG1      VAL  33  12.864   8.932   8.932
  283   2HG1  VAL  33          3HG1      VAL  33  12.345   7.543   7.543
  284   3HG1  VAL  33          2HG1      VAL  33  13.893   8.317   8.317
  285   1HG2  VAL  33          1HG2      VAL  33  13.867   4.951   4.951
  286   2HG2  VAL  33          3HG2      VAL  33  15.143   5.643   5.643
  287   3HG2  VAL  33          2HG2      VAL  33  13.476   5.641   5.641
  288    H    ALA  34           H        ALA  34  14.833   7.654   7.654
  289    HA   ALA  34           HA       ALA  34  14.093  10.442  10.442
  290   1HB   ALA  34          1HB       ALA  34  16.435   9.191   9.191
  291   2HB   ALA  34          3HB       ALA  34  15.883   9.085   9.085
  292   3HB   ALA  34          2HB       ALA  34  16.063  10.661  10.661
  293    H    ALA  35           H        ALA  35  13.670   7.473   7.473
  294    HA   ALA  35           HA       ALA  35  12.625   8.610   8.610
  295   1HB   ALA  35          2HB       ALA  35  12.241   5.915   5.915
  296   2HB   ALA  35          1HB       ALA  35  11.552   6.308   6.308
  297   3HB   ALA  35          3HB       ALA  35  13.302   6.302   6.302
  298    H    ALA  36           H        ALA  36  11.117   7.589   7.589
  299    HA   ALA  36           HA       ALA  36   8.410   8.012   8.012
  300   1HB   ALA  36          3HB       ALA  36   9.872   7.486   7.486
  301   2HB   ALA  36          2HB       ALA  36   8.409   8.438   8.438
  302   3HB   ALA  36          1HB       ALA  36   8.319   6.851   6.851
  303    H    SER  37           H        SER  37  10.302   9.954   9.954
  304    HA   SER  37           HA       SER  37  10.184  12.248  12.248
  305   1HB   SER  37          2HB       SER  37  10.288  12.028  12.028
  306   2HB   SER  37          1HB       SER  37   9.754  13.585  13.585
  307    HG   SER  37           HG       SER  37  12.223  12.415  12.415
  308    H    LYS  38           H        LYS  38   7.902  11.119  11.119
  309    HA   LYS  38           HA       LYS  38   5.634  11.549  11.549
  310   1HB   LYS  38          2HB       LYS  38   5.993  14.117  14.117
  311   2HB   LYS  38          1HB       LYS  38   4.767  13.770  13.770
  312   1HG   LYS  38          2HG       LYS  38   6.931  13.339  13.339
  313   2HG   LYS  38          1HG       LYS  38   7.648  14.465  14.465
  314   1HD   LYS  38          2HD       LYS  38   6.123  16.187  16.187
  315   2HD   LYS  38          1HD       LYS  38   5.013  15.065  15.065
  316   1HE   LYS  38          2HE       LYS  38   7.775  15.207  15.207
  317   2HE   LYS  38          1HE       LYS  38   6.732  16.600  16.600
  318   1HZ   LYS  38          2HZ       LYS  38   6.059  13.776  13.776
  319   2HZ   LYS  38          1HZ       LYS  38   6.519  14.959  14.959
  320   3HZ   LYS  38          3HZ       LYS  38   5.059  15.120  15.120
  321    HA   PRO  39           HA       PRO  39   5.029  10.089  10.089
  322   1HB   PRO  39          2HB       PRO  39   4.069   7.603   7.603
  323   2HB   PRO  39          1HB       PRO  39   5.772   7.965   7.965
  324   1HG   PRO  39          2HG       PRO  39   4.385   7.533   7.533
  325   2HG   PRO  39          1HG       PRO  39   6.082   7.258   7.258
  326   1HD   PRO  39          2HD       PRO  39   5.115   9.456   9.456
  327   2HD   PRO  39          1HD       PRO  39   6.699   9.361   9.361
  328    H    ALA  40           H        ALA  40   3.016   9.862   9.862
  329    HA   ALA  40           HA       ALA  40   0.666  10.657  10.657
  330   1HB   ALA  40          3HB       ALA  40   1.465  11.047  11.047
  331   2HB   ALA  40          2HB       ALA  40  -0.251  11.040  11.040
  332   3HB   ALA  40          1HB       ALA  40   0.827  12.222  12.222
  333    H    VAL  41           H        VAL  41  -1.467   9.784   9.784
  334    HA   VAL  41           HA       VAL  41  -1.294   7.105   7.105
  335    HB   VAL  41           HB       VAL  41  -2.201   7.631   7.631
  336   1HG1  VAL  41          3HG1      VAL  41  -2.711   5.193   5.193
  337   2HG1  VAL  41          2HG1      VAL  41  -2.948   5.245   5.245
  338   3HG1  VAL  41          1HG1      VAL  41  -3.930   6.263   6.263
  339   1HG2  VAL  41          1HG2      VAL  41  -0.182   5.787   5.787
  340   2HG2  VAL  41          3HG2      VAL  41   0.133   7.106   7.106
  341   3HG2  VAL  41          2HG2      VAL  41  -0.685   5.646   5.646
  342    H    GLU  42           H        GLU  42  -3.540   6.296   6.296
  343    HA   GLU  42           HA       GLU  42  -5.678   8.339   8.339
  344   1HB   GLU  42          2HB       GLU  42  -4.550   8.817   8.817
  345   2HB   GLU  42          1HB       GLU  42  -4.753   7.137   7.137
  346   1HG   GLU  42          2HG       GLU  42  -7.323   7.764   7.764
  347   2HG   GLU  42          1HG       GLU  42  -6.739   9.347   9.347
  348    H    ILE  43           H        ILE  43  -7.227   7.166   7.166
  349    HA   ILE  43           HA       ILE  43  -7.416   4.269   4.269
  350    HB   ILE  43           HB       ILE  43  -8.549   6.032   6.032
  351   1HG1  ILE  43          2HG1      ILE  43  -6.972   3.660   3.660
  352   2HG1  ILE  43          1HG1      ILE  43  -6.077   4.782   4.782
  353   1HG2  ILE  43          3HG2      ILE  43  -9.231   3.217   3.217
  354   2HG2  ILE  43          2HG2      ILE  43  -9.137   3.628   3.628
  355   3HG2  ILE  43          1HG2      ILE  43 -10.268   4.480   4.480
  356   1HD1  ILE  43          3HD1      ILE  43  -7.551   6.226   6.226
  357   2HD1  ILE  43          2HD1      ILE  43  -6.512   5.004   5.004
  358   3HD1  ILE  43          1HD1      ILE  43  -5.819   6.226   6.226
  359    H    LYS  44           H        LYS  44  -9.032   3.431   3.431
  360    HA   LYS  44           HA       LYS  44 -11.304   5.209   5.209
  361   1HB   LYS  44          2HB       LYS  44 -11.028   2.782   2.782
  362   2HB   LYS  44          1HB       LYS  44 -11.161   4.454   4.454
  363   1HG   LYS  44          2HG       LYS  44  -8.767   4.784   4.784
  364   2HG   LYS  44          1HG       LYS  44  -8.572   3.252   3.252
  365   1HD   LYS  44          2HD       LYS  44  -8.045   2.500   2.500
  366   2HD   LYS  44          1HD       LYS  44  -9.796   2.400   2.400
  367   1HE   LYS  44          2HE       LYS  44  -8.266   4.920   4.920
  368   2HE   LYS  44          1HE       LYS  44  -8.524   3.646   3.646
  369   1HZ   LYS  44          2HZ       LYS  44 -10.967   3.842   3.842
  370   2HZ   LYS  44          1HZ       LYS  44 -10.521   5.347   5.347
  371   3HZ   LYS  44          3HZ       LYS  44 -10.321   5.049   5.049
  372    H    GLN  45           H        GLN  45 -12.985   4.676   4.676
  373    HA   GLN  45           HA       GLN  45 -13.215   1.852   1.852
  374   1HB   GLN  45          2HB       GLN  45 -13.303   3.612   3.612
  375   2HB   GLN  45          1HB       GLN  45 -14.718   4.314   4.314
  376   1HG   GLN  45          2HG       GLN  45 -15.925   2.153   2.153
  377   2HG   GLN  45          1HG       GLN  45 -14.529   1.529   1.529
  378   1HE2  GLN  45          2HE2      GLN  45 -16.187   2.732   2.732
  379   2HE2  GLN  45          1HE2      GLN  45 -15.721   1.357   1.357
  380    H    GLU  46           H        GLU  46 -14.606   0.504   0.504
  381    HA   GLU  46           HA       GLU  46 -17.048   1.633   1.633
  382   1HB   GLU  46          2HB       GLU  46 -15.081  -0.417  -0.417
  383   2HB   GLU  46          1HB       GLU  46 -16.775  -0.587  -0.587
  384   1HG   GLU  46          2HG       GLU  46 -15.534   2.112   2.112
  385   2HG   GLU  46          1HG       GLU  46 -15.071   0.872   0.872
  386    H    GLY  47           H        GLY  47 -17.307   1.040   1.040
  387   1HA   GLY  47          2HA       GLY  47 -18.962  -0.186  -0.186
  388   2HA   GLY  47          1HA       GLY  47 -18.926  -1.443  -1.443
  389    H    ASP  48           H        ASP  48 -18.150  -3.304  -3.304
  390    HA   ASP  48           HA       ASP  48 -16.325  -3.286  -3.286
  391   1HB   ASP  48          2HB       ASP  48 -16.217  -5.794  -5.794
  392   2HB   ASP  48          1HB       ASP  48 -17.786  -5.161  -5.161
  393    H    THR  49           H        THR  49 -15.758  -2.693  -2.693
  394    HA   THR  49           HA       THR  49 -13.196  -4.158  -4.158
  395    HB   THR  49           HB       THR  49 -14.838  -2.650  -2.650
  396    HG1  THR  49           HG1      THR  49 -13.788  -5.278  -5.278
  397   1HG2  THR  49          1HG2      THR  49 -11.936  -3.339  -3.339
  398   2HG2  THR  49          3HG2      THR  49 -12.881  -3.605  -3.605
  399   3HG2  THR  49          2HG2      THR  49 -12.794  -1.994  -1.994
  400    H    PHE  50           H        PHE  50 -11.254  -3.083  -3.083
  401    HA   PHE  50           HA       PHE  50 -11.345  -0.111  -0.111
  402   1HB   PHE  50          2HB       PHE  50  -9.958  -1.956  -1.956
  403   2HB   PHE  50          1HB       PHE  50  -9.740  -0.204  -0.204
  404    HD1  PHE  50           HD1      PHE  50 -12.083  -2.943  -2.943
  405    HD2  PHE  50           HD2      PHE  50 -11.545   1.309   1.309
  406    HE1  PHE  50           HE1      PHE  50 -14.202  -2.665  -2.665
  407    HE2  PHE  50           HE2      PHE  50 -13.660   1.592   1.592
  408    HZ   PHE  50           HZ       PHE  50 -15.000  -0.401  -0.401
  409    H    TYR  51           H        TYR  51 -10.072   0.595   0.595
  410    HA   TYR  51           HA       TYR  51  -7.718  -0.991  -0.991
  411   1HB   TYR  51          2HB       TYR  51  -9.495  -0.246  -0.246
  412   2HB   TYR  51          1HB       TYR  51  -9.027   1.412   1.412
  413    HD1  TYR  51           HD1      TYR  51  -6.442   1.915   1.915
  414    HD2  TYR  51           HD2      TYR  51  -8.449  -1.397  -1.397
  415    HE1  TYR  51           HE1      TYR  51  -4.616   1.742   1.742
  416    HE2  TYR  51           HE2      TYR  51  -6.623  -1.556  -1.556
  417    HH   TYR  51           HH       TYR  51  -4.854   0.233   0.233
  418    H    ILE  52           H        ILE  52  -5.628   0.086   0.086
  419    HA   ILE  52           HA       ILE  52  -5.545   2.771   2.771
  420    HB   ILE  52           HB       ILE  52  -3.686   0.711   0.711
  421   1HG1  ILE  52          2HG1      ILE  52  -6.618   0.962   0.962
  422   2HG1  ILE  52          1HG1      ILE  52  -5.856  -0.455  -0.455
  423   1HG2  ILE  52          1HG2      ILE  52  -3.974   3.315   3.315
  424   2HG2  ILE  52          3HG2      ILE  52  -5.232   2.739   2.739
  425   3HG2  ILE  52          2HG2      ILE  52  -3.567   2.195   2.195
  426   1HD1  ILE  52          2HD1      ILE  52  -4.254  -0.054  -0.054
  427   2HD1  ILE  52          1HD1      ILE  52  -5.806   0.512   0.512
  428   3HD1  ILE  52          3HD1      ILE  52  -5.653  -1.128  -1.128
  429    H    LYS  53           H        LYS  53  -4.521   3.769   3.769
  430    HA   LYS  53           HA       LYS  53  -2.094   2.508   2.508
  431   1HB   LYS  53          2HB       LYS  53  -4.062   3.598   3.598
  432   2HB   LYS  53          1HB       LYS  53  -3.283   5.115   5.115
  433   1HG   LYS  53          2HG       LYS  53  -1.228   3.348   3.348
  434   2HG   LYS  53          1HG       LYS  53  -2.541   3.245   3.245
  435   1HD   LYS  53          2HD       LYS  53  -2.355   5.978   5.978
  436   2HD   LYS  53          1HD       LYS  53  -0.676   5.442   5.442
  437   1HE   LYS  53          2HE       LYS  53  -0.741   4.864   4.864
  438   2HE   LYS  53          1HE       LYS  53  -2.446   4.415   4.415
  439   1HZ   LYS  53          2HZ       LYS  53  -1.553   7.222   7.222
  440   2HZ   LYS  53          1HZ       LYS  53  -1.860   6.523   6.523
  441   3HZ   LYS  53          3HZ       LYS  53  -3.105   6.641   6.641
  442    H    THR  54           H        THR  54  -0.259   3.044   3.044
  443    HA   THR  54           HA       THR  54  -0.046   5.729   5.729
  444    HB   THR  54           HB       THR  54   1.835   3.359   3.359
  445    HG1  THR  54           HG1      THR  54   0.103   2.614   2.614
  446   1HG2  THR  54          1HG2      THR  54   2.113   6.044   6.044
  447   2HG2  THR  54          3HG2      THR  54   1.683   5.182   5.182
  448   3HG2  THR  54          2HG2      THR  54   3.090   4.682   4.682
  449    H    SER  55           H        SER  55   1.652   7.152   7.152
  450    HA   SER  55           HA       SER  55   3.378   6.307   6.307
  451   1HB   SER  55          2HB       SER  55   2.898   8.710   8.710
  452   2HB   SER  55          1HB       SER  55   1.719   7.436   7.436
  453    HG   SER  55           HG       SER  55   1.249   9.700   9.700
  454    H    THR  56           H        THR  56   5.434   6.982   6.982
  455    HA   THR  56           HA       THR  56   6.031   8.997   8.997
  456    HB   THR  56           HB       THR  56   8.406   7.860   7.860
  457    HG1  THR  56           HG1      THR  56   8.374   5.990   5.990
  458   1HG2  THR  56          2HG2      THR  56   7.046   7.794   7.794
  459   2HG2  THR  56          1HG2      THR  56   6.111   6.455   6.455
  460   3HG2  THR  56          3HG2      THR  56   7.824   6.242   6.242
  461    H    THR  57           H        THR  57   7.546   7.690   7.690
  462    HA   THR  57           HA       THR  57   7.545  10.050  10.050
  463    HB   THR  57           HB       THR  57   8.988  11.032  11.032
  464    HG1  THR  57           HG1      THR  57   9.696  11.682  11.682
  465   1HG2  THR  57          1HG2      THR  57   9.746   8.784   8.784
  466   2HG2  THR  57          3HG2      THR  57  10.888   8.725   8.725
  467   3HG2  THR  57          2HG2      THR  57  11.016  10.000  10.000
  468    H    VAL  58           H        VAL  58   9.395   7.233   7.233
  469    HA   VAL  58           HA       VAL  58   9.807   6.529   6.529
  470    HB   VAL  58           HB       VAL  58  11.606   5.842   5.842
  471   1HG1  VAL  58          1HG1      VAL  58  11.671   5.286   5.286
  472   2HG1  VAL  58          3HG1      VAL  58  13.166   5.346   5.346
  473   3HG1  VAL  58          2HG1      VAL  58  11.920   4.164   4.164
  474   1HG2  VAL  58          1HG2      VAL  58  11.364   8.321   8.321
  475   2HG2  VAL  58          3HG2      VAL  58  12.870   7.694   7.694
  476   3HG2  VAL  58          2HG2      VAL  58  12.568   7.599   7.599
  477    H    ARG  59           H        ARG  59   8.320   5.568   5.568
  478    HA   ARG  59           HA       ARG  59   8.422   2.695   2.695
  479   1HB   ARG  59          2HB       ARG  59   8.823   3.095   3.095
  480   2HB   ARG  59          1HB       ARG  59   7.376   4.093   4.093
  481   1HG   ARG  59          2HG       ARG  59   5.973   2.289   2.289
  482   2HG   ARG  59          1HG       ARG  59   6.941   1.356   1.356
  483   1HD   ARG  59          2HD       ARG  59   7.688   1.865   1.865
  484   2HD   ARG  59          1HD       ARG  59   6.998   0.364   0.364
  485    HE   ARG  59           HE       ARG  59   9.174   0.578   0.578
  486   1HH1  ARG  59          1HH2      ARG  59   9.567   2.356   2.356
  487   2HH1  ARG  59          2HH2      ARG  59  10.817   1.387   1.387
  488   1HH2  ARG  59          2HH1      ARG  59  10.439  -1.218  -1.218
  489   2HH2  ARG  59          1HH1      ARG  59  11.310  -0.636  -0.636
  490    H    THR  60           H        THR  60   5.687   4.406   4.406
  491    HA   THR  60           HA       THR  60   3.471   4.664   4.664
  492    HB   THR  60           HB       THR  60   4.256   3.836   3.836
  493    HG1  THR  60           HG1      THR  60   5.747   5.327   5.327
  494   1HG2  THR  60          3HG2      THR  60   1.876   4.365   4.365
  495   2HG2  THR  60          2HG2      THR  60   2.406   6.009   6.009
  496   3HG2  THR  60          1HG2      THR  60   2.512   5.387   5.387
  497    H    THR  61           H        THR  61   2.945   2.782   2.782
  498    HA   THR  61           HA       THR  61   2.593   0.272   0.272
  499    HB   THR  61           HB       THR  61   2.166  -0.620  -0.620
  500    HG1  THR  61           HG1      THR  61   2.272   1.395   1.395
  501   1HG2  THR  61          1HG2      THR  61   4.070  -1.142  -1.142
  502   2HG2  THR  61          3HG2      THR  61   4.981   0.133   0.133
  503   3HG2  THR  61          2HG2      THR  61   4.456  -1.287  -1.287
  504    H    GLU  62           H        GLU  62   0.580  -1.002  -1.002
  505    HA   GLU  62           HA       GLU  62  -1.640   0.584   0.584
  506   1HB   GLU  62          2HB       GLU  62  -3.021   0.583   0.583
  507   2HB   GLU  62          1HB       GLU  62  -1.511   1.429   1.429
  508   1HG   GLU  62          2HG       GLU  62  -0.864  -1.163  -1.163
  509   2HG   GLU  62          1HG       GLU  62  -2.554  -1.061  -1.061
  510    H    ILE  63           H        ILE  63  -2.859  -0.831  -0.831
  511    HA   ILE  63           HA       ILE  63  -2.863  -3.708  -3.708
  512    HB   ILE  63           HB       ILE  63  -3.443  -4.197  -4.197
  513   1HG1  ILE  63          2HG1      ILE  63  -2.879  -1.247  -1.247
  514   2HG1  ILE  63          1HG1      ILE  63  -4.494  -1.957  -1.957
  515   1HG2  ILE  63          2HG2      ILE  63  -1.014  -3.817  -3.817
  516   2HG2  ILE  63          1HG2      ILE  63  -1.002  -2.471  -2.471
  517   3HG2  ILE  63          3HG2      ILE  63  -1.242  -4.119  -4.119
  518   1HD1  ILE  63          1HD1      ILE  63  -3.279  -3.633  -3.633
  519   2HD1  ILE  63          3HD1      ILE  63  -2.332  -2.174  -2.174
  520   3HD1  ILE  63          2HD1      ILE  63  -4.082  -2.149  -2.149
  521    H    ASN  64           H        ASN  64  -5.045  -4.797  -4.797
  522    HA   ASN  64           HA       ASN  64  -7.351  -3.039  -3.039
  523   1HB   ASN  64          2HB       ASN  64  -8.340  -3.415  -3.415
  524   2HB   ASN  64          1HB       ASN  64  -6.690  -2.866  -2.866
  525   1HD2  ASN  64          2HD2      ASN  64  -7.722  -6.691  -6.691
  526   2HD2  ASN  64          1HD2      ASN  64  -8.726  -5.772  -5.772
  527    H    PHE  65           H        PHE  65  -9.033  -4.196  -4.196
  528    HA   PHE  65           HA       PHE  65  -9.270  -7.101  -7.101
  529   1HB   PHE  65          2HB       PHE  65  -8.762  -7.734  -7.734
  530   2HB   PHE  65          1HB       PHE  65  -7.383  -6.905  -6.905
  531    HD1  PHE  65           HD2      PHE  65  -6.929  -4.506  -4.506
  532    HD2  PHE  65           HD1      PHE  65  -9.983  -6.785  -6.785
  533    HE1  PHE  65           HE2      PHE  65  -7.057  -2.789  -2.789
  534    HE2  PHE  65           HE1      PHE  65 -10.122  -5.073  -5.073
  535    HZ   PHE  65           HZ       PHE  65  -8.662  -3.070  -3.070
  536    H    LYS  66           H        LYS  66 -10.693  -7.938  -7.938
  537    HA   LYS  66           HA       LYS  66 -12.968  -6.052  -6.052
  538   1HB   LYS  66          2HB       LYS  66 -14.458  -8.127  -8.127
  539   2HB   LYS  66          1HB       LYS  66 -13.804  -7.557  -7.557
  540   1HG   LYS  66          2HG       LYS  66 -11.920  -9.215  -9.215
  541   2HG   LYS  66          1HG       LYS  66 -12.781  -9.864  -9.864
  542   1HD   LYS  66          2HD       LYS  66 -13.968  -9.657  -9.657
  543   2HD   LYS  66          1HD       LYS  66 -13.244 -11.123 -11.123
  544   1HE   LYS  66          2HE       LYS  66 -14.885 -11.183 -11.183
  545   2HE   LYS  66          1HE       LYS  66 -15.556  -9.636  -9.636
  546   1HZ   LYS  66          1HZ       LYS  66 -15.951 -10.782 -10.782
  547   2HZ   LYS  66          3HZ       LYS  66 -15.671 -12.240 -12.240
  548   3HZ   LYS  66          2HZ       LYS  66 -16.957 -11.236 -11.236
  549    H    VAL  67           H        VAL  67 -14.082  -6.466  -6.466
  550    HA   VAL  67           HA       VAL  67 -12.228  -7.572  -7.572
  551    HB   VAL  67           HB       VAL  67 -14.942  -6.818  -6.818
  552   1HG1  VAL  67          1HG1      VAL  67 -12.070  -6.330  -6.330
  553   2HG1  VAL  67          3HG1      VAL  67 -13.367  -5.392  -5.392
  554   3HG1  VAL  67          2HG1      VAL  67 -13.336  -7.146  -7.146
  555   1HG2  VAL  67          1HG2      VAL  67 -13.235  -4.945  -4.945
  556   2HG2  VAL  67          3HG2      VAL  67 -14.991  -5.009  -5.009
  557   3HG2  VAL  67          2HG2      VAL  67 -14.022  -4.322  -4.322
  558    H    GLY  68           H        GLY  68 -12.213  -9.833  -9.833
  559   1HA   GLY  68          2HA       GLY  68 -13.738 -11.545 -11.545
  560   2HA   GLY  68          1HA       GLY  68 -14.817 -11.252 -11.252
  561    H    GLU  69           H        GLU  69 -12.527 -11.005 -11.005
  562    HA   GLU  69           HA       GLU  69 -11.794 -13.911 -13.911
  563   1HB   GLU  69          2HB       GLU  69 -12.646 -11.991 -11.991
  564   2HB   GLU  69          1HB       GLU  69 -11.670 -13.407 -13.407
  565   1HG   GLU  69          2HG       GLU  69 -13.531 -14.584 -14.584
  566   2HG   GLU  69          1HG       GLU  69 -14.494 -13.251 -13.251
  567    H    GLU  70           H        GLU  70  -9.710 -14.393 -14.393
  568    HA   GLU  70           HA       GLU  70  -7.680 -12.374 -12.374
  569   1HB   GLU  70          2HB       GLU  70  -7.277 -15.134 -15.134
  570   2HB   GLU  70          1HB       GLU  70  -6.069 -14.145 -14.145
  571   1HG   GLU  70          2HG       GLU  70  -7.117 -14.421 -14.421
  572   2HG   GLU  70          1HG       GLU  70  -8.608 -15.020 -15.020
  573    H    PHE  71           H        PHE  71  -5.832 -12.086 -12.086
  574    HA   PHE  71           HA       PHE  71  -6.527 -12.350 -12.350
  575   1HB   PHE  71          2HB       PHE  71  -6.458  -9.878  -9.878
  576   2HB   PHE  71          1HB       PHE  71  -7.863 -10.386 -10.386
  577    HD1  PHE  71           HD2      PHE  71  -7.730 -10.227 -10.227
  578    HD2  PHE  71           HD1      PHE  71  -4.944  -8.293  -8.293
  579    HE1  PHE  71           HE2      PHE  71  -7.049  -8.703  -8.703
  580    HE2  PHE  71           HE1      PHE  71  -4.265  -6.767  -6.767
  581    HZ   PHE  71           HZ       PHE  71  -5.314  -6.969  -6.969
  582    H    GLU  72           H        GLU  72  -4.814 -11.072 -11.072
  583    HA   GLU  72           HA       GLU  72  -2.197 -11.418 -11.418
  584   1HB   GLU  72          2HB       GLU  72  -2.451 -11.017 -11.017
  585   2HB   GLU  72          1HB       GLU  72  -1.179 -11.830 -11.830
  586   1HG   GLU  72          2HG       GLU  72  -2.806 -13.630 -13.630
  587   2HG   GLU  72          1HG       GLU  72  -4.000 -12.853 -12.853
  588    H    GLU  73           H        GLU  73  -0.717  -9.694  -9.694
  589    HA   GLU  73           HA       GLU  73  -1.299  -7.191  -7.191
  590   1HB   GLU  73          2HB       GLU  73  -1.472  -5.850  -5.850
  591   2HB   GLU  73          1HB       GLU  73  -2.847  -6.926  -6.926
  592   1HG   GLU  73          2HG       GLU  73  -2.271  -8.294  -8.294
  593   2HG   GLU  73          1HG       GLU  73  -0.542  -8.042  -8.042
  594    H    GLN  74           H        GLN  74   0.285  -5.440  -5.440
  595    HA   GLN  74           HA       GLN  74   2.935  -6.843  -6.843
  596   1HB   GLN  74          2HB       GLN  74   2.024  -4.207  -4.207
  597   2HB   GLN  74          1HB       GLN  74   3.632  -4.265  -4.265
  598   1HG   GLN  74          2HG       GLN  74   3.953  -6.402  -6.402
  599   2HG   GLN  74          1HG       GLN  74   2.579  -5.785  -5.785
  600   1HE2  GLN  74          2HE2      GLN  74   6.213  -4.017  -4.017
  601   2HE2  GLN  74          1HE2      GLN  74   5.984  -5.334  -5.334
  602    H    THR  75           H        THR  75   4.500  -5.987  -5.987
  603    HA   THR  75           HA       THR  75   3.152  -5.146  -5.146
  604    HB   THR  75           HB       THR  75   5.819  -5.539  -5.539
  605    HG1  THR  75           HG1      THR  75   6.642  -6.932  -6.932
  606   1HG2  THR  75          1HG2      THR  75   3.281  -6.887  -6.887
  607   2HG2  THR  75          3HG2      THR  75   4.619  -8.032  -8.032
  608   3HG2  THR  75          2HG2      THR  75   4.637  -6.737  -6.737
  609    H    VAL  76           H        VAL  76   5.092  -3.871  -3.871
  610    HA   VAL  76           HA       VAL  76   5.152  -1.275  -1.275
  611    HB   VAL  76           HB       VAL  76   6.294  -2.071  -2.071
  612   1HG1  VAL  76          3HG1      VAL  76   5.691   0.554   0.554
  613   2HG1  VAL  76          2HG1      VAL  76   5.779   0.432   0.432
  614   3HG1  VAL  76          1HG1      VAL  76   7.189   0.038   0.038
  615   1HG2  VAL  76          2HG2      VAL  76   3.852  -2.572  -2.572
  616   2HG2  VAL  76          1HG2      VAL  76   4.181  -1.315  -1.315
  617   3HG2  VAL  76          3HG2      VAL  76   3.583  -0.878  -0.878
  618    H    ASP  77           H        ASP  77   7.350  -3.928  -3.928
  619    HA   ASP  77           HA       ASP  77   9.732  -2.277  -2.277
  620   1HB   ASP  77          2HB       ASP  77   9.401  -4.595  -4.595
  621   2HB   ASP  77          1HB       ASP  77   9.897  -5.227  -5.227
  622    H    GLY  78           H        GLY  78   7.774  -4.692  -4.692
  623   1HA   GLY  78          2HA       GLY  78   7.469  -4.060  -4.060
  624   2HA   GLY  78          1HA       GLY  78   9.230  -4.040  -4.040
  625    H    ARG  79           H        ARG  79   7.060  -6.316  -6.316
  626    HA   ARG  79           HA       ARG  79   8.151  -8.491  -8.491
  627   1HB   ARG  79          2HB       ARG  79   8.001  -8.212  -8.212
  628   2HB   ARG  79          1HB       ARG  79   7.728  -9.810  -9.810
  629   1HG   ARG  79          2HG       ARG  79  10.093  -8.137  -8.137
  630   2HG   ARG  79          1HG       ARG  79  10.160  -9.153  -9.153
  631   1HD   ARG  79          2HD       ARG  79   9.386 -10.177 -10.177
  632   2HD   ARG  79          1HD       ARG  79  11.016 -10.284 -10.284
  633    HE   ARG  79           HE       ARG  79   8.690 -11.556 -11.556
  634   1HH1  ARG  79          2HH1      ARG  79  11.625 -11.477 -11.477
  635   2HH1  ARG  79          1HH1      ARG  79  12.131 -13.082 -13.082
  636   1HH2  ARG  79          1HH2      ARG  79   9.444 -13.675 -13.675
  637   2HH2  ARG  79          2HH2      ARG  79  10.897 -14.326 -14.326
  638    HA   PRO  80           HA       PRO  80   3.858  -9.473  -9.473
  639   1HB   PRO  80          2HB       PRO  80   4.055 -12.120 -12.120
  640   2HB   PRO  80          1HB       PRO  80   4.429 -10.771 -10.771
  641   1HG   PRO  80          2HG       PRO  80   6.294 -12.636 -12.636
  642   2HG   PRO  80          1HG       PRO  80   6.528 -11.728 -11.728
  643   1HD   PRO  80          2HD       PRO  80   7.586 -11.045 -11.045
  644   2HD   PRO  80          1HD       PRO  80   7.540  -9.994  -9.994
  645    H    CYS  81           H        CYS  81   2.256 -10.173 -10.173
  646    HA   CYS  81           HA       CYS  81   2.599 -12.480 -12.480
  647   1HB   CYS  81          2HB       CYS  81   2.229 -11.147 -11.147
  648   2HB   CYS  81          1HB       CYS  81   3.804 -10.873 -10.873
  649    HG   CYS  81           HG       CYS  81   2.411  -8.714  -8.714
  650    H    LYS  82           H        LYS  82   0.600 -13.228 -13.228
  651    HA   LYS  82           HA       LYS  82  -1.759 -11.915 -11.915
  652   1HB   LYS  82          2HB       LYS  82  -1.577 -14.330 -14.330
  653   2HB   LYS  82          1HB       LYS  82  -1.393 -14.537 -14.537
  654   1HG   LYS  82          2HG       LYS  82  -3.621 -14.835 -14.835
  655   2HG   LYS  82          1HG       LYS  82  -3.778 -13.115 -13.115
  656   1HD   LYS  82          2HD       LYS  82  -5.080 -14.106 -14.106
  657   2HD   LYS  82          1HD       LYS  82  -3.540 -13.804 -13.804
  658   1HE   LYS  82          2HE       LYS  82  -2.874 -16.174 -16.174
  659   2HE   LYS  82          1HE       LYS  82  -4.567 -16.420 -16.420
  660   1HZ   LYS  82          3HZ       LYS  82  -3.806 -15.371 -15.371
  661   2HZ   LYS  82          2HZ       LYS  82  -3.812 -17.043 -17.043
  662   3HZ   LYS  82          1HZ       LYS  82  -5.244 -16.141 -16.141
  663    H    SER  83           H        SER  83  -2.769 -10.401 -10.401
  664    HA   SER  83           HA       SER  83  -2.434 -10.364 -10.364
  665   1HB   SER  83          2HB       SER  83  -1.934  -8.244  -8.244
  666   2HB   SER  83          1HB       SER  83  -3.236  -8.343  -8.343
  667    HG   SER  83           HG       SER  83  -3.687  -6.942  -6.942
  668    H    LEU  84           H        LEU  84  -4.462  -9.711  -9.711
  669    HA   LEU  84           HA       LEU  84  -7.016 -10.479 -10.479
  670   1HB   LEU  84          2HB       LEU  84  -6.207 -12.627 -12.627
  671   2HB   LEU  84          1HB       LEU  84  -5.913 -11.883 -11.883
  672    HG   LEU  84           HG       LEU  84  -8.317 -11.435 -11.435
  673   1HD1  LEU  84          2HD1      LEU  84  -8.748 -11.245 -11.245
  674   2HD1  LEU  84          1HD1      LEU  84  -8.738 -13.002 -13.002
  675   3HD1  LEU  84          3HD1      LEU  84  -9.950 -12.153 -12.153
  676   1HD2  LEU  84          3HD2      LEU  84  -7.138 -13.758 -13.758
  677   2HD2  LEU  84          2HD2      LEU  84  -8.888 -13.605 -13.605
  678   3HD2  LEU  84          1HD2      LEU  84  -8.191 -14.296 -14.296
  679    H    VAL  85           H        VAL  85  -8.851  -9.640  -9.640
  680    HA   VAL  85           HA       VAL  85  -8.031  -7.930  -7.930
  681    HB   VAL  85           HB       VAL  85  -9.598  -6.837  -6.837
  682   1HG1  VAL  85          3HG1      VAL  85  -9.191  -5.950  -5.950
  683   2HG1  VAL  85          2HG1      VAL  85  -8.323  -4.850  -4.850
  684   3HG1  VAL  85          1HG1      VAL  85 -10.048  -5.133  -5.133
  685   1HG2  VAL  85          2HG2      VAL  85  -6.667  -6.730  -6.730
  686   2HG2  VAL  85          1HG2      VAL  85  -7.411  -7.129  -7.129
  687   3HG2  VAL  85          3HG2      VAL  85  -7.415  -5.466  -5.466
  688    H    LYS  86           H        LYS  86  -9.484  -7.922  -7.922
  689    HA   LYS  86           HA       LYS  86 -12.320  -8.602  -8.602
  690   1HB   LYS  86          2HB       LYS  86 -12.176  -9.439  -9.439
  691   2HB   LYS  86          1HB       LYS  86 -11.806 -10.517 -10.517
  692   1HG   LYS  86          2HG       LYS  86  -9.383  -9.911  -9.911
  693   2HG   LYS  86          1HG       LYS  86  -9.821  -8.972  -8.972
  694   1HD   LYS  86          2HD       LYS  86 -11.037 -11.301 -11.301
  695   2HD   LYS  86          1HD       LYS  86  -9.710 -11.920 -11.920
  696   1HE   LYS  86          2HE       LYS  86  -8.107 -10.627 -10.627
  697   2HE   LYS  86          1HE       LYS  86  -9.450 -10.104 -10.104
  698   1HZ   LYS  86          2HZ       LYS  86  -8.933 -12.967 -12.967
  699   2HZ   LYS  86          1HZ       LYS  86  -8.130 -12.137 -12.137
  700   3HZ   LYS  86          3HZ       LYS  86  -9.822 -12.258 -12.258
  701    H    TRP  87           H        TRP  87 -13.817  -7.581  -7.581
  702    HA   TRP  87           HA       TRP  87 -12.854  -4.884  -4.884
  703   1HB   TRP  87          2HB       TRP  87 -15.521  -6.282  -6.282
  704   2HB   TRP  87          1HB       TRP  87 -15.250  -4.677  -4.677
  705    HD1  TRP  87           HD1      TRP  87 -16.086  -6.462  -6.462
  706    HE1  TRP  87           HE1      TRP  87 -16.134  -4.845  -4.845
  707    HE3  TRP  87           HE3      TRP  87 -13.886  -2.395  -2.395
  708    HZ2  TRP  87           HZ2      TRP  87 -15.335  -2.169  -2.169
  709    HZ3  TRP  87           HZ3      TRP  87 -13.511  -0.331  -0.331
  710    HH2  TRP  87           HH2      TRP  87 -14.233  -0.218  -0.218
  711    H    GLU  88           H        GLU  88 -13.476  -4.008  -4.008
  712    HA   GLU  88           HA       GLU  88 -13.069  -5.987  -5.987
  713   1HB   GLU  88          2HB       GLU  88 -10.969  -4.609  -4.609
  714   2HB   GLU  88          1HB       GLU  88 -11.803  -3.252  -3.252
  715   1HG   GLU  88          2HG       GLU  88 -10.540  -4.100  -4.100
  716   2HG   GLU  88          1HG       GLU  88 -12.117  -4.848  -4.848
  717    H    SER  89           H        SER  89 -13.892  -2.689  -2.689
  718    HA   SER  89           HA       SER  89 -16.101  -2.695  -2.695
  719   1HB   SER  89          2HB       SER  89 -15.603  -0.417  -0.417
  720   2HB   SER  89          1HB       SER  89 -14.082  -1.297  -1.297
  721    HG   SER  89           HG       SER  89 -13.759   0.598   0.598
  722    H    GLU  90           H        GLU  90 -16.919  -0.015  -0.015
  723    HA   GLU  90           HA       GLU  90 -18.304  -0.880  -0.880
  724   1HB   GLU  90          2HB       GLU  90 -18.261   1.918   1.918
  725   2HB   GLU  90          1HB       GLU  90 -19.499   1.202   1.202
  726   1HG   GLU  90          2HG       GLU  90 -19.512  -0.586  -0.586
  727   2HG   GLU  90          1HG       GLU  90 -19.029   0.861   0.861
  728    H    ASN  91           H        ASN  91 -15.449   1.010   1.010
  729    HA   ASN  91           HA       ASN  91 -15.032   1.311   1.311
  730   1HB   ASN  91          2HB       ASN  91 -14.507   3.569   3.569
  731   2HB   ASN  91          1HB       ASN  91 -14.422   3.618   3.618
  732   1HD2  ASN  91          2HD2      ASN  91 -17.831   4.699   4.699
  733   2HD2  ASN  91          1HD2      ASN  91 -16.289   4.847   4.847
  734    H    LYS  92           H        LYS  92 -13.786  -0.391  -0.391
  735    HA   LYS  92           HA       LYS  92 -10.986   0.485   0.485
  736   1HB   LYS  92          2HB       LYS  92 -11.555   1.080   1.080
  737   2HB   LYS  92          1HB       LYS  92 -12.035  -0.588  -0.588
  738   1HG   LYS  92          2HG       LYS  92  -9.691  -1.279  -1.279
  739   2HG   LYS  92          1HG       LYS  92  -9.267   0.433   0.433
  740   1HD   LYS  92          2HD       LYS  92 -10.082   0.559   0.559
  741   2HD   LYS  92          1HD       LYS  92 -10.282  -1.193  -1.193
  742   1HE   LYS  92          2HE       LYS  92  -7.648  -0.148  -0.148
  743   2HE   LYS  92          1HE       LYS  92  -8.001  -0.007  -0.007
  744   1HZ   LYS  92          3HZ       LYS  92  -8.325  -2.525  -2.525
  745   2HZ   LYS  92          2HZ       LYS  92  -6.911  -2.126  -2.126
  746   3HZ   LYS  92          1HZ       LYS  92  -8.381  -2.327  -2.327
  747    H    MET  93           H        MET  93 -10.305  -1.081  -1.081
  748    HA   MET  93           HA       MET  93 -11.047  -3.910  -3.910
  749   1HB   MET  93          2HB       MET  93 -10.315  -4.223  -4.223
  750   2HB   MET  93          1HB       MET  93 -11.928  -3.629  -3.629
  751   1HG   MET  93          2HG       MET  93 -11.443  -1.467  -1.467
  752   2HG   MET  93          1HG       MET  93  -9.722  -1.634  -1.634
  753   1HE   MET  93          1HE       MET  93 -12.302  -3.711  -3.711
  754   2HE   MET  93          3HE       MET  93 -12.593  -2.369  -2.369
  755   3HE   MET  93          2HE       MET  93 -11.867  -3.863  -3.863
  756    H    VAL  94           H        VAL  94  -9.459  -5.485  -5.485
  757    HA   VAL  94           HA       VAL  94  -6.672  -4.476  -4.476
  758    HB   VAL  94           HB       VAL  94  -7.542  -7.270  -7.270
  759   1HG1  VAL  94          3HG1      VAL  94  -5.303  -5.416  -5.416
  760   2HG1  VAL  94          2HG1      VAL  94  -5.779  -6.556  -6.556
  761   3HG1  VAL  94          1HG1      VAL  94  -5.268  -7.147  -7.147
  762   1HG2  VAL  94          3HG2      VAL  94  -8.198  -4.745  -4.745
  763   2HG2  VAL  94          2HG2      VAL  94  -9.116  -6.247  -6.247
  764   3HG2  VAL  94          1HG2      VAL  94  -7.707  -6.146  -6.146
  765    H    CYS  95           H        CYS  95  -4.997  -6.196  -6.196
  766    HA   CYS  95           HA       CYS  95  -5.995  -7.617  -7.617
  767   1HB   CYS  95          2HB       CYS  95  -5.452  -5.337  -5.337
  768   2HB   CYS  95          1HB       CYS  95  -3.832  -5.498  -5.498
  769    HG   CYS  95           HG       CYS  95  -3.193  -7.115  -7.115
  770    H    GLU  96           H        GLU  96  -4.799  -9.375  -9.375
  771    HA   GLU  96           HA       GLU  96  -2.324  -9.893  -9.893
  772   1HB   GLU  96          2HB       GLU  96  -4.014 -11.960 -11.960
  773   2HB   GLU  96          1HB       GLU  96  -2.778 -12.240 -12.240
  774   1HG   GLU  96          2HG       GLU  96  -4.863 -10.459 -10.459
  775   2HG   GLU  96          1HG       GLU  96  -5.539 -11.988 -11.988
  776    H    GLN  97           H        GLN  97  -0.616 -11.147 -11.147
  777    HA   GLN  97           HA       GLN  97  -0.897 -11.011 -11.011
  778   1HB   GLN  97          2HB       GLN  97  -0.207  -8.676  -8.676
  779   2HB   GLN  97          1HB       GLN  97   1.389  -9.403  -9.403
  780   1HG   GLN  97          2HG       GLN  97   0.886  -9.858  -9.858
  781   2HG   GLN  97          1HG       GLN  97  -0.643  -9.013  -9.013
  782   1HE2  GLN  97          2HE2      GLN  97   0.877  -5.919  -5.919
  783   2HE2  GLN  97          1HE2      GLN  97  -0.483  -6.923  -6.923
  784    H    LYS  98           H        LYS  98   0.463 -12.383 -12.383
  785    HA   LYS  98           HA       LYS  98   2.913 -13.346 -13.346
  786   1HB   LYS  98          2HB       LYS  98   2.276 -15.716 -15.716
  787   2HB   LYS  98          1HB       LYS  98   1.197 -14.955 -14.955
  788   1HG   LYS  98          2HG       LYS  98  -0.547 -14.731 -14.731
  789   2HG   LYS  98          1HG       LYS  98   0.538 -14.894 -14.894
  790   1HD   LYS  98          2HD       LYS  98   0.907 -17.253 -17.253
  791   2HD   LYS  98          1HD       LYS  98  -0.090 -17.111 -17.111
  792   1HE   LYS  98          2HE       LYS  98  -2.071 -16.769 -16.769
  793   2HE   LYS  98          1HE       LYS  98  -1.165 -16.435 -16.435
  794   1HZ   LYS  98          1HZ       LYS  98  -0.391 -18.726 -18.726
  795   2HZ   LYS  98          3HZ       LYS  98  -1.275 -19.044 -19.044
  796   3HZ   LYS  98          2HZ       LYS  98  -2.089 -18.661 -18.661
  797    H    LEU  99           H        LEU  99   4.498 -14.086 -14.086
  798    HA   LEU  99           HA       LEU  99   4.393 -12.882 -12.882
  799   1HB   LEU  99          2HB       LEU  99   6.050 -15.191 -15.191
  800   2HB   LEU  99          1HB       LEU  99   6.318 -14.402 -14.402
  801    HG   LEU  99           HG       LEU  99   6.144 -12.639 -12.639
  802   1HD1  LEU  99          2HD1      LEU  99   8.509 -14.431 -14.431
  803   2HD1  LEU  99          1HD1      LEU  99   8.561 -13.065 -13.065
  804   3HD1  LEU  99          3HD1      LEU  99   7.544 -14.460 -14.460
  805   1HD2  LEU  99          1HD2      LEU  99   6.651 -12.195 -12.195
  806   2HD2  LEU  99          3HD2      LEU  99   7.399 -11.226 -11.226
  807   3HD2  LEU  99          2HD2      LEU  99   8.294 -12.553 -12.553
  808    H    LEU 100           H        LEU 100   4.593 -14.085 -14.085
  809    HA   LEU 100           HA       LEU 100   2.576 -16.257 -16.257
  810   1HB   LEU 100          2HB       LEU 100   3.676 -14.309 -14.309
  811   2HB   LEU 100          1HB       LEU 100   2.737 -15.725 -15.725
  812    HG   LEU 100           HG       LEU 100   1.783 -13.627 -13.627
  813   1HD1  LEU 100          3HD1      LEU 100   2.108 -12.967 -12.967
  814   2HD1  LEU 100          2HD1      LEU 100   0.728 -14.025 -14.025
  815   3HD1  LEU 100          1HD1      LEU 100   0.556 -12.623 -12.623
  816   1HD2  LEU 100          2HD2      LEU 100   0.724 -16.200 -16.200
  817   2HD2  LEU 100          1HD2      LEU 100   0.465 -15.442 -15.442
  818   3HD2  LEU 100          3HD2      LEU 100  -0.431 -14.877 -14.877
  819    H    LYS 101           H        LYS 101   5.907 -15.850 -15.850
  820    HA   LYS 101           HA       LYS 101   6.380 -18.567 -18.567
  821   1HB   LYS 101          2HB       LYS 101   6.624 -16.876 -16.876
  822   2HB   LYS 101          1HB       LYS 101   8.095 -16.361 -16.361
  823   1HG   LYS 101          2HG       LYS 101   8.725 -18.059 -18.059
  824   2HG   LYS 101          1HG       LYS 101   8.828 -18.779 -18.779
  825   1HD   LYS 101          2HD       LYS 101   6.835 -20.005 -20.005
  826   2HD   LYS 101          1HD       LYS 101   6.299 -18.991 -18.991
  827   1HE   LYS 101          2HE       LYS 101   8.318 -19.844 -19.844
  828   2HE   LYS 101          1HE       LYS 101   8.535 -21.029 -21.029
  829   1HZ   LYS 101          1HZ       LYS 101   6.125 -21.623 -21.623
  830   2HZ   LYS 101          3HZ       LYS 101   6.242 -20.731 -20.731
  831   3HZ   LYS 101          2HZ       LYS 101   7.233 -22.090 -22.090
  832    H    GLY 102           H        GLY 102   8.112 -19.493 -19.493
  833   1HA   GLY 102          2HA       GLY 102   9.817 -19.677 -19.677
  834   2HA   GLY 102          1HA       GLY 102  10.246 -18.008 -18.008
  835    H    GLU 103           H        GLU 103  10.570 -17.833 -17.833
  836    HA   GLU 103           HA       GLU 103   8.365 -16.520 -16.520
  837   1HB   GLU 103          2HB       GLU 103   7.559 -18.888 -18.888
  838   2HB   GLU 103          1HB       GLU 103   8.986 -19.252 -19.252
  839   1HG   GLU 103          2HG       GLU 103   8.322 -17.691 -17.691
  840   2HG   GLU 103          1HG       GLU 103   7.018 -17.066 -17.066
  841    H    GLY 104           H        GLY 104   9.095 -15.325 -15.325
  842   1HA   GLY 104          2HA       GLY 104  11.516 -16.076 -16.076
  843   2HA   GLY 104          1HA       GLY 104  11.658 -14.612 -14.612
  844    HA   PRO 105           HA       PRO 105   9.624 -12.541 -12.541
  845   1HB   PRO 105          2HB       PRO 105   8.931 -10.215 -10.215
  846   2HB   PRO 105          1HB       PRO 105  10.591 -10.592 -10.592
  847   1HG   PRO 105          2HG       PRO 105   9.413 -10.559 -10.559
  848   2HG   PRO 105          1HG       PRO 105  11.110 -10.423 -10.423
  849   1HD   PRO 105          2HD       PRO 105   9.787 -12.759 -12.759
  850   2HD   PRO 105          1HD       PRO 105  11.450 -12.652 -12.652
  851    H    LYS 106           H        LYS 106   7.436 -11.105 -11.105
  852    HA   LYS 106           HA       LYS 106   5.291 -12.347 -12.347
  853   1HB   LYS 106          2HB       LYS 106   5.414 -13.504 -13.504
  854   2HB   LYS 106          1HB       LYS 106   5.270 -11.949 -11.949
  855   1HG   LYS 106          2HG       LYS 106   3.055 -11.640 -11.640
  856   2HG   LYS 106          1HG       LYS 106   3.208 -12.819 -12.819
  857   1HD   LYS 106          2HD       LYS 106   3.398 -14.636 -14.636
  858   2HD   LYS 106          1HD       LYS 106   3.231 -13.456 -13.456
  859   1HE   LYS 106          2HE       LYS 106   1.165 -14.019 -14.019
  860   2HE   LYS 106          1HE       LYS 106   1.069 -14.541 -14.541
  861   1HZ   LYS 106          1HZ       LYS 106   1.363 -12.055 -12.055
  862   2HZ   LYS 106          3HZ       LYS 106   0.887 -11.815 -11.815
  863   3HZ   LYS 106          2HZ       LYS 106  -0.157 -12.602 -12.602
  864    H    THR 107           H        THR 107   3.625 -10.858 -10.858
  865    HA   THR 107           HA       THR 107   3.990  -8.111  -8.111
  866    HB   THR 107           HB       THR 107   2.819  -7.661  -7.661
  867    HG1  THR 107           HG1      THR 107   3.216  -9.303  -9.303
  868   1HG2  THR 107          1HG2      THR 107   4.826  -6.589  -6.589
  869   2HG2  THR 107          3HG2      THR 107   5.806  -7.845  -7.845
  870   3HG2  THR 107          2HG2      THR 107   4.909  -6.703  -6.703
  871    H    SER 108           H        SER 108   2.198  -6.952  -6.952
  872    HA   SER 108           HA       SER 108  -0.505  -7.763  -7.763
  873   1HB   SER 108          2HB       SER 108  -1.095  -7.951  -7.951
  874   2HB   SER 108          1HB       SER 108  -0.390  -9.356  -9.356
  875    HG   SER 108           HG       SER 108   1.047  -9.187  -9.187
  876    H    TRP 109           H        TRP 109  -1.847  -5.901  -5.901
  877    HA   TRP 109           HA       TRP 109  -0.778  -3.699  -3.699
  878   1HB   TRP 109          2HB       TRP 109  -1.275  -2.051  -2.051
  879   2HB   TRP 109          1HB       TRP 109   0.112  -3.094  -3.094
  880    HD1  TRP 109           HD1      TRP 109  -0.023  -4.824  -4.824
  881    HE1  TRP 109           HE1      TRP 109  -1.697  -5.187  -5.187
  882    HE3  TRP 109           HE3      TRP 109  -3.878  -1.873  -1.873
  883    HZ2  TRP 109           HZ2      TRP 109  -4.319  -4.347  -4.347
  884    HZ3  TRP 109           HZ3      TRP 109  -5.949  -1.677  -1.677
  885    HH2  TRP 109           HH2      TRP 109  -6.177  -2.907  -2.907
  886    H    THR 110           H        THR 110  -2.413  -1.821  -1.821
  887    HA   THR 110           HA       THR 110  -5.203  -2.875  -2.875
  888    HB   THR 110           HB       THR 110  -5.742  -2.076  -2.076
  889    HG1  THR 110           HG1      THR 110  -4.604  -0.592  -0.592
  890   1HG2  THR 110          1HG2      THR 110  -3.884  -4.073  -4.073
  891   2HG2  THR 110          3HG2      THR 110  -3.082  -3.026  -3.026
  892   3HG2  THR 110          2HG2      THR 110  -4.675  -3.693  -3.693
  893    H    MET 111           H        MET 111  -6.800  -1.005  -1.005
  894    HA   MET 111           HA       MET 111  -5.805   1.656   1.656
  895   1HB   MET 111          2HB       MET 111  -6.621  -0.227  -0.227
  896   2HB   MET 111          1HB       MET 111  -7.850   1.031   1.031
  897   1HG   MET 111          2HG       MET 111  -6.105   2.757   2.757
  898   2HG   MET 111          1HG       MET 111  -4.873   1.497   1.497
  899   1HE   MET 111          3HE       MET 111  -3.982   2.427   2.427
  900   2HE   MET 111          2HE       MET 111  -4.002   0.780   0.780
  901   3HE   MET 111          1HE       MET 111  -4.482   2.117   2.117
  902    H    GLU 112           H        GLU 112  -7.041   3.027   3.027
  903    HA   GLU 112           HA       GLU 112  -9.845   2.165   2.165
  904   1HB   GLU 112          2HB       GLU 112  -8.298   2.207   2.207
  905   2HB   GLU 112          1HB       GLU 112  -8.051   3.931   3.931
  906   1HG   GLU 112          2HG       GLU 112 -10.227   4.485   4.485
  907   2HG   GLU 112          1HG       GLU 112 -10.852   2.881   2.881
  908    H    LEU 113           H        LEU 113 -11.442   3.844   3.844
  909    HA   LEU 113           HA       LEU 113 -10.717   6.340   6.340
  910   1HB   LEU 113          2HB       LEU 113 -12.472   4.359   4.359
  911   2HB   LEU 113          1HB       LEU 113 -13.546   5.470   5.470
  912    HG   LEU 113           HG       LEU 113 -13.323   5.865   5.865
  913   1HD1  LEU 113          2HD1      LEU 113 -13.195   7.783   7.783
  914   2HD1  LEU 113          1HD1      LEU 113 -12.364   8.420   8.420
  915   3HD1  LEU 113          3HD1      LEU 113 -14.040   7.891   7.891
  916   1HD2  LEU 113          2HD2      LEU 113 -10.563   5.673   5.673
  917   2HD2  LEU 113          1HD2      LEU 113 -11.308   6.032   6.032
  918   3HD2  LEU 113          3HD2      LEU 113 -10.849   7.346   7.346
  919    H    THR 114           H        THR 114 -11.575   8.292   8.292
  920    HA   THR 114           HA       THR 114 -12.539   7.954   7.954
  921    HB   THR 114           HB       THR 114 -11.913  10.242  10.242
  922    HG1  THR 114           HG1      THR 114 -11.414  11.598  11.598
  923   1HG2  THR 114          1HG2      THR 114 -10.082   8.489   8.489
  924   2HG2  THR 114          3HG2      THR 114  -9.804   9.133   9.133
  925   3HG2  THR 114          2HG2      THR 114  -9.567  10.164  10.164
  926    H    ASN 115           H        ASN 115 -14.320   9.372   9.372
  927    HA   ASN 115           HA       ASN 115 -16.658   9.093   9.093
  928   1HB   ASN 115          2HB       ASN 115 -16.038  10.791  10.791
  929   2HB   ASN 115          1HB       ASN 115 -17.639  10.754  10.754
  930   1HD2  ASN 115          2HD2      ASN 115 -18.448   7.881   7.881
  931   2HD2  ASN 115          1HD2      ASN 115 -18.924   9.401   9.401
  932    H    ASP 116           H        ASP 116 -14.230  11.591  11.591
  933    HA   ASP 116           HA       ASP 116 -15.948  13.575  13.575
  934   1HB   ASP 116          2HB       ASP 116 -13.006  13.486  13.486
  935   2HB   ASP 116          1HB       ASP 116 -13.717  14.810  14.810
  936    H    GLY 117           H        GLY 117 -13.637  11.095  11.095
  937   1HA   GLY 117          2HA       GLY 117 -14.074  10.268  10.268
  938   2HA   GLY 117          1HA       GLY 117 -13.879  11.951  11.951
  939    H    GLU 118           H        GLU 118 -11.697  11.853  11.853
  940    HA   GLU 118           HA       GLU 118  -9.395  11.838  11.838
  941   1HB   GLU 118          2HB       GLU 118  -9.644  11.134  11.134
  942   2HB   GLU 118          1HB       GLU 118  -8.127  11.497  11.497
  943   1HG   GLU 118          2HG       GLU 118  -9.172  13.718  13.718
  944   2HG   GLU 118          1HG       GLU 118 -10.476  13.351  13.351
  945    H    LEU 119           H        LEU 119  -7.549  10.141  10.141
  946    HA   LEU 119           HA       LEU 119  -8.610   7.379   7.379
  947   1HB   LEU 119          2HB       LEU 119  -8.975   8.139   8.139
  948   2HB   LEU 119          1HB       LEU 119  -7.239   8.385   8.385
  949    HG   LEU 119           HG       LEU 119  -8.385   5.717   5.717
  950   1HD1  LEU 119          1HD1      LEU 119  -8.260   7.017   7.017
  951   2HD1  LEU 119          3HD1      LEU 119  -7.922   5.290   5.290
  952   3HD1  LEU 119          2HD1      LEU 119  -9.477   5.923   5.923
  953   1HD2  LEU 119          1HD2      LEU 119  -5.770   6.798   6.798
  954   2HD2  LEU 119          3HD2      LEU 119  -6.069   5.632   5.632
  955   3HD2  LEU 119          2HD2      LEU 119  -6.205   5.135   5.135
  956    H    ILE 120           H        ILE 120  -7.172   6.458   6.458
  957    HA   ILE 120           HA       ILE 120  -4.302   7.228   7.228
  958    HB   ILE 120           HB       ILE 120  -5.223   7.360   7.360
  959   1HG1  ILE 120          2HG1      ILE 120  -3.542   4.850   4.850
  960   2HG1  ILE 120          1HG1      ILE 120  -2.862   6.431   6.431
  961   1HG2  ILE 120          3HG2      ILE 120  -6.022   4.497   4.497
  962   2HG2  ILE 120          2HG2      ILE 120  -5.924   5.145   5.145
  963   3HG2  ILE 120          1HG2      ILE 120  -7.059   5.840   5.840
  964   1HD1  ILE 120          1HD1      ILE 120  -4.113   7.075   7.075
  965   2HD1  ILE 120          3HD1      ILE 120  -3.819   5.367   5.367
  966   3HD1  ILE 120          2HD1      ILE 120  -2.467   6.444   6.444
  967    H    LEU 121           H        LEU 121  -2.702   5.497   5.497
  968    HA   LEU 121           HA       LEU 121  -3.779   2.889   2.889
  969   1HB   LEU 121          2HB       LEU 121  -3.345   4.087   4.087
  970   2HB   LEU 121          1HB       LEU 121  -1.883   4.807   4.807
  971    HG   LEU 121           HG       LEU 121  -1.652   2.944   2.944
  972   1HD1  LEU 121          1HD1      LEU 121   0.057   3.871   3.871
  973   2HD1  LEU 121          3HD1      LEU 121  -0.043   2.204   2.204
  974   3HD1  LEU 121          2HD1      LEU 121   0.471   2.544   2.544
  975   1HD2  LEU 121          1HD2      LEU 121  -2.540   1.332   1.332
  976   2HD2  LEU 121          3HD2      LEU 121  -3.006   1.183   1.183
  977   3HD2  LEU 121          2HD2      LEU 121  -1.409   0.659   0.659
  978    H    THR 122           H        THR 122  -2.925   1.471   1.471
  979    HA   THR 122           HA       THR 122  -0.194   2.027   2.027
  980    HB   THR 122           HB       THR 122  -1.450  -0.276  -0.276
  981    HG1  THR 122           HG1      THR 122  -2.912   2.151   2.151
  982   1HG2  THR 122          3HG2      THR 122   0.303   1.591   1.591
  983   2HG2  THR 122          2HG2      THR 122  -1.159   2.342   2.342
  984   3HG2  THR 122          1HG2      THR 122  -0.693   0.725   0.725
  985    H    MET 123           H        MET 123   1.147  -0.049  -0.049
  986    HA   MET 123           HA       MET 123   0.590  -2.054  -2.054
  987   1HB   MET 123          2HB       MET 123   3.158  -0.458  -0.458
  988   2HB   MET 123          1HB       MET 123   2.868  -1.795  -1.795
  989   1HG   MET 123          2HG       MET 123   0.749  -0.312  -0.312
  990   2HG   MET 123          1HG       MET 123   1.783   0.986   0.986
  991   1HE   MET 123          2HE       MET 123   0.503  -0.733  -0.733
  992   2HE   MET 123          1HE       MET 123   1.672  -0.878  -0.878
  993   3HE   MET 123          3HE       MET 123   1.634  -2.085  -2.085
  994    H    THR 124           H        THR 124   2.270  -3.825  -3.825
  995    HA   THR 124           HA       THR 124   3.660  -4.109  -4.109
  996    HB   THR 124           HB       THR 124   1.792  -6.312  -6.312
  997    HG1  THR 124           HG1      THR 124   0.170  -5.204  -5.204
  998   1HG2  THR 124          1HG2      THR 124   3.641  -6.714  -6.714
  999   2HG2  THR 124          3HG2      THR 124   2.985  -5.446  -5.446
 1000   3HG2  THR 124          2HG2      THR 124   2.054  -6.915  -6.915
 1001    H    ALA 125           H        ALA 125   5.250  -5.731  -5.731
 1002    HA   ALA 125           HA       ALA 125   5.534  -7.370  -7.370
 1003   1HB   ALA 125          3HB       ALA 125   6.584  -4.892  -4.892
 1004   2HB   ALA 125          2HB       ALA 125   7.937  -5.717  -5.717
 1005   3HB   ALA 125          1HB       ALA 125   7.312  -6.302  -6.302
 1006    H    ASP 126           H        ASP 126   5.509  -9.122  -9.122
 1007    HA   ASP 126           HA       ASP 126   6.589 -10.820 -10.820
 1008   1HB   ASP 126          2HB       ASP 126   8.765  -9.262  -9.262
 1009   2HB   ASP 126          1HB       ASP 126   9.009  -9.456  -9.456
 1010    H    ASP 127           H        ASP 127   8.002  -7.982  -7.982
 1011    HA   ASP 127           HA       ASP 127   6.003  -8.213  -8.213
 1012   1HB   ASP 127          2HB       ASP 127   7.792  -8.264  -8.264
 1013   2HB   ASP 127          1HB       ASP 127   7.772  -9.724  -9.724
 1014    H    VAL 128           H        VAL 128   6.924  -6.294  -6.294
 1015    HA   VAL 128           HA       VAL 128   7.464  -3.955  -3.955
 1016    HB   VAL 128           HB       VAL 128   8.542  -2.879  -2.879
 1017   1HG1  VAL 128          2HG1      VAL 128   9.698  -4.726  -4.726
 1018   2HG1  VAL 128          1HG1      VAL 128   9.717  -5.640  -5.640
 1019   3HG1  VAL 128          3HG1      VAL 128  10.534  -4.080  -4.080
 1020   1HG2  VAL 128          3HG2      VAL 128   7.291  -5.151  -5.151
 1021   2HG2  VAL 128          2HG2      VAL 128   7.663  -3.527  -3.527
 1022   3HG2  VAL 128          1HG2      VAL 128   8.929  -4.754  -4.754
 1023    H    VAL 129           H        VAL 129   6.648  -1.900  -1.900
 1024    HA   VAL 129           HA       VAL 129   4.206  -2.432  -2.432
 1025    HB   VAL 129           HB       VAL 129   4.193  -1.581  -1.581
 1026   1HG1  VAL 129          3HG1      VAL 129   2.431  -0.437  -0.437
 1027   2HG1  VAL 129          2HG1      VAL 129   1.687  -0.864  -0.864
 1028   3HG1  VAL 129          1HG1      VAL 129   3.003   0.309   0.309
 1029   1HG2  VAL 129          1HG2      VAL 129   2.691  -3.449  -3.449
 1030   2HG2  VAL 129          3HG2      VAL 129   3.468  -3.769  -3.769
 1031   3HG2  VAL 129          2HG2      VAL 129   1.936  -2.898  -2.898
 1032    H    CYS 130           H        CYS 130   4.255  -0.986  -0.986
 1033    HA   CYS 130           HA       CYS 130   5.663   1.596   1.596
 1034   1HB   CYS 130          2HB       CYS 130   5.991  -0.058  -0.058
 1035   2HB   CYS 130          1HB       CYS 130   4.561   0.763   0.763
 1036    HG   CYS 130           HG       CYS 130   5.915   3.054   3.054
 1037    H    THR 131           H        THR 131   4.293   3.176   3.176
 1038    HA   THR 131           HA       THR 131   1.476   3.141   3.141
 1039    HB   THR 131           HB       THR 131   2.699   4.776   4.776
 1040    HG1  THR 131           HG1      THR 131   2.558   3.011   3.011
 1041   1HG2  THR 131          1HG2      THR 131   0.572   5.611   5.611
 1042   2HG2  THR 131          3HG2      THR 131  -0.196   4.107   4.107
 1043   3HG2  THR 131          2HG2      THR 131   0.424   5.231   5.231
 1044    H    ARG 132           H        ARG 132   0.568   4.950   4.950
 1045    HA   ARG 132           HA       ARG 132   2.158   7.357   7.357
 1046   1HB   ARG 132          2HB       ARG 132   1.046   5.695   5.695
 1047   2HB   ARG 132          1HB       ARG 132   1.985   7.180   7.180
 1048   1HG   ARG 132          2HG       ARG 132   3.891   6.006   6.006
 1049   2HG   ARG 132          1HG       ARG 132   2.949   4.516   4.516
 1050   1HD   ARG 132          2HD       ARG 132   3.437   6.118   6.118
 1051   2HD   ARG 132          1HD       ARG 132   4.641   4.967   4.967
 1052    HE   ARG 132           HE       ARG 132   2.300   3.498   3.498
 1053   1HH1  ARG 132          1HH2      ARG 132   4.784   3.812   3.812
 1054   2HH1  ARG 132          2HH2      ARG 132   3.903   3.650   3.650
 1055   1HH2  ARG 132          2HH1      ARG 132   0.797   3.998   3.998
 1056   2HH2  ARG 132          1HH1      ARG 132   1.646   3.756   3.756
 1057    H    VAL 133           H        VAL 133   0.530   8.590   8.590
 1058    HA   VAL 133           HA       VAL 133  -2.289   8.169   8.169
 1059    HB   VAL 133           HB       VAL 133  -0.855  10.696  10.696
 1060   1HG1  VAL 133          3HG1      VAL 133  -3.431  10.559  10.559
 1061   2HG1  VAL 133          2HG1      VAL 133  -3.617  10.021  10.021
 1062   3HG1  VAL 133          1HG1      VAL 133  -2.904  11.597  11.597
 1063   1HG2  VAL 133          1HG2      VAL 133  -0.468   8.574   8.574
 1064   2HG2  VAL 133          3HG2      VAL 133  -1.138   9.947   9.947
 1065   3HG2  VAL 133          2HG2      VAL 133  -2.191   8.625   8.625
 1066    H    TYR 134           H        TYR 134  -3.510   8.770   8.770
 1067    HA   TYR 134           HA       TYR 134  -2.212  10.558  10.558
 1068   1HB   TYR 134          2HB       TYR 134  -3.996   8.163   8.163
 1069   2HB   TYR 134          1HB       TYR 134  -3.930   9.383   9.383
 1070    HD1  TYR 134           HD2      TYR 134  -1.828   9.844   9.844
 1071    HD2  TYR 134           HD1      TYR 134  -2.132   6.716   6.716
 1072    HE1  TYR 134           HE2      TYR 134   0.258   8.832   8.832
 1073    HE2  TYR 134           HE1      TYR 134  -0.066   5.662   5.662
 1074    HH   TYR 134           HH       TYR 134   1.937   6.351   6.351
 1075    H    VAL 135           H        VAL 135  -3.201  12.457  12.457
 1076    HA   VAL 135           HA       VAL 135  -6.074  12.669  12.669
 1077    HB   VAL 135           HB       VAL 135  -3.876  14.274  14.274
 1078   1HG1  VAL 135          3HG1      VAL 135  -4.055  15.366  15.366
 1079   2HG1  VAL 135          2HG1      VAL 135  -5.678  15.891  15.891
 1080   3HG1  VAL 135          1HG1      VAL 135  -4.281  16.472  16.472
 1081   1HG2  VAL 135          1HG2      VAL 135  -6.862  14.501  14.501
 1082   2HG2  VAL 135          3HG2      VAL 135  -5.699  14.144  14.144
 1083   3HG2  VAL 135          2HG2      VAL 135  -5.845  15.787  15.787
 1084    H    ARG 136           H        ARG 136  -7.550  13.312  13.312
 1085    HA   ARG 136           HA       ARG 136  -7.021  12.723  12.723
 1086   1HB   ARG 136          2HB       ARG 136  -9.157  13.987  13.987
 1087   2HB   ARG 136          1HB       ARG 136  -8.892  14.833  14.833
 1088   1HG   ARG 136          2HG       ARG 136  -9.377  12.983  12.983
 1089   2HG   ARG 136          1HG       ARG 136  -8.912  11.846  11.846
 1090   1HD   ARG 136          2HD       ARG 136 -11.432  13.530  13.530
 1091   2HD   ARG 136          1HD       ARG 136 -11.325  11.773  11.773
 1092    HE   ARG 136           HE       ARG 136 -10.139  12.424  12.424
 1093   1HH1  ARG 136          1HH2      ARG 136 -12.952  11.156  11.156
 1094   2HH1  ARG 136          2HH2      ARG 136 -13.970  11.931  11.931
 1095   1HH2  ARG 136          2HH1      ARG 136 -11.537  14.187  14.187
 1096   2HH2  ARG 136          1HH1      ARG 136 -13.168  13.649  13.649
 1097    H    GLU 137           HN       GLU 137  -5.872  13.571  13.571
 1098    HA   GLU 137           HA       GLU 137  -4.323  14.971  14.971
 1099   1HB   GLU 137          2HB       GLU 137  -6.734  15.718  15.718
 1100   2HB   GLU 137          1HB       GLU 137  -6.360  17.112  17.112
 1101   1HG   GLU 137          2HG       GLU 137  -4.211  17.321  17.321
 1102   2HG   GLU 137          1HG       GLU 137  -5.021  16.239  16.239

  Start of MODEL    8
    1   1H    PRO   1          1H        PRO   1  16.052   8.532   8.532
    2   2H    PRO   1          2H        PRO   1  15.454   7.734   7.734
    3    HA   PRO   1           HA       PRO   1  15.184   5.857   5.857
    4   1HB   PRO   1          2HB       PRO   1  17.714   5.492   5.492
    5   2HB   PRO   1          1HB       PRO   1  17.105   4.681   4.681
    6   1HG   PRO   1          2HG       PRO   1  19.140   6.692   6.692
    7   2HG   PRO   1          1HG       PRO   1  18.537   5.867   5.867
    8   1HD   PRO   1          1HD       PRO   1  18.079   8.578   8.578
    9   2HD   PRO   1          2HD       PRO   1  17.460   7.741   7.741
   10    H    ASN   2           H        ASN   2  16.149   4.918   4.918
   11    HA   ASN   2           HA       ASN   2  15.794   5.121   5.121
   12   1HB   ASN   2          2HB       ASN   2  16.683   7.830   7.830
   13   2HB   ASN   2          1HB       ASN   2  15.837   7.736   7.736
   14   1HD2  ASN   2          2HD2      ASN   2  19.150   5.314   5.314
   15   2HD2  ASN   2          1HD2      ASN   2  18.031   5.324   5.324
   16    H    PHE   3           H        PHE   3  13.874   4.833   4.833
   17    HA   PHE   3           HA       PHE   3  11.510   6.344   6.344
   18   1HB   PHE   3          2HB       PHE   3  11.802   3.863   3.863
   19   2HB   PHE   3          1HB       PHE   3  10.267   4.595   4.595
   20    HD1  PHE   3           HD1      PHE   3  13.401   3.612   3.612
   21    HD2  PHE   3           HD2      PHE   3   9.113   3.470   3.470
   22    HE1  PHE   3           HE1      PHE   3  13.335   2.286   2.286
   23    HE2  PHE   3           HE2      PHE   3   9.055   2.130   2.130
   24    HZ   PHE   3           HZ       PHE   3  11.168   1.532   1.532
   25    H    SER   4           H        SER   4  13.776   6.669   6.669
   26    HA   SER   4           HA       SER   4  12.115   7.053   7.053
   27   1HB   SER   4          2HB       SER   4  14.712   6.647   6.647
   28   2HB   SER   4          1HB       SER   4  14.768   8.407   8.407
   29    HG   SER   4           HG       SER   4  14.769   8.046   8.046
   30    H    GLY   5           H        GLY   5  10.742   8.673   8.673
   31   1HA   GLY   5          2HA       GLY   5  11.262  11.367  11.367
   32   2HA   GLY   5          1HA       GLY   5  10.830  11.147  11.147
   33    H    ASN   6           H        ASN   6   9.003  12.638  12.638
   34    HA   ASN   6           HA       ASN   6   6.854  11.060  11.060
   35   1HB   ASN   6          2HB       ASN   6   7.337  13.989  13.989
   36   2HB   ASN   6          1HB       ASN   6   5.684  13.420  13.420
   37   1HD2  ASN   6          2HD2      ASN   6   6.559  12.210  12.210
   38   2HD2  ASN   6          1HD2      ASN   6   5.878  11.548  11.548
   39    H    TRP   7           H        TRP   7   4.628  11.347  11.347
   40    HA   TRP   7           HA       TRP   7   4.942  11.678  11.678
   41   1HB   TRP   7          2HB       TRP   7   4.130   9.087   9.087
   42   2HB   TRP   7          1HB       TRP   7   3.961   9.411   9.411
   43    HD1  TRP   7           HD1      TRP   7   6.455   8.388   8.388
   44    HE1  TRP   7           HE1      TRP   7   8.810   8.202   8.202
   45    HE3  TRP   7           HE3      TRP   7   5.517  10.579  10.579
   46    HZ2  TRP   7           HZ2      TRP   7  10.111   8.937   8.937
   47    HZ3  TRP   7           HZ3      TRP   7   7.327  10.875  10.875
   48    HH2  TRP   7           HH2      TRP   7   9.599  10.044  10.044
   49    H    LYS   8           H        LYS   8   3.269  12.762  12.762
   50    HA   LYS   8           HA       LYS   8   0.611  12.434  12.434
   51   1HB   LYS   8          2HB       LYS   8   1.778  14.880  14.880
   52   2HB   LYS   8          1HB       LYS   8   0.124  14.757  14.757
   53   1HG   LYS   8          2HG       LYS   8   1.089  14.226  14.226
   54   2HG   LYS   8          1HG       LYS   8   2.676  14.637  14.637
   55   1HD   LYS   8          2HD       LYS   8   2.139  16.891  16.891
   56   2HD   LYS   8          1HD       LYS   8   0.406  16.572  16.572
   57   1HE   LYS   8          2HE       LYS   8   0.793  17.550  17.550
   58   2HE   LYS   8          1HE       LYS   8   0.559  15.825  15.825
   59   1HZ   LYS   8          3HZ       LYS   8   3.091  15.701  15.701
   60   2HZ   LYS   8          2HZ       LYS   8   3.066  17.380  17.380
   61   3HZ   LYS   8          1HZ       LYS   8   2.453  16.325  16.325
   62    H    ILE   9           H        ILE   9  -0.631  11.235  11.235
   63    HA   ILE   9           HA       ILE   9  -0.113  10.617  10.617
   64    HB   ILE   9           HB       ILE   9  -1.580   9.290   9.290
   65   1HG1  ILE   9          2HG1      ILE   9  -3.076  10.504  10.504
   66   2HG1  ILE   9          1HG1      ILE   9  -1.932   9.166   9.166
   67   1HG2  ILE   9          2HG2      ILE   9  -3.323  11.767  11.767
   68   2HG2  ILE   9          1HG2      ILE   9  -3.912  10.189  10.189
   69   3HG2  ILE   9          3HG2      ILE   9  -2.614  10.983  10.983
   70   1HD1  ILE   9          3HD1      ILE   9  -3.524   8.080   8.080
   71   2HD1  ILE   9          2HD1      ILE   9  -4.705   9.213   9.213
   72   3HD1  ILE   9          1HD1      ILE   9  -3.954   8.013   8.013
   73    H    ILE  10           H        ILE  10  -0.893  11.404  11.404
   74    HA   ILE  10           HA       ILE  10  -2.348  14.007  14.007
   75    HB   ILE  10           HB       ILE  10  -1.003  14.747  14.747
   76   1HG1  ILE  10          2HG1      ILE  10   1.211  13.147  13.147
   77   2HG1  ILE  10          1HG1      ILE  10  -0.045  11.944  11.944
   78   1HG2  ILE  10          1HG2      ILE  10  -0.301  15.059  15.059
   79   2HG2  ILE  10          3HG2      ILE  10   0.877  13.781  13.781
   80   3HG2  ILE  10          2HG2      ILE  10   0.952  15.282  15.282
   81   1HD1  ILE  10          2HD1      ILE  10  -1.290  13.419  13.419
   82   2HD1  ILE  10          1HD1      ILE  10   0.383  13.709  13.709
   83   3HD1  ILE  10          3HD1      ILE  10  -0.239  12.061  12.061
   84    H    ARG  11           H        ARG  11  -1.980  10.867  10.867
   85    HA   ARG  11           HA       ARG  11  -4.444  11.414  11.414
   86   1HB   ARG  11          2HB       ARG  11  -1.760  10.771  10.771
   87   2HB   ARG  11          1HB       ARG  11  -3.088   9.835   9.835
   88   1HG   ARG  11          2HG       ARG  11  -4.204  12.302  12.302
   89   2HG   ARG  11          1HG       ARG  11  -2.506  12.738  12.738
   90   1HD   ARG  11          2HD       ARG  11  -2.318  11.665  11.665
   91   2HD   ARG  11          1HD       ARG  11  -3.577  10.490  10.490
   92    HE   ARG  11           HE       ARG  11  -4.238  13.346  13.346
   93   1HH1  ARG  11          1HH2      ARG  11  -5.866  10.645  10.645
   94   2HH1  ARG  11          2HH2      ARG  11  -6.733  10.468  10.468
   95   1HH2  ARG  11          2HH1      ARG  11  -4.838  12.828  12.828
   96   2HH2  ARG  11          1HH1      ARG  11  -6.151  11.704  11.704
   97    H    SER  12           H        SER  12  -5.170   9.228   9.228
   98    HA   SER  12           HA       SER  12  -4.511   6.673   6.673
   99   1HB   SER  12          2HB       SER  12  -4.930   7.241   7.241
  100   2HB   SER  12          1HB       SER  12  -6.379   8.150   8.150
  101    HG   SER  12           HG       SER  12  -6.540   5.861   5.861
  102    H    GLU  13           H        GLU  13  -6.531   5.144   5.144
  103    HA   GLU  13           HA       GLU  13  -8.818   6.377   6.377
  104   1HB   GLU  13          2HB       GLU  13  -8.361   5.460   5.460
  105   2HB   GLU  13          1HB       GLU  13  -7.054   6.532   6.532
  106   1HG   GLU  13          2HG       GLU  13  -6.342   3.964   3.964
  107   2HG   GLU  13          1HG       GLU  13  -6.939   3.721   3.721
  108    H    ASN  14           H        ASN  14  -8.329   4.333   4.333
  109    HA   ASN  14           HA       ASN  14 -10.312   2.404   2.404
  110   1HB   ASN  14          2HB       ASN  14  -8.147   0.742   0.742
  111   2HB   ASN  14          1HB       ASN  14  -9.010   0.646   0.646
  112   1HD2  ASN  14          2HD2      ASN  14  -6.054   1.537   1.537
  113   2HD2  ASN  14          1HD2      ASN  14  -7.402   0.525   0.525
  114    H    PHE  15           H        PHE  15  -9.973   4.349   4.349
  115    HA   PHE  15           HA       PHE  15  -9.312   3.091   3.091
  116   1HB   PHE  15          2HB       PHE  15  -9.611   5.601   5.601
  117   2HB   PHE  15          1HB       PHE  15 -11.330   5.308   5.308
  118    HD1  PHE  15           HD2      PHE  15 -10.350   3.039   3.039
  119    HD2  PHE  15           HD1      PHE  15 -10.017   7.274   7.274
  120    HE1  PHE  15           HE2      PHE  15 -10.151   3.364   3.364
  121    HE2  PHE  15           HE1      PHE  15  -9.806   7.589   7.589
  122    HZ   PHE  15           HZ       PHE  15  -9.874   5.621   5.621
  123    H    GLU  16           H        GLU  16 -12.565   3.983   3.983
  124    HA   GLU  16           HA       GLU  16 -13.994   2.527   2.527
  125   1HB   GLU  16          2HB       GLU  16 -14.625   3.671   3.671
  126   2HB   GLU  16          1HB       GLU  16 -15.770   2.518   2.518
  127   1HG   GLU  16          2HG       GLU  16 -15.365   4.031   4.031
  128   2HG   GLU  16          1HG       GLU  16 -15.029   5.246   5.246
  129    H    GLU  17           H        GLU  17 -12.491   1.382   1.382
  130    HA   GLU  17           HA       GLU  17 -14.074  -1.045  -1.045
  131   1HB   GLU  17          2HB       GLU  17 -12.538  -1.874  -1.874
  132   2HB   GLU  17          1HB       GLU  17 -12.966  -0.201  -0.201
  133   1HG   GLU  17          2HG       GLU  17 -10.844   0.527   0.527
  134   2HG   GLU  17          1HG       GLU  17 -10.578  -0.494  -0.494
  135    H    LEU  18           H        LEU  18 -11.145  -0.108  -0.108
  136    HA   LEU  18           HA       LEU  18 -10.468  -2.856  -2.856
  137   1HB   LEU  18          2HB       LEU  18  -8.922  -0.667  -0.667
  138   2HB   LEU  18          1HB       LEU  18  -9.263  -0.544  -0.544
  139    HG   LEU  18           HG       LEU  18  -8.526  -2.913  -2.913
  140   1HD1  LEU  18          2HD1      LEU  18  -8.268  -2.633  -2.633
  141   2HD1  LEU  18          1HD1      LEU  18  -7.011  -3.555  -3.555
  142   3HD1  LEU  18          3HD1      LEU  18  -8.698  -4.046  -4.046
  143   1HD2  LEU  18          1HD2      LEU  18  -7.001  -0.676  -0.676
  144   2HD2  LEU  18          3HD2      LEU  18  -6.339  -2.269  -2.269
  145   3HD2  LEU  18          2HD2      LEU  18  -6.226  -1.622  -1.622
  146    H    LEU  19           H        LEU  19 -12.497  -0.343  -0.343
  147    HA   LEU  19           HA       LEU  19 -12.391  -1.488  -1.488
  148   1HB   LEU  19          2HB       LEU  19 -14.298   0.671   0.671
  149   2HB   LEU  19          1HB       LEU  19 -13.731   0.353   0.353
  150    HG   LEU  19           HG       LEU  19 -12.211   1.606   1.606
  151   1HD1  LEU  19          3HD1      LEU  19 -13.641   2.650   2.650
  152   2HD1  LEU  19          2HD1      LEU  19 -11.947   2.811   2.811
  153   3HD1  LEU  19          1HD1      LEU  19 -12.514   3.506   3.506
  154   1HD2  LEU  19          2HD2      LEU  19 -10.765  -0.142  -0.142
  155   2HD2  LEU  19          1HD2      LEU  19 -10.159   1.499   1.499
  156   3HD2  LEU  19          3HD2      LEU  19 -10.999   0.718   0.718
  157    H    LYS  20           H        LYS  20 -14.160  -1.877  -1.877
  158    HA   LYS  20           HA       LYS  20 -16.548  -3.000  -3.000
  159   1HB   LYS  20          2HB       LYS  20 -15.823  -3.224  -3.224
  160   2HB   LYS  20          1HB       LYS  20 -17.422  -3.344  -3.344
  161   1HG   LYS  20          2HG       LYS  20 -16.193  -0.798  -0.798
  162   2HG   LYS  20          1HG       LYS  20 -16.212  -1.040  -1.040
  163   1HD   LYS  20          2HD       LYS  20 -18.624  -1.382  -1.382
  164   2HD   LYS  20          1HD       LYS  20 -18.281   0.069   0.069
  165   1HE   LYS  20          2HE       LYS  20 -18.338  -2.602  -2.602
  166   2HE   LYS  20          1HE       LYS  20 -19.854  -1.778  -1.778
  167   1HZ   LYS  20          1HZ       LYS  20 -17.642  -0.350  -0.350
  168   2HZ   LYS  20          3HZ       LYS  20 -18.710  -1.311  -1.311
  169   3HZ   LYS  20          2HZ       LYS  20 -19.303   0.009   0.009
  170    H    VAL  21           H        VAL  21 -13.581  -4.005  -4.005
  171    HA   VAL  21           HA       VAL  21 -14.226  -6.833  -6.833
  172    HB   VAL  21           HB       VAL  21 -12.543  -5.718  -5.718
  173   1HG1  VAL  21          1HG1      VAL  21 -11.623  -4.201  -4.201
  174   2HG1  VAL  21          3HG1      VAL  21 -10.825  -5.584  -5.584
  175   3HG1  VAL  21          2HG1      VAL  21 -10.381  -5.071  -5.071
  176   1HG2  VAL  21          3HG2      VAL  21 -11.731  -7.995  -7.995
  177   2HG2  VAL  21          2HG2      VAL  21 -12.294  -8.066  -8.066
  178   3HG2  VAL  21          1HG2      VAL  21 -10.679  -7.455  -7.455
  179    H    LEU  22           H        LEU  22 -12.475  -4.671  -4.671
  180    HA   LEU  22           HA       LEU  22 -11.510  -6.620  -6.620
  181   1HB   LEU  22          2HB       LEU  22 -11.773  -3.680  -3.680
  182   2HB   LEU  22          1HB       LEU  22 -11.794  -4.284  -4.284
  183    HG   LEU  22           HG       LEU  22  -9.642  -5.346  -5.346
  184   1HD1  LEU  22          1HD1      LEU  22 -10.031  -6.039  -6.039
  185   2HD1  LEU  22          3HD1      LEU  22  -9.699  -4.378  -4.378
  186   3HD1  LEU  22          2HD1      LEU  22  -8.440  -5.339  -5.339
  187   1HD2  LEU  22          1HD2      LEU  22  -9.777  -2.856  -2.856
  188   2HD2  LEU  22          3HD2      LEU  22  -8.273  -3.381  -3.381
  189   3HD2  LEU  22          2HD2      LEU  22  -9.532  -2.619  -2.619
  190    H    GLY  23           H        GLY  23 -14.281  -4.434  -4.434
  191   1HA   GLY  23          2HA       GLY  23 -15.462  -5.888  -5.888
  192   2HA   GLY  23          1HA       GLY  23 -15.954  -4.288  -4.288
  193    H    VAL  24           H        VAL  24 -18.134  -4.897  -4.897
  194    HA   VAL  24           HA       VAL  24 -18.881  -6.217  -6.217
  195    HB   VAL  24           HB       VAL  24 -20.483  -7.764  -7.764
  196   1HG1  VAL  24          2HG1      VAL  24 -18.099  -8.361  -8.361
  197   2HG1  VAL  24          1HG1      VAL  24 -17.654  -8.301  -8.301
  198   3HG1  VAL  24          3HG1      VAL  24 -18.865  -9.457  -9.457
  199   1HG2  VAL  24          2HG2      VAL  24 -18.940  -6.765  -6.765
  200   2HG2  VAL  24          1HG2      VAL  24 -20.683  -6.704  -6.704
  201   3HG2  VAL  24          3HG2      VAL  24 -19.886  -8.253  -8.253
  202    H    ASN  25           H        ASN  25 -19.992  -4.791  -4.791
  203    HA   ASN  25           HA       ASN  25 -22.619  -4.062  -4.062
  204   1HB   ASN  25          2HB       ASN  25 -21.240  -3.833  -3.833
  205   2HB   ASN  25          1HB       ASN  25 -20.988  -2.199  -2.199
  206   1HD2  ASN  25          2HD2      ASN  25 -24.202  -1.140  -1.140
  207   2HD2  ASN  25          1HD2      ASN  25 -22.635  -0.726  -0.726
  208    H    VAL  26           H        VAL  26 -23.035  -1.414  -1.414
  209    HA   VAL  26           HA       VAL  26 -21.502  -0.473  -0.473
  210    HB   VAL  26           HB       VAL  26 -23.546   1.146   1.146
  211   1HG1  VAL  26          1HG1      VAL  26 -23.186  -1.669  -1.669
  212   2HG1  VAL  26          3HG1      VAL  26 -24.841  -1.071  -1.071
  213   3HG1  VAL  26          2HG1      VAL  26 -23.539  -0.246  -0.246
  214   1HG2  VAL  26          2HG2      VAL  26 -24.556   0.558   0.558
  215   2HG2  VAL  26          1HG2      VAL  26 -25.650   0.191   0.191
  216   3HG2  VAL  26          3HG2      VAL  26 -24.754  -1.107  -1.107
  217    H    MET  27           H        MET  27 -22.909   0.650   0.650
  218    HA   MET  27           HA       MET  27 -21.758   3.295   3.295
  219   1HB   MET  27          2HB       MET  27 -23.666   2.402   2.402
  220   2HB   MET  27          1HB       MET  27 -22.348   1.891   1.891
  221   1HG   MET  27          2HG       MET  27 -21.543   4.130   4.130
  222   2HG   MET  27          1HG       MET  27 -22.575   4.711   4.711
  223   1HE   MET  27          1HE       MET  27 -22.289   6.044   6.044
  224   2HE   MET  27          3HE       MET  27 -23.457   6.677   6.677
  225   3HE   MET  27          2HE       MET  27 -23.938   6.407   6.407
  226    H    LEU  28           H        LEU  28 -20.577   0.169   0.169
  227    HA   LEU  28           HA       LEU  28 -18.401   0.866   0.866
  228   1HB   LEU  28          2HB       LEU  28 -19.241  -1.411  -1.411
  229   2HB   LEU  28          1HB       LEU  28 -17.503  -1.307  -1.307
  230    HG   LEU  28           HG       LEU  28 -18.546  -2.672  -2.672
  231   1HD1  LEU  28          1HD1      LEU  28 -16.660  -0.812  -0.812
  232   2HD1  LEU  28          3HD1      LEU  28 -17.897  -0.158  -0.158
  233   3HD1  LEU  28          2HD1      LEU  28 -17.289  -1.795  -1.795
  234   1HD2  LEU  28          2HD2      LEU  28 -20.223  -0.187  -0.187
  235   2HD2  LEU  28          1HD2      LEU  28 -20.762  -1.851  -1.851
  236   3HD2  LEU  28          3HD2      LEU  28 -20.020  -1.364  -1.364
  237    H    ARG  29           H        ARG  29 -18.680   0.876   0.876
  238    HA   ARG  29           HA       ARG  29 -15.845   1.333   1.333
  239   1HB   ARG  29          2HB       ARG  29 -18.117   1.934   1.934
  240   2HB   ARG  29          1HB       ARG  29 -16.433   1.619   1.619
  241   1HG   ARG  29          2HG       ARG  29 -16.944  -0.565  -0.565
  242   2HG   ARG  29          1HG       ARG  29 -17.276  -0.614  -0.614
  243   1HD   ARG  29          2HD       ARG  29 -19.193  -1.400  -1.400
  244   2HD   ARG  29          1HD       ARG  29 -19.601  -0.063  -0.063
  245    HE   ARG  29           HE       ARG  29 -18.814   1.134   1.134
  246   1HH1  ARG  29          2HH1      ARG  29 -20.479  -1.711  -1.711
  247   2HH1  ARG  29          1HH1      ARG  29 -21.935  -1.056  -1.056
  248   1HH2  ARG  29          1HH2      ARG  29 -20.995   2.244   2.244
  249   2HH2  ARG  29          2HH2      ARG  29 -22.228   1.183   1.183
  250    H    LYS  30           H        LYS  30 -18.744   3.409   3.409
  251    HA   LYS  30           HA       LYS  30 -17.393   5.802   5.802
  252   1HB   LYS  30          2HB       LYS  30 -19.906   5.365   5.365
  253   2HB   LYS  30          1HB       LYS  30 -19.874   5.680   5.680
  254   1HG   LYS  30          2HG       LYS  30 -19.470   7.921   7.921
  255   2HG   LYS  30          1HG       LYS  30 -18.507   7.676   7.676
  256   1HD   LYS  30          2HD       LYS  30 -21.395   6.994   6.994
  257   2HD   LYS  30          1HD       LYS  30 -20.999   8.707   8.707
  258   1HE   LYS  30          2HE       LYS  30 -20.753   8.546   8.546
  259   2HE   LYS  30          1HE       LYS  30 -19.154   7.937   7.937
  260   1HZ   LYS  30          1HZ       LYS  30 -21.567   6.265   6.265
  261   2HZ   LYS  30          3HZ       LYS  30 -20.296   6.472   6.472
  262   3HZ   LYS  30          2HZ       LYS  30 -20.013   5.692   5.692
  263    H    ILE  31           H        ILE  31 -17.651   4.191   4.191
  264    HA   ILE  31           HA       ILE  31 -16.902   6.570   6.570
  265    HB   ILE  31           HB       ILE  31 -16.853   3.641   3.641
  266   1HG1  ILE  31          2HG1      ILE  31 -18.909   5.654   5.654
  267   2HG1  ILE  31          1HG1      ILE  31 -19.076   4.877   4.877
  268   1HG2  ILE  31          2HG2      ILE  31 -16.526   6.234   6.234
  269   2HG2  ILE  31          1HG2      ILE  31 -17.033   4.748   4.748
  270   3HG2  ILE  31          3HG2      ILE  31 -15.464   4.827   4.827
  271   1HD1  ILE  31          1HD1      ILE  31 -18.713   3.375   3.375
  272   2HD1  ILE  31          3HD1      ILE  31 -20.273   3.655   3.655
  273   3HD1  ILE  31          2HD1      ILE  31 -19.050   2.673   2.673
  274    H    ALA  32           H        ALA  32 -15.253   3.939   3.939
  275    HA   ALA  32           HA       ALA  32 -12.677   4.512   4.512
  276   1HB   ALA  32          2HB       ALA  32 -13.544   2.673   2.673
  277   2HB   ALA  32          1HB       ALA  32 -11.852   2.866   2.866
  278   3HB   ALA  32          3HB       ALA  32 -13.016   2.231   2.231
  279    H    VAL  33           H        VAL  33 -14.431   5.462   5.462
  280    HA   VAL  33           HA       VAL  33 -12.158   6.554   6.554
  281    HB   VAL  33           HB       VAL  33 -15.073   7.281   7.281
  282   1HG1  VAL  33          3HG1      VAL  33 -13.236   8.533   8.533
  283   2HG1  VAL  33          2HG1      VAL  33 -12.822   7.018   7.018
  284   3HG1  VAL  33          1HG1      VAL  33 -14.407   7.746   7.746
  285   1HG2  VAL  33          1HG2      VAL  33 -14.064   4.661   4.661
  286   2HG2  VAL  33          3HG2      VAL  33 -15.569   5.222   5.222
  287   3HG2  VAL  33          2HG2      VAL  33 -14.098   5.172   5.172
  288    H    ALA  34           H        ALA  34 -14.716   7.728   7.728
  289    HA   ALA  34           HA       ALA  34 -13.905  10.510  10.510
  290   1HB   ALA  34          2HB       ALA  34 -15.738   8.971   8.971
  291   2HB   ALA  34          1HB       ALA  34 -15.421  10.693  10.693
  292   3HB   ALA  34          3HB       ALA  34 -16.193  10.111  10.111
  293    H    ALA  35           H        ALA  35 -13.266   7.758   7.758
  294    HA   ALA  35           HA       ALA  35 -11.924   9.126   9.126
  295   1HB   ALA  35          1HB       ALA  35 -11.890   6.308   6.308
  296   2HB   ALA  35          3HB       ALA  35 -10.750   6.792   6.792
  297   3HB   ALA  35          2HB       ALA  35 -12.485   6.897   6.897
  298    H    ALA  36           H        ALA  36 -10.794   7.740   7.740
  299    HA   ALA  36           HA       ALA  36  -8.012   8.181   8.181
  300   1HB   ALA  36          1HB       ALA  36  -9.793   7.552   7.552
  301   2HB   ALA  36          3HB       ALA  36  -8.371   8.481   8.481
  302   3HB   ALA  36          2HB       ALA  36  -8.180   6.936   6.936
  303    H    SER  37           H        SER  37 -10.122  10.066  10.066
  304    HA   SER  37           HA       SER  37  -9.996  12.326  12.326
  305   1HB   SER  37          2HB       SER  37  -9.726  12.290  12.290
  306   2HB   SER  37          1HB       SER  37  -9.403  13.811  13.811
  307    HG   SER  37           HG       SER  37 -11.543  13.866  13.866
  308    H    LYS  38           H        LYS  38  -7.773  11.054  11.054
  309    HA   LYS  38           HA       LYS  38  -5.547  11.404  11.404
  310   1HB   LYS  38          2HB       LYS  38  -5.849  14.148  14.148
  311   2HB   LYS  38          1HB       LYS  38  -4.635  13.659  13.659
  312   1HG   LYS  38          2HG       LYS  38  -7.445  13.213  13.213
  313   2HG   LYS  38          1HG       LYS  38  -6.966  14.902  14.902
  314   1HD   LYS  38          2HD       LYS  38  -5.282  14.714  14.714
  315   2HD   LYS  38          1HD       LYS  38  -5.211  12.957  12.957
  316   1HE   LYS  38          2HE       LYS  38  -6.992  12.635  12.635
  317   2HE   LYS  38          1HE       LYS  38  -7.831  14.079  14.079
  318   1HZ   LYS  38          2HZ       LYS  38  -5.941  15.317  15.317
  319   2HZ   LYS  38          1HZ       LYS  38  -5.697  13.852  13.852
  320   3HZ   LYS  38          3HZ       LYS  38  -7.191  14.647  14.647
  321    HA   PRO  39           HA       PRO  39  -4.536  10.457  10.457
  322   1HB   PRO  39          2HB       PRO  39  -3.627   7.904   7.904
  323   2HB   PRO  39          1HB       PRO  39  -5.295   8.305   8.305
  324   1HG   PRO  39          2HG       PRO  39  -4.162   7.571   7.571
  325   2HG   PRO  39          1HG       PRO  39  -5.806   7.345   7.345
  326   1HD   PRO  39          2HD       PRO  39  -5.018   9.358   9.358
  327   2HD   PRO  39          1HD       PRO  39  -6.513   9.358   9.358
  328    H    ALA  40           H        ALA  40  -2.404  10.314  10.314
  329    HA   ALA  40           HA       ALA  40  -0.236  10.912  10.912
  330   1HB   ALA  40          3HB       ALA  40  -0.863  12.492  12.492
  331   2HB   ALA  40          2HB       ALA  40  -0.069  11.299  11.299
  332   3HB   ALA  40          1HB       ALA  40   0.844  12.118  12.118
  333    H    VAL  41           H        VAL  41   1.994  10.163  10.163
  334    HA   VAL  41           HA       VAL  41   1.939   7.625   7.625
  335    HB   VAL  41           HB       VAL  41   2.619   7.841   7.841
  336   1HG1  VAL  41          2HG1      VAL  41   3.290   5.622   5.622
  337   2HG1  VAL  41          1HG1      VAL  41   3.354   5.447   5.447
  338   3HG1  VAL  41          3HG1      VAL  41   4.430   6.583   6.583
  339   1HG2  VAL  41          3HG2      VAL  41   0.721   6.139   6.139
  340   2HG2  VAL  41          2HG2      VAL  41   0.301   7.351   7.351
  341   3HG2  VAL  41          1HG2      VAL  41   1.076   5.845   5.845
  342    H    GLU  42           H        GLU  42   4.215   6.861   6.861
  343    HA   GLU  42           HA       GLU  42   6.315   8.892   8.892
  344   1HB   GLU  42          2HB       GLU  42   5.596   9.679   9.679
  345   2HB   GLU  42          1HB       GLU  42   5.317   8.060   8.060
  346   1HG   GLU  42          2HG       GLU  42   7.347   9.092   9.092
  347   2HG   GLU  42          1HG       GLU  42   7.746   7.651   7.651
  348    H    ILE  43           H        ILE  43   7.790   7.634   7.634
  349    HA   ILE  43           HA       ILE  43   8.103   4.809   4.809
  350    HB   ILE  43           HB       ILE  43   8.965   6.319   6.319
  351   1HG1  ILE  43          2HG1      ILE  43   7.369   3.865   3.865
  352   2HG1  ILE  43          1HG1      ILE  43   6.562   5.088   5.088
  353   1HG2  ILE  43          1HG2      ILE  43   9.788   3.630   3.630
  354   2HG2  ILE  43          3HG2      ILE  43   9.482   3.805   3.805
  355   3HG2  ILE  43          2HG2      ILE  43  10.709   4.800   4.800
  356   1HD1  ILE  43          3HD1      ILE  43   7.781   6.282   6.282
  357   2HD1  ILE  43          2HD1      ILE  43   6.666   4.989   4.989
  358   3HD1  ILE  43          1HD1      ILE  43   6.103   6.336   6.336
  359    H    LYS  44           H        LYS  44   9.871   4.107   4.107
  360    HA   LYS  44           HA       LYS  44  12.174   5.989   5.989
  361   1HB   LYS  44          2HB       LYS  44  12.141   3.785   3.785
  362   2HB   LYS  44          1HB       LYS  44  12.270   5.513   5.513
  363   1HG   LYS  44          2HG       LYS  44   9.867   5.769   5.769
  364   2HG   LYS  44          1HG       LYS  44   9.635   4.137   4.137
  365   1HD   LYS  44          2HD       LYS  44  10.105   3.154   3.154
  366   2HD   LYS  44          1HD       LYS  44  11.175   4.463   4.463
  367   1HE   LYS  44          2HE       LYS  44   8.918   5.870   5.870
  368   2HE   LYS  44          1HE       LYS  44   8.195   4.282   4.282
  369   1HZ   LYS  44          1HZ       LYS  44  10.459   5.151   5.151
  370   2HZ   LYS  44          3HZ       LYS  44   8.895   5.702   5.702
  371   3HZ   LYS  44          2HZ       LYS  44   9.227   4.036   4.036
  372    H    GLN  45           H        GLN  45  13.850   5.308   5.308
  373    HA   GLN  45           HA       GLN  45  13.969   2.424   2.424
  374   1HB   GLN  45          2HB       GLN  45  14.019   4.024   4.024
  375   2HB   GLN  45          1HB       GLN  45  15.458   4.786   4.786
  376   1HG   GLN  45          2HG       GLN  45  16.720   2.703   2.703
  377   2HG   GLN  45          1HG       GLN  45  15.284   1.875   1.875
  378   1HE2  GLN  45          2HE2      GLN  45  16.372   2.686   2.686
  379   2HE2  GLN  45          1HE2      GLN  45  15.991   1.458   1.458
  380    H    GLU  46           H        GLU  46  15.303   1.140   1.140
  381    HA   GLU  46           HA       GLU  46  17.843   2.295   2.295
  382   1HB   GLU  46          2HB       GLU  46  15.833   0.431   0.431
  383   2HB   GLU  46          1HB       GLU  46  17.531   0.090   0.090
  384   1HG   GLU  46          2HG       GLU  46  17.619   2.684   2.684
  385   2HG   GLU  46          1HG       GLU  46  15.888   2.469   2.469
  386    H    GLY  47           H        GLY  47  17.931   1.530   1.530
  387   1HA   GLY  47          2HA       GLY  47  19.464   0.203   0.203
  388   2HA   GLY  47          1HA       GLY  47  19.558  -0.943  -0.943
  389    H    ASP  48           H        ASP  48  18.686  -2.877  -2.877
  390    HA   ASP  48           HA       ASP  48  16.664  -3.064  -3.064
  391   1HB   ASP  48          2HB       ASP  48  16.597  -5.510  -5.510
  392   2HB   ASP  48          1HB       ASP  48  18.114  -4.946  -4.946
  393    H    THR  49           H        THR  49  16.405  -2.134  -2.134
  394    HA   THR  49           HA       THR  49  13.878  -3.573  -3.573
  395    HB   THR  49           HB       THR  49  15.664  -1.791  -1.791
  396    HG1  THR  49           HG1      THR  49  15.773  -3.715  -3.715
  397   1HG2  THR  49          2HG2      THR  49  12.845  -2.690  -2.690
  398   2HG2  THR  49          1HG2      THR  49  13.973  -2.543  -2.543
  399   3HG2  THR  49          3HG2      THR  49  13.600  -1.136  -1.136
  400    H    PHE  50           H        PHE  50  11.913  -2.528  -2.528
  401    HA   PHE  50           HA       PHE  50  11.913   0.394   0.394
  402   1HB   PHE  50          2HB       PHE  50  10.398  -1.700  -1.700
  403   2HB   PHE  50          1HB       PHE  50  10.139   0.042   0.042
  404    HD1  PHE  50           HD2      PHE  50  12.084   1.526   1.526
  405    HD2  PHE  50           HD1      PHE  50  12.226  -2.749  -2.749
  406    HE1  PHE  50           HE2      PHE  50  14.048   1.697   1.697
  407    HE2  PHE  50           HE1      PHE  50  14.195  -2.581  -2.581
  408    HZ   PHE  50           HZ       PHE  50  15.116  -0.361  -0.361
  409    H    TYR  51           H        TYR  51  10.779   1.242   1.242
  410    HA   TYR  51           HA       TYR  51   8.539  -0.272  -0.272
  411   1HB   TYR  51          2HB       TYR  51  10.373   0.586   0.586
  412   2HB   TYR  51          1HB       TYR  51   9.995   2.221   2.221
  413    HD1  TYR  51           HD1      TYR  51   7.520   2.967   2.967
  414    HD2  TYR  51           HD2      TYR  51   9.276  -0.309  -0.309
  415    HE1  TYR  51           HE1      TYR  51   5.763   3.139   3.139
  416    HE2  TYR  51           HE2      TYR  51   7.520  -0.127  -0.127
  417    HH   TYR  51           HH       TYR  51   5.976   1.680   1.680
  418    H    ILE  52           H        ILE  52   6.439   0.771   0.771
  419    HA   ILE  52           HA       ILE  52   6.244   3.323   3.323
  420    HB   ILE  52           HB       ILE  52   4.293   1.163   1.163
  421   1HG1  ILE  52          2HG1      ILE  52   7.139   1.356   1.356
  422   2HG1  ILE  52          1HG1      ILE  52   6.429  -0.010  -0.010
  423   1HG2  ILE  52          1HG2      ILE  52   4.512   3.727   3.727
  424   2HG2  ILE  52          3HG2      ILE  52   5.606   3.023   3.023
  425   3HG2  ILE  52          2HG2      ILE  52   3.927   2.488   2.488
  426   1HD1  ILE  52          3HD1      ILE  52   4.695   0.410   0.410
  427   2HD1  ILE  52          2HD1      ILE  52   6.296   0.677   0.677
  428   3HD1  ILE  52          1HD1      ILE  52   5.924  -0.850  -0.850
  429    H    LYS  53           H        LYS  53   5.301   4.594   4.594
  430    HA   LYS  53           HA       LYS  53   3.013   3.508   3.508
  431   1HB   LYS  53          2HB       LYS  53   4.859   4.721   4.721
  432   2HB   LYS  53          1HB       LYS  53   4.453   6.168   6.168
  433   1HG   LYS  53          2HG       LYS  53   2.122   4.909   4.909
  434   2HG   LYS  53          1HG       LYS  53   3.345   5.442   5.442
  435   1HD   LYS  53          2HD       LYS  53   2.221   7.185   7.185
  436   2HD   LYS  53          1HD       LYS  53   1.651   7.212   7.212
  437   1HE   LYS  53          2HE       LYS  53   4.172   7.574   7.574
  438   2HE   LYS  53          1HE       LYS  53   4.319   8.068   8.068
  439   1HZ   LYS  53          2HZ       LYS  53   2.321   9.548   9.548
  440   2HZ   LYS  53          1HZ       LYS  53   2.696   9.287   9.287
  441   3HZ   LYS  53          3HZ       LYS  53   3.832  10.024  10.024
  442    H    THR  54           H        THR  54   1.079   3.835   3.835
  443    HA   THR  54           HA       THR  54   0.737   6.297   6.297
  444    HB   THR  54           HB       THR  54  -1.152   3.936   3.936
  445    HG1  THR  54           HG1      THR  54   0.648   3.087   3.087
  446   1HG2  THR  54          1HG2      THR  54  -1.431   6.468   6.468
  447   2HG2  THR  54          3HG2      THR  54  -1.109   5.361   5.361
  448   3HG2  THR  54          2HG2      THR  54  -2.465   5.062   5.062
  449    H    SER  55           H        SER  55  -0.827   7.839   7.839
  450    HA   SER  55           HA       SER  55  -2.379   7.241   7.241
  451   1HB   SER  55          2HB       SER  55  -1.564  10.011  10.011
  452   2HB   SER  55          1HB       SER  55  -1.290   8.769   8.769
  453    HG   SER  55           HG       SER  55   0.306   9.537   9.537
  454    H    THR  56           H        THR  56  -4.460   7.584   7.584
  455    HA   THR  56           HA       THR  56  -5.275   9.433   9.433
  456    HB   THR  56           HB       THR  56  -7.590   8.273   8.273
  457    HG1  THR  56           HG1      THR  56  -5.632   6.287   6.287
  458   1HG2  THR  56          3HG2      THR  56  -5.469   7.048   7.048
  459   2HG2  THR  56          2HG2      THR  56  -7.177   6.600   6.600
  460   3HG2  THR  56          1HG2      THR  56  -6.688   8.227   8.227
  461    H    THR  57           H        THR  57  -7.774  10.183  10.183
  462    HA   THR  57           HA       THR  57  -7.381  12.391  12.391
  463    HB   THR  57           HB       THR  57  -9.365  12.132  12.132
  464    HG1  THR  57           HG1      THR  57 -10.408  13.306  13.306
  465   1HG2  THR  57          1HG2      THR  57  -9.573   9.653   9.653
  466   2HG2  THR  57          3HG2      THR  57 -10.280  10.023  10.023
  467   3HG2  THR  57          2HG2      THR  57 -11.098  10.532  10.532
  468    H    VAL  58           H        VAL  58  -8.483   9.131   9.131
  469    HA   VAL  58           HA       VAL  58  -7.854   9.898   9.898
  470    HB   VAL  58           HB       VAL  58 -10.201   8.216   8.216
  471   1HG1  VAL  58          2HG1      VAL  58  -9.169   9.280   9.280
  472   2HG1  VAL  58          1HG1      VAL  58 -10.865   8.841   8.841
  473   3HG1  VAL  58          3HG1      VAL  58  -9.608   7.623   7.623
  474   1HG2  VAL  58          3HG2      VAL  58  -9.856  11.134  11.134
  475   2HG2  VAL  58          2HG2      VAL  58 -11.129  10.210  10.210
  476   3HG2  VAL  58          1HG2      VAL  58 -11.215  10.516  10.516
  477    H    ARG  59           H        ARG  59  -7.279   7.632   7.632
  478    HA   ARG  59           HA       ARG  59  -6.644   5.515   5.515
  479   1HB   ARG  59          2HB       ARG  59  -8.077   5.133   5.133
  480   2HB   ARG  59          1HB       ARG  59  -6.487   5.011   5.011
  481   1HG   ARG  59          2HG       ARG  59  -5.943   3.080   3.080
  482   2HG   ARG  59          1HG       ARG  59  -6.879   3.517   3.517
  483   1HD   ARG  59          2HD       ARG  59  -7.980   1.653   1.653
  484   2HD   ARG  59          1HD       ARG  59  -8.977   3.097   3.097
  485    HE   ARG  59           HE       ARG  59  -7.142   2.196   2.196
  486   1HH1  ARG  59          1HH2      ARG  59  -8.045   4.189   4.189
  487   2HH1  ARG  59          2HH2      ARG  59  -9.709   3.943   3.943
  488   1HH2  ARG  59          2HH1      ARG  59 -10.214   1.484   1.484
  489   2HH2  ARG  59          1HH1      ARG  59 -10.937   2.412   2.412
  490    H    THR  60           H        THR  60  -4.632   4.149   4.149
  491    HA   THR  60           HA       THR  60  -2.508   5.643   5.643
  492    HB   THR  60           HB       THR  60  -2.224   5.071   5.071
  493    HG1  THR  60           HG1      THR  60  -2.582   7.582   7.582
  494   1HG2  THR  60          2HG2      THR  60  -0.172   5.119   5.119
  495   2HG2  THR  60          1HG2      THR  60  -0.562   6.797   6.797
  496   3HG2  THR  60          3HG2      THR  60  -0.174   6.336   6.336
  497    H    THR  61           H        THR  61  -2.167   3.729   3.729
  498    HA   THR  61           HA       THR  61  -1.766   1.163   1.163
  499    HB   THR  61           HB       THR  61  -0.979   0.674   0.674
  500    HG1  THR  61           HG1      THR  61  -3.035   2.606   2.606
  501   1HG2  THR  61          1HG2      THR  61  -3.740   0.740   0.740
  502   2HG2  THR  61          3HG2      THR  61  -3.422   0.037   0.037
  503   3HG2  THR  61          2HG2      THR  61  -2.653  -0.641  -0.641
  504    H    GLU  62           H        GLU  62   0.290  -0.111  -0.111
  505    HA   GLU  62           HA       GLU  62   2.699   1.463   1.463
  506   1HB   GLU  62          2HB       GLU  62   1.941   0.638   0.638
  507   2HB   GLU  62          1HB       GLU  62   3.640   0.610   0.610
  508   1HG   GLU  62          2HG       GLU  62   3.669   2.817   2.817
  509   2HG   GLU  62          1HG       GLU  62   2.756   3.057   3.057
  510    H    ILE  63           H        ILE  63   4.009   0.073   0.073
  511    HA   ILE  63           HA       ILE  63   3.889  -2.841  -2.841
  512    HB   ILE  63           HB       ILE  63   4.384  -3.307  -3.307
  513   1HG1  ILE  63          2HG1      ILE  63   3.753  -0.366  -0.366
  514   2HG1  ILE  63          1HG1      ILE  63   5.383  -1.039  -1.039
  515   1HG2  ILE  63          3HG2      ILE  63   2.007  -3.004  -3.004
  516   2HG2  ILE  63          2HG2      ILE  63   1.917  -1.606  -1.606
  517   3HG2  ILE  63          1HG2      ILE  63   2.149  -3.219  -3.219
  518   1HD1  ILE  63          2HD1      ILE  63   3.371  -2.427  -2.427
  519   2HD1  ILE  63          1HD1      ILE  63   3.796  -0.794  -0.794
  520   3HD1  ILE  63          3HD1      ILE  63   5.051  -2.023  -2.023
  521    H    ASN  64           H        ASN  64   6.015  -3.980  -3.980
  522    HA   ASN  64           HA       ASN  64   8.363  -2.289  -2.289
  523   1HB   ASN  64          2HB       ASN  64   9.465  -2.964  -2.964
  524   2HB   ASN  64          1HB       ASN  64   8.084  -1.898  -1.898
  525   1HD2  ASN  64          2HD2      ASN  64   5.990  -4.476  -4.476
  526   2HD2  ASN  64          1HD2      ASN  64   5.928  -3.105  -3.105
  527    H    PHE  65           H        PHE  65   9.828  -3.553  -3.553
  528    HA   PHE  65           HA       PHE  65  10.214  -6.380  -6.380
  529   1HB   PHE  65          2HB       PHE  65   9.449  -7.307  -7.307
  530   2HB   PHE  65          1HB       PHE  65   8.125  -6.435  -6.435
  531    HD1  PHE  65           HD2      PHE  65   7.432  -4.187  -4.187
  532    HD2  PHE  65           HD1      PHE  65  10.477  -6.519  -6.519
  533    HE1  PHE  65           HE2      PHE  65   7.278  -2.726  -2.726
  534    HE2  PHE  65           HE1      PHE  65  10.329  -5.062  -5.062
  535    HZ   PHE  65           HZ       PHE  65   8.730  -3.160  -3.160
  536    H    LYS  66           H        LYS  66  11.434  -7.399  -7.399
  537    HA   LYS  66           HA       LYS  66  13.478  -5.449  -5.449
  538   1HB   LYS  66          2HB       LYS  66  15.174  -7.363  -7.363
  539   2HB   LYS  66          1HB       LYS  66  14.676  -6.546  -6.546
  540   1HG   LYS  66          2HG       LYS  66  12.866  -8.401  -8.401
  541   2HG   LYS  66          1HG       LYS  66  13.852  -9.258  -9.258
  542   1HD   LYS  66          2HD       LYS  66  15.225  -9.942  -9.942
  543   2HD   LYS  66          1HD       LYS  66  15.635  -8.263  -8.263
  544   1HE   LYS  66          2HE       LYS  66  13.962  -8.049  -8.049
  545   2HE   LYS  66          1HE       LYS  66  13.093  -9.473  -9.473
  546   1HZ   LYS  66          1HZ       LYS  66  15.086 -10.790 -10.790
  547   2HZ   LYS  66          3HZ       LYS  66  15.702  -9.396  -9.396
  548   3HZ   LYS  66          2HZ       LYS  66  14.248 -10.081 -10.081
  549    H    VAL  67           H        VAL  67  14.462  -6.133  -6.133
  550    HA   VAL  67           HA       VAL  67  12.480  -7.575  -7.575
  551    HB   VAL  67           HB       VAL  67  15.029  -6.883  -6.883
  552   1HG1  VAL  67          2HG1      VAL  67  12.115  -6.190  -6.190
  553   2HG1  VAL  67          1HG1      VAL  67  13.435  -5.884  -5.884
  554   3HG1  VAL  67          3HG1      VAL  67  12.990  -7.541  -7.541
  555   1HG2  VAL  67          3HG2      VAL  67  13.443  -4.826  -4.826
  556   2HG2  VAL  67          2HG2      VAL  67  15.186  -4.930  -4.930
  557   3HG2  VAL  67          1HG2      VAL  67  14.143  -4.406  -4.406
  558    H    GLY  68           H        GLY  68  12.615  -9.760  -9.760
  559   1HA   GLY  68          2HA       GLY  68  14.185 -11.548 -11.548
  560   2HA   GLY  68          1HA       GLY  68  15.229 -11.103 -11.103
  561    H    GLU  69           H        GLU  69  12.728 -10.725 -10.725
  562    HA   GLU  69           HA       GLU  69  12.016 -13.617 -13.617
  563   1HB   GLU  69          2HB       GLU  69  12.265 -13.444 -13.444
  564   2HB   GLU  69          1HB       GLU  69  13.782 -13.032 -13.032
  565   1HG   GLU  69          2HG       GLU  69  13.773 -11.086 -11.086
  566   2HG   GLU  69          1HG       GLU  69  12.360 -10.602 -10.602
  567    H    GLU  70           H        GLU  70  10.031 -13.952 -13.952
  568    HA   GLU  70           HA       GLU  70   8.012 -11.935 -11.935
  569   1HB   GLU  70          2HB       GLU  70   6.434 -13.661 -13.661
  570   2HB   GLU  70          1HB       GLU  70   7.464 -14.270 -14.270
  571   1HG   GLU  70          2HG       GLU  70   8.628 -14.573 -14.573
  572   2HG   GLU  70          1HG       GLU  70   7.130 -15.474 -15.474
  573    H    PHE  71           H        PHE  71   6.331 -11.447 -11.447
  574    HA   PHE  71           HA       PHE  71   7.239 -11.491 -11.491
  575   1HB   PHE  71          2HB       PHE  71   7.263  -8.989  -8.989
  576   2HB   PHE  71          1HB       PHE  71   8.580  -9.622  -9.622
  577    HD1  PHE  71           HD2      PHE  71   8.281  -9.670  -9.670
  578    HD2  PHE  71           HD1      PHE  71   5.693  -7.469  -7.469
  579    HE1  PHE  71           HE2      PHE  71   7.486  -8.311  -8.311
  580    HE2  PHE  71           HE1      PHE  71   4.899  -6.110  -6.110
  581    HZ   PHE  71           HZ       PHE  71   5.792  -6.527  -6.527
  582    H    GLU  72           H        GLU  72   5.658 -10.064 -10.064
  583    HA   GLU  72           HA       GLU  72   2.943 -10.449 -10.449
  584   1HB   GLU  72          2HB       GLU  72   3.403  -9.762  -9.762
  585   2HB   GLU  72          1HB       GLU  72   2.065 -10.634 -10.634
  586   1HG   GLU  72          2HG       GLU  72   3.605 -12.526 -12.526
  587   2HG   GLU  72          1HG       GLU  72   4.893 -11.673 -11.673
  588    H    GLU  73           H        GLU  73   1.535  -8.693  -8.693
  589    HA   GLU  73           HA       GLU  73   2.229  -6.077  -6.077
  590   1HB   GLU  73          2HB       GLU  73   2.323  -4.969  -4.969
  591   2HB   GLU  73          1HB       GLU  73   3.696  -6.032  -6.032
  592   1HG   GLU  73          2HG       GLU  73   3.039  -7.567  -7.567
  593   2HG   GLU  73          1HG       GLU  73   1.323  -7.280  -7.280
  594    H    GLN  74           H        GLN  74   0.637  -4.423  -4.423
  595    HA   GLN  74           HA       GLN  74  -2.049  -5.731  -5.731
  596   1HB   GLN  74          2HB       GLN  74  -1.073  -2.886  -2.886
  597   2HB   GLN  74          1HB       GLN  74  -2.778  -3.222  -3.222
  598   1HG   GLN  74          2HG       GLN  74  -2.689  -4.817  -4.817
  599   2HG   GLN  74          1HG       GLN  74  -1.102  -4.139  -4.139
  600   1HE2  GLN  74          2HE2      GLN  74  -4.443  -2.033  -2.033
  601   2HE2  GLN  74          1HE2      GLN  74  -4.536  -3.569  -3.569
  602    H    THR  75           H        THR  75  -3.687  -5.167  -5.167
  603    HA   THR  75           HA       THR  75  -2.460  -4.907  -4.907
  604    HB   THR  75           HB       THR  75  -4.058  -6.785  -6.785
  605    HG1  THR  75           HG1      THR  75  -5.234  -6.498  -6.498
  606   1HG2  THR  75          3HG2      THR  75  -5.692  -4.606  -4.606
  607   2HG2  THR  75          2HG2      THR  75  -6.494  -5.391  -5.391
  608   3HG2  THR  75          1HG2      THR  75  -6.050  -6.330  -6.330
  609    H    VAL  76           H        VAL  76  -5.278  -3.859  -3.859
  610    HA   VAL  76           HA       VAL  76  -4.705  -1.027  -1.027
  611    HB   VAL  76           HB       VAL  76  -6.104  -2.086  -2.086
  612   1HG1  VAL  76          2HG1      VAL  76  -5.158   0.641   0.641
  613   2HG1  VAL  76          1HG1      VAL  76  -5.477   0.269   0.269
  614   3HG1  VAL  76          3HG1      VAL  76  -6.778   0.164   0.164
  615   1HG2  VAL  76          2HG2      VAL  76  -3.225  -1.434  -1.434
  616   2HG2  VAL  76          1HG2      VAL  76  -3.891  -2.816  -2.816
  617   3HG2  VAL  76          3HG2      VAL  76  -3.867  -1.224  -1.224
  618    H    ASP  77           H        ASP  77  -7.118  -3.514  -3.514
  619    HA   ASP  77           HA       ASP  77  -9.309  -1.579  -1.579
  620   1HB   ASP  77          2HB       ASP  77  -9.285  -4.064  -4.064
  621   2HB   ASP  77          1HB       ASP  77  -9.767  -4.447  -4.447
  622    H    GLY  78           H        GLY  78  -7.396  -3.880  -3.880
  623   1HA   GLY  78          2HA       GLY  78  -6.987  -2.937  -2.937
  624   2HA   GLY  78          1HA       GLY  78  -8.747  -2.961  -2.961
  625    H    ARG  79           H        ARG  79  -6.519  -5.323  -5.323
  626    HA   ARG  79           HA       ARG  79  -7.431  -7.332  -7.332
  627   1HB   ARG  79          2HB       ARG  79  -7.579  -7.381  -7.381
  628   2HB   ARG  79          1HB       ARG  79  -7.196  -8.884  -8.884
  629   1HG   ARG  79          2HG       ARG  79  -9.349  -7.675  -7.675
  630   2HG   ARG  79          1HG       ARG  79  -9.751  -7.593  -7.593
  631   1HD   ARG  79          2HD       ARG  79  -8.645 -10.167 -10.167
  632   2HD   ARG  79          1HD       ARG  79 -10.309  -9.760  -9.760
  633    HE   ARG  79           HE       ARG  79  -9.345  -9.909  -9.909
  634   1HH1  ARG  79          1HH2      ARG  79 -11.566  -9.308  -9.308
  635   2HH1  ARG  79          2HH2      ARG  79 -12.825 -10.402 -10.402
  636   1HH2  ARG  79          2HH1      ARG  79 -11.018 -11.783 -11.783
  637   2HH2  ARG  79          1HH1      ARG  79 -12.515 -11.803 -11.803
  638    HA   PRO  80           HA       PRO  80  -3.078  -8.179  -8.179
  639   1HB   PRO  80          2HB       PRO  80  -3.134 -10.710 -10.710
  640   2HB   PRO  80          1HB       PRO  80  -3.423  -9.235  -9.235
  641   1HG   PRO  80          2HG       PRO  80  -5.378 -11.284 -11.284
  642   2HG   PRO  80          1HG       PRO  80  -5.476 -10.187 -10.187
  643   1HD   PRO  80          2HD       PRO  80  -6.807  -9.857  -9.857
  644   2HD   PRO  80          1HD       PRO  80  -6.642  -8.628  -8.628
  645    H    CYS  81           H        CYS  81  -1.558  -9.119  -9.119
  646    HA   CYS  81           HA       CYS  81  -2.069 -11.597 -11.597
  647   1HB   CYS  81          2HB       CYS  81  -1.812 -10.525 -10.525
  648   2HB   CYS  81          1HB       CYS  81  -3.329 -10.124 -10.124
  649    HG   CYS  81           HG       CYS  81  -0.925  -8.167  -8.167
  650    H    LYS  82           H        LYS  82  -0.141 -12.482 -12.482
  651    HA   LYS  82           HA       LYS  82   2.330 -11.110 -11.110
  652   1HB   LYS  82          2HB       LYS  82   2.020 -13.491 -13.491
  653   2HB   LYS  82          1HB       LYS  82   1.856 -13.879 -13.879
  654   1HG   LYS  82          2HG       LYS  82   4.193 -12.714 -12.714
  655   2HG   LYS  82          1HG       LYS  82   4.294 -13.039 -13.039
  656   1HD   LYS  82          2HD       LYS  82   5.224 -14.985 -14.985
  657   2HD   LYS  82          1HD       LYS  82   3.537 -15.456 -15.456
  658   1HE   LYS  82          2HE       LYS  82   3.097 -14.822 -14.822
  659   2HE   LYS  82          1HE       LYS  82   4.812 -14.458 -14.458
  660   1HZ   LYS  82          3HZ       LYS  82   3.987 -17.085 -17.085
  661   2HZ   LYS  82          2HZ       LYS  82   3.915 -16.783 -16.783
  662   3HZ   LYS  82          1HZ       LYS  82   5.394 -16.658 -16.658
  663    H    SER  83           H        SER  83   3.291  -9.800  -9.800
  664    HA   SER  83           HA       SER  83   2.743 -10.180 -10.180
  665   1HB   SER  83          2HB       SER  83   2.361  -7.941  -7.941
  666   2HB   SER  83          1HB       SER  83   3.568  -7.897  -7.897
  667    HG   SER  83           HG       SER  83   4.090  -6.778  -6.778
  668    H    LEU  84           H        LEU  84   4.614  -9.892  -9.892
  669    HA   LEU  84           HA       LEU  84   7.270 -10.549 -10.549
  670   1HB   LEU  84          2HB       LEU  84   6.276 -12.725 -12.725
  671   2HB   LEU  84          1HB       LEU  84   5.969 -12.092 -12.092
  672    HG   LEU  84           HG       LEU  84   8.386 -11.792 -11.792
  673   1HD1  LEU  84          2HD1      LEU  84   9.002 -11.388 -11.388
  674   2HD1  LEU  84          1HD1      LEU  84   8.699 -13.090 -13.090
  675   3HD1  LEU  84          3HD1      LEU  84  10.004 -12.625 -12.625
  676   1HD2  LEU  84          2HD2      LEU  84   7.341 -13.961 -13.961
  677   2HD2  LEU  84          1HD2      LEU  84   9.016 -14.166 -14.166
  678   3HD2  LEU  84          3HD2      LEU  84   7.702 -14.544 -14.544
  679    H    VAL  85           H        VAL  85   9.024  -9.866  -9.866
  680    HA   VAL  85           HA       VAL  85   8.063  -8.368  -8.368
  681    HB   VAL  85           HB       VAL  85   9.816  -7.047  -7.047
  682   1HG1  VAL  85          2HG1      VAL  85   9.876  -6.331  -6.331
  683   2HG1  VAL  85          1HG1      VAL  85   8.196  -5.833  -5.833
  684   3HG1  VAL  85          3HG1      VAL  85   9.464  -5.063  -5.063
  685   1HG2  VAL  85          2HG2      VAL  85   6.827  -6.935  -6.935
  686   2HG2  VAL  85          1HG2      VAL  85   7.691  -7.302  -7.302
  687   3HG2  VAL  85          3HG2      VAL  85   7.704  -5.663  -5.663
  688    H    LYS  86           H        LYS  86   9.381  -8.630  -8.630
  689    HA   LYS  86           HA       LYS  86  12.270  -9.189  -9.189
  690   1HB   LYS  86          2HB       LYS  86  11.983 -10.307 -10.307
  691   2HB   LYS  86          1HB       LYS  86  11.737 -11.231 -11.231
  692   1HG   LYS  86          2HG       LYS  86   9.279 -10.682 -10.682
  693   2HG   LYS  86          1HG       LYS  86   9.606  -9.954  -9.954
  694   1HD   LYS  86          2HD       LYS  86   9.092 -12.082 -12.082
  695   2HD   LYS  86          1HD       LYS  86  10.812 -12.316 -12.316
  696   1HE   LYS  86          2HE       LYS  86   8.931 -12.687 -12.687
  697   2HE   LYS  86          1HE       LYS  86   8.969 -13.942 -13.942
  698   1HZ   LYS  86          1HZ       LYS  86  11.509 -13.750 -13.750
  699   2HZ   LYS  86          3HZ       LYS  86  11.129 -13.029 -13.029
  700   3HZ   LYS  86          2HZ       LYS  86  10.609 -14.612 -14.612
  701    H    TRP  87           H        TRP  87  13.656  -8.264  -8.264
  702    HA   TRP  87           HA       TRP  87  12.602  -5.692  -5.692
  703   1HB   TRP  87          2HB       TRP  87  15.258  -7.113  -7.113
  704   2HB   TRP  87          1HB       TRP  87  14.936  -5.620  -5.620
  705    HD1  TRP  87           HD1      TRP  87  16.018  -6.940  -6.940
  706    HE1  TRP  87           HE1      TRP  87  16.229  -5.047  -5.047
  707    HE3  TRP  87           HE3      TRP  87  13.638  -3.212  -3.212
  708    HZ2  TRP  87           HZ2      TRP  87  15.484  -2.293  -2.293
  709    HZ3  TRP  87           HZ3      TRP  87  13.376  -0.967  -0.967
  710    HH2  TRP  87           HH2      TRP  87  14.294  -0.510  -0.510
  711    H    GLU  88           H        GLU  88  13.199  -5.093  -5.093
  712    HA   GLU  88           HA       GLU  88  12.617  -7.293  -7.293
  713   1HB   GLU  88          2HB       GLU  88  10.562  -5.844  -5.844
  714   2HB   GLU  88          1HB       GLU  88  11.335  -4.582  -4.582
  715   1HG   GLU  88          2HG       GLU  88   9.974  -5.616  -5.616
  716   2HG   GLU  88          1HG       GLU  88  11.531  -6.405  -6.405
  717    H    SER  89           H        SER  89  13.467  -3.906  -3.906
  718    HA   SER  89           HA       SER  89  15.544  -4.126  -4.126
  719   1HB   SER  89          2HB       SER  89  14.978  -1.923  -1.923
  720   2HB   SER  89          1HB       SER  89  13.471  -2.833  -2.833
  721    HG   SER  89           HG       SER  89  14.064  -0.565  -0.565
  722    H    GLU  90           H        GLU  90  16.367  -1.338  -1.338
  723    HA   GLU  90           HA       GLU  90  17.933  -1.923  -1.923
  724   1HB   GLU  90          2HB       GLU  90  17.777   0.727   0.727
  725   2HB   GLU  90          1HB       GLU  90  19.094   0.131   0.131
  726   1HG   GLU  90          2HG       GLU  90  18.866  -1.869  -1.869
  727   2HG   GLU  90          1HG       GLU  90  18.498  -0.427  -0.427
  728    H    ASN  91           H        ASN  91  14.999  -0.160  -0.160
  729    HA   ASN  91           HA       ASN  91  14.776   0.451   0.451
  730   1HB   ASN  91          2HB       ASN  91  14.087   2.510   2.510
  731   2HB   ASN  91          1HB       ASN  91  14.151   2.729   2.729
  732   1HD2  ASN  91          2HD2      ASN  91  17.403   3.617   3.617
  733   2HD2  ASN  91          1HD2      ASN  91  15.812   3.649   3.649
  734    H    LYS  92           H        LYS  92  13.427  -1.498  -1.498
  735    HA   LYS  92           HA       LYS  92  10.651  -0.582  -0.582
  736   1HB   LYS  92          2HB       LYS  92  11.104  -0.222  -0.222
  737   2HB   LYS  92          1HB       LYS  92  11.605  -1.903  -1.903
  738   1HG   LYS  92          2HG       LYS  92   9.186  -2.312  -2.312
  739   2HG   LYS  92          1HG       LYS  92   8.874  -0.762  -0.762
  740   1HD   LYS  92          2HD       LYS  92   9.617  -1.643  -1.643
  741   2HD   LYS  92          1HD       LYS  92  10.041  -3.181  -3.181
  742   1HE   LYS  92          2HE       LYS  92   7.243  -2.051  -2.051
  743   2HE   LYS  92          1HE       LYS  92   7.765  -3.073  -3.073
  744   1HZ   LYS  92          2HZ       LYS  92   7.988  -3.839  -3.839
  745   2HZ   LYS  92          1HZ       LYS  92   6.699  -4.298  -4.298
  746   3HZ   LYS  92          3HZ       LYS  92   8.273  -4.828  -4.828
  747    H    MET  93           H        MET  93  10.022  -2.038  -2.038
  748    HA   MET  93           HA       MET  93  10.769  -4.905  -4.905
  749   1HB   MET  93          2HB       MET  93  10.634  -5.227  -5.227
  750   2HB   MET  93          1HB       MET  93  11.831  -4.011  -4.011
  751   1HG   MET  93          2HG       MET  93   9.475  -2.560  -2.560
  752   2HG   MET  93          1HG       MET  93   9.382  -3.751  -3.751
  753   1HE   MET  93          3HE       MET  93  11.230  -4.452  -4.452
  754   2HE   MET  93          2HE       MET  93  12.832  -3.992  -3.992
  755   3HE   MET  93          1HE       MET  93  12.219  -3.329  -3.329
  756    H    VAL  94           H        VAL  94   9.182  -6.480  -6.480
  757    HA   VAL  94           HA       VAL  94   6.391  -5.482  -5.482
  758    HB   VAL  94           HB       VAL  94   7.190  -8.358  -8.358
  759   1HG1  VAL  94          3HG1      VAL  94   4.977  -6.542  -6.542
  760   2HG1  VAL  94          2HG1      VAL  94   5.341  -7.944  -7.944
  761   3HG1  VAL  94          1HG1      VAL  94   4.891  -8.160  -8.160
  762   1HG2  VAL  94          2HG2      VAL  94   7.762  -6.086  -6.086
  763   2HG2  VAL  94          1HG2      VAL  94   8.726  -7.526  -7.526
  764   3HG2  VAL  94          3HG2      VAL  94   7.278  -7.644  -7.644
  765    H    CYS  95           H        CYS  95   4.769  -7.057  -7.057
  766    HA   CYS  95           HA       CYS  95   5.918  -8.155  -8.155
  767   1HB   CYS  95          2HB       CYS  95   5.394  -5.768  -5.768
  768   2HB   CYS  95          1HB       CYS  95   3.728  -6.054  -6.054
  769    HG   CYS  95           HG       CYS  95   3.270  -7.194  -7.194
  770    H    GLU  96           H        GLU  96   4.771  -9.844  -9.844
  771    HA   GLU  96           HA       GLU  96   2.198 -10.543 -10.543
  772   1HB   GLU  96          2HB       GLU  96   4.047 -12.334 -12.334
  773   2HB   GLU  96          1HB       GLU  96   2.636 -12.846 -12.846
  774   1HG   GLU  96          2HG       GLU  96   4.765 -11.324 -11.324
  775   2HG   GLU  96          1HG       GLU  96   5.098 -13.005 -13.005
  776    H    GLN  97           H        GLN  97   0.549 -11.546 -11.546
  777    HA   GLN  97           HA       GLN  97   0.967 -10.874 -10.874
  778   1HB   GLN  97          2HB       GLN  97   0.200  -8.797  -8.797
  779   2HB   GLN  97          1HB       GLN  97  -1.376  -9.473  -9.473
  780   1HG   GLN  97          2HG       GLN  97  -0.517  -9.530  -9.530
  781   2HG   GLN  97          1HG       GLN  97   0.742  -8.435  -8.435
  782   1HE2  GLN  97          2HE2      GLN  97  -1.501  -5.690  -5.690
  783   2HE2  GLN  97          1HE2      GLN  97  -0.003  -6.337  -6.337
  784    H    LYS  98           H        LYS  98  -0.228 -12.159 -12.159
  785    HA   LYS  98           HA       LYS  98  -2.783 -13.290 -13.290
  786   1HB   LYS  98          2HB       LYS  98  -2.103 -15.550 -15.550
  787   2HB   LYS  98          1HB       LYS  98  -1.104 -14.997 -14.997
  788   1HG   LYS  98          2HG       LYS  98   0.463 -14.052 -14.052
  789   2HG   LYS  98          1HG       LYS  98  -0.399 -15.164 -15.164
  790   1HD   LYS  98          2HD       LYS  98   0.940 -15.986 -15.986
  791   2HD   LYS  98          1HD       LYS  98   1.674 -16.162 -16.162
  792   1HE   LYS  98          2HE       LYS  98   0.298 -17.896 -17.896
  793   2HE   LYS  98          1HE       LYS  98  -1.074 -17.253 -17.253
  794   1HZ   LYS  98          1HZ       LYS  98   0.077 -17.905 -17.905
  795   2HZ   LYS  98          3HZ       LYS  98   1.301 -18.626 -18.626
  796   3HZ   LYS  98          2HZ       LYS  98  -0.284 -19.233 -19.233
  797    H    LEU  99           H        LEU  99  -4.242 -13.814 -13.814
  798    HA   LEU  99           HA       LEU  99  -4.001 -12.183 -12.183
  799   1HB   LEU  99          2HB       LEU  99  -5.667 -14.646 -14.646
  800   2HB   LEU  99          1HB       LEU  99  -5.843 -13.639 -13.639
  801    HG   LEU  99           HG       LEU  99  -5.879 -12.247 -12.247
  802   1HD1  LEU  99          1HD1      LEU  99  -8.099 -14.031 -14.031
  803   2HD1  LEU  99          3HD1      LEU  99  -8.349 -12.769 -12.769
  804   3HD1  LEU  99          2HD1      LEU  99  -7.291 -14.134 -14.134
  805   1HD2  LEU  99          3HD2      LEU  99  -7.138 -12.014 -12.014
  806   2HD2  LEU  99          2HD2      LEU  99  -6.194 -10.820 -10.820
  807   3HD2  LEU  99          1HD2      LEU  99  -7.855 -11.166 -11.166
  808    H    LEU 100           H        LEU 100  -4.045 -13.039 -13.039
  809    HA   LEU 100           HA       LEU 100  -1.899 -15.041 -15.041
  810   1HB   LEU 100          2HB       LEU 100  -3.135 -12.928 -12.928
  811   2HB   LEU 100          1HB       LEU 100  -2.126 -14.211 -14.211
  812    HG   LEU 100           HG       LEU 100  -1.261 -12.360 -12.360
  813   1HD1  LEU 100          3HD1      LEU 100  -1.141 -12.138 -12.138
  814   2HD1  LEU 100          2HD1      LEU 100   0.327 -11.709 -11.709
  815   3HD1  LEU 100          1HD1      LEU 100  -1.185 -10.867 -10.867
  816   1HD2  LEU 100          2HD2      LEU 100  -0.027 -14.641 -14.641
  817   2HD2  LEU 100          1HD2      LEU 100   0.098 -14.232 -14.232
  818   3HD2  LEU 100          3HD2      LEU 100   1.015 -13.315 -13.315
  819    H    LYS 101           H        LYS 101  -5.294 -14.839 -14.839
  820    HA   LYS 101           HA       LYS 101  -5.534 -17.515 -17.515
  821   1HB   LYS 101          2HB       LYS 101  -7.286 -16.810 -16.810
  822   2HB   LYS 101          1HB       LYS 101  -5.687 -16.180 -16.180
  823   1HG   LYS 101          2HG       LYS 101  -6.282 -14.014 -14.014
  824   2HG   LYS 101          1HG       LYS 101  -7.345 -14.467 -14.467
  825   1HD   LYS 101          2HD       LYS 101  -9.160 -14.819 -14.819
  826   2HD   LYS 101          1HD       LYS 101  -8.158 -15.282 -15.282
  827   1HE   LYS 101          2HE       LYS 101  -9.083 -13.129 -13.129
  828   2HE   LYS 101          1HE       LYS 101  -7.389 -12.863 -12.863
  829   1HZ   LYS 101          2HZ       LYS 101  -8.283 -12.503 -12.503
  830   2HZ   LYS 101          1HZ       LYS 101  -9.794 -12.292 -12.292
  831   3HZ   LYS 101          3HZ       LYS 101  -8.504 -11.261 -11.261
  832    H    GLY 102           H        GLY 102  -7.668 -18.432 -18.432
  833   1HA   GLY 102          2HA       GLY 102  -9.517 -18.758 -18.758
  834   2HA   GLY 102          1HA       GLY 102  -9.754 -17.011 -17.011
  835    H    GLU 103           H        GLU 103 -10.348 -17.278 -17.278
  836    HA   GLU 103           HA       GLU 103  -8.218 -16.465 -16.465
  837   1HB   GLU 103          2HB       GLU 103  -7.629 -18.895 -18.895
  838   2HB   GLU 103          1HB       GLU 103  -9.184 -19.291 -19.291
  839   1HG   GLU 103          2HG       GLU 103  -8.598 -18.120 -18.120
  840   2HG   GLU 103          1HG       GLU 103  -7.111 -17.513 -17.513
  841    H    GLY 104           H        GLY 104  -9.065 -15.554 -15.554
  842   1HA   GLY 104          2HA       GLY 104 -11.614 -16.366 -16.366
  843   2HA   GLY 104          1HA       GLY 104 -11.705 -14.822 -14.822
  844    HA   PRO 105           HA       PRO 105  -9.964 -13.003 -13.003
  845   1HB   PRO 105          2HB       PRO 105  -9.111 -10.616 -10.616
  846   2HB   PRO 105          1HB       PRO 105 -10.818 -10.992 -10.992
  847   1HG   PRO 105          2HG       PRO 105  -9.367 -10.814 -10.814
  848   2HG   PRO 105          1HG       PRO 105 -11.103 -10.677 -10.677
  849   1HD   PRO 105          2HD       PRO 105  -9.712 -12.968 -12.968
  850   2HD   PRO 105          1HD       PRO 105 -11.427 -12.869 -12.869
  851    H    LYS 106           H        LYS 106  -7.802 -11.620 -11.620
  852    HA   LYS 106           HA       LYS 106  -5.495 -12.721 -12.721
  853   1HB   LYS 106          2HB       LYS 106  -5.859 -14.180 -14.180
  854   2HB   LYS 106          1HB       LYS 106  -5.840 -12.767 -12.767
  855   1HG   LYS 106          2HG       LYS 106  -3.562 -12.404 -12.404
  856   2HG   LYS 106          1HG       LYS 106  -3.526 -13.269 -13.269
  857   1HD   LYS 106          2HD       LYS 106  -4.107 -15.373 -15.373
  858   2HD   LYS 106          1HD       LYS 106  -3.677 -14.425 -14.425
  859   1HE   LYS 106          2HE       LYS 106  -1.889 -15.064 -15.064
  860   2HE   LYS 106          1HE       LYS 106  -1.710 -15.654 -15.654
  861   1HZ   LYS 106          3HZ       LYS 106  -1.601 -13.189 -13.189
  862   2HZ   LYS 106          2HZ       LYS 106  -1.295 -12.923 -12.923
  863   3HZ   LYS 106          1HZ       LYS 106  -0.238 -13.885 -13.885
  864    H    THR 107           H        THR 107  -3.795 -11.206 -11.206
  865    HA   THR 107           HA       THR 107  -4.228  -8.642  -8.642
  866    HB   THR 107           HB       THR 107  -2.825  -7.885  -7.885
  867    HG1  THR 107           HG1      THR 107  -3.117  -9.340  -9.340
  868   1HG2  THR 107          2HG2      THR 107  -5.814  -8.013  -8.013
  869   2HG2  THR 107          1HG2      THR 107  -5.038  -7.038  -7.038
  870   3HG2  THR 107          3HG2      THR 107  -4.730  -6.698  -6.698
  871    H    SER 108           H        SER 108  -2.445  -7.582  -7.582
  872    HA   SER 108           HA       SER 108   0.289  -8.414  -8.414
  873   1HB   SER 108          2HB       SER 108   0.543  -8.820  -8.820
  874   2HB   SER 108          1HB       SER 108   0.116 -10.144 -10.144
  875    HG   SER 108           HG       SER 108  -1.390 -10.175 -10.175
  876    H    TRP 109           H        TRP 109   1.648  -6.611  -6.611
  877    HA   TRP 109           HA       TRP 109   0.512  -4.611  -4.611
  878   1HB   TRP 109          2HB       TRP 109   1.008  -2.760  -2.760
  879   2HB   TRP 109          1HB       TRP 109  -0.332  -3.798  -3.798
  880    HD1  TRP 109           HD1      TRP 109  -0.114  -5.146  -5.146
  881    HE1  TRP 109           HE1      TRP 109   1.681  -5.275  -5.275
  882    HE3  TRP 109           HE3      TRP 109   3.695  -2.629  -2.629
  883    HZ2  TRP 109           HZ2      TRP 109   4.371  -4.421  -4.421
  884    HZ3  TRP 109           HZ3      TRP 109   5.847  -2.308  -2.308
  885    HH2  TRP 109           HH2      TRP 109   6.202  -3.193  -3.193
  886    H    THR 110           H        THR 110   2.159  -2.714  -2.714
  887    HA   THR 110           HA       THR 110   4.947  -3.751  -3.751
  888    HB   THR 110           HB       THR 110   5.411  -3.252  -3.252
  889    HG1  THR 110           HG1      THR 110   4.435  -1.380  -1.380
  890   1HG2  THR 110          3HG2      THR 110   3.615  -5.184  -5.184
  891   2HG2  THR 110          2HG2      THR 110   2.659  -4.227  -4.227
  892   3HG2  THR 110          1HG2      THR 110   4.208  -4.901  -4.901
  893    H    MET 111           H        MET 111   6.520  -1.944  -1.944
  894    HA   MET 111           HA       MET 111   5.558   0.807   0.807
  895   1HB   MET 111          2HB       MET 111   7.177   1.116   1.116
  896   2HB   MET 111          1HB       MET 111   5.788   0.099   0.099
  897   1HG   MET 111          2HG       MET 111   7.152  -1.914  -1.914
  898   2HG   MET 111          1HG       MET 111   8.540  -0.880  -0.880
  899   1HE   MET 111          3HE       MET 111   8.412   1.407   1.407
  900   2HE   MET 111          2HE       MET 111   9.340   0.813   0.813
  901   3HE   MET 111          1HE       MET 111   9.867   0.437   0.437
  902    H    GLU 112           H        GLU 112   6.741   2.051   2.051
  903    HA   GLU 112           HA       GLU 112   9.490   1.115   1.115
  904   1HB   GLU 112          2HB       GLU 112   7.788   0.808   0.808
  905   2HB   GLU 112          1HB       GLU 112   7.538   2.553   2.553
  906   1HG   GLU 112          2HG       GLU 112   9.599   2.997   2.997
  907   2HG   GLU 112          1HG       GLU 112  10.347   1.567   1.567
  908    H    LEU 113           H        LEU 113  11.020   2.783   2.783
  909    HA   LEU 113           HA       LEU 113  10.256   5.451   5.451
  910   1HB   LEU 113          2HB       LEU 113  12.233   3.713   3.713
  911   2HB   LEU 113          1HB       LEU 113  13.123   4.767   4.767
  912    HG   LEU 113           HG       LEU 113  13.126   5.503   5.503
  913   1HD1  LEU 113          3HD1      LEU 113  12.486   7.099   7.099
  914   2HD1  LEU 113          2HD1      LEU 113  11.927   7.864   7.864
  915   3HD1  LEU 113          1HD1      LEU 113  13.620   7.425   7.425
  916   1HD2  LEU 113          2HD2      LEU 113  10.335   5.039   5.039
  917   2HD2  LEU 113          1HD2      LEU 113  11.213   5.624   5.624
  918   3HD2  LEU 113          3HD2      LEU 113  10.542   6.771   6.771
  919    H    THR 114           H        THR 114  10.807   7.267   7.267
  920    HA   THR 114           HA       THR 114  11.444   6.611   6.611
  921    HB   THR 114           HB       THR 114  10.686   8.797   8.797
  922    HG1  THR 114           HG1      THR 114  10.703  10.430  10.430
  923   1HG2  THR 114          3HG2      THR 114   9.033   7.827   7.827
  924   2HG2  THR 114          2HG2      THR 114   8.481   8.941   8.941
  925   3HG2  THR 114          1HG2      THR 114   8.876   7.273   7.273
  926    H    ASN 115           H        ASN 115  13.081   7.927   7.927
  927    HA   ASN 115           HA       ASN 115  15.619   7.854   7.854
  928   1HB   ASN 115          2HB       ASN 115  14.574   9.032   9.032
  929   2HB   ASN 115          1HB       ASN 115  16.201   9.459   9.459
  930   1HD2  ASN 115          2HD2      ASN 115  15.799   6.032   6.032
  931   2HD2  ASN 115          1HD2      ASN 115  14.785   7.384   7.384
  932    H    ASP 116           H        ASP 116  13.145  10.296  10.296
  933    HA   ASP 116           HA       ASP 116  14.985  12.448  12.448
  934   1HB   ASP 116          2HB       ASP 116  12.068  12.194  12.194
  935   2HB   ASP 116          1HB       ASP 116  12.564  13.481  13.481
  936    H    GLY 117           H        GLY 117  12.878  10.090  10.090
  937   1HA   GLY 117          2HA       GLY 117  13.648   9.555   9.555
  938   2HA   GLY 117          1HA       GLY 117  13.518  11.285  11.285
  939    H    GLU 118           H        GLU 118  11.016  10.847  10.847
  940    HA   GLU 118           HA       GLU 118   8.990  11.082  11.082
  941   1HB   GLU 118          2HB       GLU 118   8.806  10.113  10.113
  942   2HB   GLU 118          1HB       GLU 118   7.418  10.536  10.536
  943   1HG   GLU 118          2HG       GLU 118   8.528  12.813  12.813
  944   2HG   GLU 118          1HG       GLU 118   9.635  12.356  12.356
  945    H    LEU 119           H        LEU 119   7.107   9.396   9.396
  946    HA   LEU 119           HA       LEU 119   8.142   6.606   6.606
  947   1HB   LEU 119          2HB       LEU 119   8.610   7.652   7.652
  948   2HB   LEU 119          1HB       LEU 119   6.871   7.799   7.799
  949    HG   LEU 119           HG       LEU 119   8.190   5.158   5.158
  950   1HD1  LEU 119          2HD1      LEU 119   7.922   6.627   6.627
  951   2HD1  LEU 119          1HD1      LEU 119   7.841   4.866   4.866
  952   3HD1  LEU 119          3HD1      LEU 119   9.285   5.690   5.690
  953   1HD2  LEU 119          3HD2      LEU 119   5.504   6.118   6.118
  954   2HD2  LEU 119          2HD2      LEU 119   5.898   4.843   4.843
  955   3HD2  LEU 119          1HD2      LEU 119   6.068   4.550   4.550
  956    H    ILE 120           H        ILE 120   6.632   5.635   5.635
  957    HA   ILE 120           HA       ILE 120   3.760   6.350   6.350
  958    HB   ILE 120           HB       ILE 120   4.500   6.625   6.625
  959   1HG1  ILE 120          2HG1      ILE 120   2.885   4.077   4.077
  960   2HG1  ILE 120          1HG1      ILE 120   2.205   5.592   5.592
  961   1HG2  ILE 120          3HG2      ILE 120   5.396   3.759   3.759
  962   2HG2  ILE 120          2HG2      ILE 120   5.133   4.474   4.474
  963   3HG2  ILE 120          1HG2      ILE 120   6.357   5.145   5.145
  964   1HD1  ILE 120          1HD1      ILE 120   2.773   6.656   6.656
  965   2HD1  ILE 120          3HD1      ILE 120   3.315   5.084   5.084
  966   3HD1  ILE 120          2HD1      ILE 120   1.621   5.331   5.331
  967    H    LEU 121           H        LEU 121   2.300   4.653   4.653
  968    HA   LEU 121           HA       LEU 121   3.594   2.008   2.008
  969   1HB   LEU 121          2HB       LEU 121   3.343   3.232   3.232
  970   2HB   LEU 121          1HB       LEU 121   1.623   3.437   3.437
  971    HG   LEU 121           HG       LEU 121   2.275   0.644   0.644
  972   1HD1  LEU 121          3HD1      LEU 121   4.191   1.385   1.385
  973   2HD1  LEU 121          2HD1      LEU 121   2.955   1.700   1.700
  974   3HD1  LEU 121          1HD1      LEU 121   3.177   0.068   0.068
  975   1HD2  LEU 121          3HD2      LEU 121   0.614   2.277   2.277
  976   2HD2  LEU 121          2HD2      LEU 121   0.061   1.343   1.343
  977   3HD2  LEU 121          1HD2      LEU 121   0.661   0.514   0.514
  978    H    THR 122           H        THR 122   2.464   0.331   0.331
  979    HA   THR 122           HA       THR 122  -0.301   0.898   0.898
  980    HB   THR 122           HB       THR 122   0.733  -1.597  -1.597
  981    HG1  THR 122           HG1      THR 122   2.370   0.675   0.675
  982   1HG2  THR 122          3HG2      THR 122   0.111   1.081   1.081
  983   2HG2  THR 122          2HG2      THR 122   0.412  -0.404  -0.404
  984   3HG2  THR 122          1HG2      THR 122  -0.986  -0.290  -0.290
  985    H    MET 123           H        MET 123  -1.795  -1.013  -1.013
  986    HA   MET 123           HA       MET 123  -1.062  -2.830  -2.830
  987   1HB   MET 123          2HB       MET 123  -3.611  -1.188  -1.188
  988   2HB   MET 123          1HB       MET 123  -3.111  -2.320  -2.320
  989   1HG   MET 123          2HG       MET 123  -0.951  -0.803  -0.803
  990   2HG   MET 123          1HG       MET 123  -2.023   0.401   0.401
  991   1HE   MET 123          2HE       MET 123  -0.770  -1.520  -1.520
  992   2HE   MET 123          1HE       MET 123  -1.577  -1.027  -1.027
  993   3HE   MET 123          3HE       MET 123  -2.251  -2.332  -2.332
  994    H    THR 124           H        THR 124  -2.571  -4.644  -4.644
  995    HA   THR 124           HA       THR 124  -4.339  -5.052  -5.052
  996    HB   THR 124           HB       THR 124  -2.385  -7.185  -7.185
  997    HG1  THR 124           HG1      THR 124  -0.934  -6.082  -6.082
  998   1HG2  THR 124          1HG2      THR 124  -4.470  -7.819  -7.819
  999   2HG2  THR 124          3HG2      THR 124  -3.995  -6.747  -6.747
 1000   3HG2  THR 124          2HG2      THR 124  -3.014  -8.160  -8.160
 1001    H    ALA 125           H        ALA 125  -5.916  -6.674  -6.674
 1002    HA   ALA 125           HA       ALA 125  -6.019  -8.096  -8.096
 1003   1HB   ALA 125          1HB       ALA 125  -6.801  -5.824  -5.824
 1004   2HB   ALA 125          3HB       ALA 125  -8.075  -5.945  -5.945
 1005   3HB   ALA 125          2HB       ALA 125  -8.072  -7.034  -7.034
 1006    H    ASP 126           H        ASP 126  -6.361  -9.988  -9.988
 1007    HA   ASP 126           HA       ASP 126  -7.679 -11.677 -11.677
 1008   1HB   ASP 126          2HB       ASP 126  -9.617  -9.768  -9.768
 1009   2HB   ASP 126          1HB       ASP 126 -10.012 -10.207 -10.207
 1010    H    ASP 127           H        ASP 127  -8.959  -8.950  -8.950
 1011    HA   ASP 127           HA       ASP 127  -7.104  -9.586  -9.586
 1012   1HB   ASP 127          2HB       ASP 127  -9.982 -10.307 -10.307
 1013   2HB   ASP 127          1HB       ASP 127  -9.393  -9.513  -9.513
 1014    H    VAL 128           H        VAL 128  -7.860  -7.325  -7.325
 1015    HA   VAL 128           HA       VAL 128  -8.388  -5.283  -5.283
 1016    HB   VAL 128           HB       VAL 128  -9.393  -3.875  -3.875
 1017   1HG1  VAL 128          1HG1      VAL 128 -10.506  -6.696  -6.696
 1018   2HG1  VAL 128          3HG1      VAL 128 -11.393  -5.268  -5.268
 1019   3HG1  VAL 128          2HG1      VAL 128 -10.885  -5.414  -5.414
 1020   1HG2  VAL 128          3HG2      VAL 128  -7.998  -5.652  -5.652
 1021   2HG2  VAL 128          2HG2      VAL 128  -8.914  -4.207  -4.207
 1022   3HG2  VAL 128          1HG2      VAL 128  -9.718  -5.774  -5.774
 1023    H    VAL 129           H        VAL 129  -7.465  -3.058  -3.058
 1024    HA   VAL 129           HA       VAL 129  -5.036  -3.494  -3.494
 1025    HB   VAL 129           HB       VAL 129  -5.001  -3.182  -3.182
 1026   1HG1  VAL 129          1HG1      VAL 129  -3.007  -1.812  -1.812
 1027   2HG1  VAL 129          3HG1      VAL 129  -2.620  -2.263  -2.263
 1028   3HG1  VAL 129          2HG1      VAL 129  -3.907  -1.101  -1.101
 1029   1HG2  VAL 129          2HG2      VAL 129  -3.544  -4.669  -4.669
 1030   2HG2  VAL 129          1HG2      VAL 129  -4.249  -5.265  -5.265
 1031   3HG2  VAL 129          3HG2      VAL 129  -2.718  -4.391  -4.391
 1032    H    CYS 130           H        CYS 130  -5.087  -1.817  -1.817
 1033    HA   CYS 130           HA       CYS 130  -6.250   0.765   0.765
 1034   1HB   CYS 130          2HB       CYS 130  -6.968  -0.444  -0.444
 1035   2HB   CYS 130          1HB       CYS 130  -5.427   0.110   0.110
 1036    HG   CYS 130           HG       CYS 130  -6.219   2.503   2.503
 1037    H    THR 131           H        THR 131  -4.737   2.137   2.137
 1038    HA   THR 131           HA       THR 131  -1.980   2.107   2.107
 1039    HB   THR 131           HB       THR 131  -3.102   3.424   3.424
 1040    HG1  THR 131           HG1      THR 131  -2.515   1.662   1.662
 1041   1HG2  THR 131          3HG2      THR 131  -0.339   3.255   3.255
 1042   2HG2  THR 131          2HG2      THR 131  -0.573   3.487   3.487
 1043   3HG2  THR 131          1HG2      THR 131  -1.196   4.678   4.678
 1044    H    ARG 132           H        ARG 132  -1.045   4.065   4.065
 1045    HA   ARG 132           HA       ARG 132  -2.684   6.491   6.491
 1046   1HB   ARG 132          2HB       ARG 132  -1.485   5.135   5.135
 1047   2HB   ARG 132          1HB       ARG 132  -2.412   6.635   6.635
 1048   1HG   ARG 132          2HG       ARG 132  -4.336   5.304   5.304
 1049   2HG   ARG 132          1HG       ARG 132  -3.403   3.848   3.848
 1050   1HD   ARG 132          2HD       ARG 132  -3.897   5.888   5.888
 1051   2HD   ARG 132          1HD       ARG 132  -5.119   4.674   4.674
 1052    HE   ARG 132           HE       ARG 132  -2.330   3.931   3.931
 1053   1HH1  ARG 132          1HH1      ARG 132  -5.233   1.436   1.436
 1054   2HH1  ARG 132          2HH1      ARG 132  -4.856   2.231   2.231
 1055   1HH2  ARG 132          1HH2      ARG 132  -3.195   3.486   3.486
 1056   2HH2  ARG 132          2HH2      ARG 132  -4.293   2.147   2.147
 1057    H    VAL 133           H        VAL 133  -1.172   7.710   7.710
 1058    HA   VAL 133           HA       VAL 133   1.673   7.322   7.322
 1059    HB   VAL 133           HB       VAL 133   0.173   9.777   9.777
 1060   1HG1  VAL 133          2HG1      VAL 133   3.043   8.922   8.922
 1061   2HG1  VAL 133          1HG1      VAL 133   2.416   9.851   9.851
 1062   3HG1  VAL 133          3HG1      VAL 133   2.363  10.527  10.527
 1063   1HG2  VAL 133          3HG2      VAL 133   0.875   7.166   7.166
 1064   2HG2  VAL 133          2HG2      VAL 133  -0.552   8.176   8.176
 1065   3HG2  VAL 133          1HG2      VAL 133   0.976   8.617   8.617
 1066    H    TYR 134           H        TYR 134   3.083   8.141   8.141
 1067    HA   TYR 134           HA       TYR 134   1.967  10.117  10.117
 1068   1HB   TYR 134          2HB       TYR 134   3.660   7.676   7.676
 1069   2HB   TYR 134          1HB       TYR 134   3.793   9.033   9.033
 1070    HD1  TYR 134           HD2      TYR 134   1.893   9.751   9.751
 1071    HD2  TYR 134           HD1      TYR 134   1.618   6.349   6.349
 1072    HE1  TYR 134           HE2      TYR 134  -0.168   9.022   9.022
 1073    HE2  TYR 134           HE1      TYR 134  -0.446   5.618   5.618
 1074    HH   TYR 134           HH       TYR 134  -1.391   6.054   6.054
 1075    H    VAL 135           H        VAL 135   2.997  12.009  12.009
 1076    HA   VAL 135           HA       VAL 135   5.810  12.006  12.006
 1077    HB   VAL 135           HB       VAL 135   3.662  13.548  13.548
 1078   1HG1  VAL 135          3HG1      VAL 135   3.799  14.871  14.871
 1079   2HG1  VAL 135          2HG1      VAL 135   5.419  15.373  15.373
 1080   3HG1  VAL 135          1HG1      VAL 135   4.024  15.836  15.836
 1081   1HG2  VAL 135          3HG2      VAL 135   6.639  13.747  13.747
 1082   2HG2  VAL 135          2HG2      VAL 135   5.463  13.357  13.357
 1083   3HG2  VAL 135          1HG2      VAL 135   5.658  15.025  15.025
 1084    H    ARG 136           H        ARG 136   7.425  12.925  12.925
 1085    HA   ARG 136           HA       ARG 136   7.159  12.635  12.635
 1086   1HB   ARG 136          2HB       ARG 136   9.129  13.694  13.694
 1087   2HB   ARG 136          1HB       ARG 136   9.015  14.732  14.732
 1088   1HG   ARG 136          2HG       ARG 136   9.650  13.064  13.064
 1089   2HG   ARG 136          1HG       ARG 136   9.057  11.776  11.776
 1090   1HD   ARG 136          2HD       ARG 136  11.562  13.436  13.436
 1091   2HD   ARG 136          1HD       ARG 136  11.481  11.713  11.713
 1092    HE   ARG 136           HE       ARG 136  10.031  12.055  12.055
 1093   1HH1  ARG 136          2HH1      ARG 136  12.791  10.651  10.651
 1094   2HH1  ARG 136          1HH1      ARG 136  13.746  11.287  11.287
 1095   1HH2  ARG 136          1HH2      ARG 136  11.442  13.740  13.740
 1096   2HH2  ARG 136          2HH2      ARG 136  12.983  13.039  13.039
 1097    H    GLU 137           HN       GLU 137   6.174  13.688  13.688
 1098    HA   GLU 137           HA       GLU 137   4.725  15.218  15.218
 1099   1HB   GLU 137          2HB       GLU 137   7.180  16.018  16.018
 1100   2HB   GLU 137          1HB       GLU 137   6.677  17.280  17.280
 1101   1HG   GLU 137          2HG       GLU 137   4.772  17.804  17.804
 1102   2HG   GLU 137          1HG       GLU 137   5.481  16.673  16.673

  Start of MODEL    9
    1   1H    PRO   1          1H        PRO   1 -16.051   5.102   5.102
    2   2H    PRO   1          2H        PRO   1 -17.371   5.067   5.067
    3    HA   PRO   1           HA       PRO   1 -18.704   5.971   5.971
    4   1HB   PRO   1          2HB       PRO   1 -17.211   8.225   8.225
    5   2HB   PRO   1          1HB       PRO   1 -18.558   8.214   8.214
    6   1HG   PRO   1          2HG       PRO   1 -15.774   8.654   8.654
    7   2HG   PRO   1          1HG       PRO   1 -17.131   8.682   8.682
    8   1HD   PRO   1          1HD       PRO   1 -15.100   6.693   6.693
    9   2HD   PRO   1          2HD       PRO   1 -16.496   6.694   6.694
   10    H    ASN   2           H        ASN   2 -15.697   7.080   7.080
   11    HA   ASN   2           HA       ASN   2 -15.863   4.960   4.960
   12   1HB   ASN   2          2HB       ASN   2 -16.487   7.857   7.857
   13   2HB   ASN   2          1HB       ASN   2 -16.011   6.694   6.694
   14   1HD2  ASN   2          2HD2      ASN   2 -19.835   6.814   6.814
   15   2HD2  ASN   2          1HD2      ASN   2 -18.724   8.077   8.077
   16    H    PHE   3           H        PHE   3 -13.926   4.656   4.656
   17    HA   PHE   3           HA       PHE   3 -11.644   6.334   6.334
   18   1HB   PHE   3          2HB       PHE   3 -11.783   3.660   3.660
   19   2HB   PHE   3          1HB       PHE   3 -10.295   4.478   4.478
   20    HD1  PHE   3           HD1      PHE   3 -13.516   3.604   3.604
   21    HD2  PHE   3           HD2      PHE   3  -9.218   3.570   3.570
   22    HE1  PHE   3           HE1      PHE   3 -13.550   2.493   2.493
   23    HE2  PHE   3           HE2      PHE   3  -9.262   2.449   2.449
   24    HZ   PHE   3           HZ       PHE   3 -11.428   1.903   1.903
   25    H    SER   4           H        SER   4 -13.806   6.169   6.169
   26    HA   SER   4           HA       SER   4 -12.017   6.379   6.379
   27   1HB   SER   4          2HB       SER   4 -14.557   5.784   5.784
   28   2HB   SER   4          1HB       SER   4 -14.791   7.527   7.527
   29    HG   SER   4           HG       SER   4 -13.608   7.537   7.537
   30    H    GLY   5           H        GLY   5 -10.734   8.025   8.025
   31   1HA   GLY   5          2HA       GLY   5 -11.379  10.632  10.632
   32   2HA   GLY   5          1HA       GLY   5 -11.046  10.669  10.669
   33    H    ASN   6           H        ASN   6  -9.216  12.119  12.119
   34    HA   ASN   6           HA       ASN   6  -6.938  10.435  10.435
   35   1HB   ASN   6          2HB       ASN   6  -7.594  13.370  13.370
   36   2HB   ASN   6          1HB       ASN   6  -5.896  12.886  12.886
   37   1HD2  ASN   6          2HD2      ASN   6  -6.462  11.026  11.026
   38   2HD2  ASN   6          1HD2      ASN   6  -5.869  10.651  10.651
   39    H    TRP   7           H        TRP   7  -4.798  11.126  11.126
   40    HA   TRP   7           HA       TRP   7  -5.358  11.801  11.801
   41   1HB   TRP   7          2HB       TRP   7  -4.244   9.138   9.138
   42   2HB   TRP   7          1HB       TRP   7  -4.247   9.696   9.696
   43    HD1  TRP   7           HD1      TRP   7  -6.440   8.144   8.144
   44    HE1  TRP   7           HE1      TRP   7  -8.844   7.860   7.860
   45    HE3  TRP   7           HE3      TRP   7  -6.019  10.886  10.886
   46    HZ2  TRP   7           HZ2      TRP   7 -10.374   8.733   8.733
   47    HZ3  TRP   7           HZ3      TRP   7  -7.949  11.186  11.186
   48    HH2  TRP   7           HH2      TRP   7 -10.110  10.110  10.110
   49    H    LYS   8           H        LYS   8  -3.795  13.018  13.018
   50    HA   LYS   8           HA       LYS   8  -1.050  12.780  12.780
   51   1HB   LYS   8          2HB       LYS   8  -2.716  15.149  15.149
   52   2HB   LYS   8          1HB       LYS   8  -1.026  15.239  15.239
   53   1HG   LYS   8          2HG       LYS   8  -1.498  14.192  14.192
   54   2HG   LYS   8          1HG       LYS   8  -1.888  15.895  15.895
   55   1HD   LYS   8          2HD       LYS   8   0.686  14.937  14.937
   56   2HD   LYS   8          1HD       LYS   8   0.597  15.066  15.066
   57   1HE   LYS   8          2HE       LYS   8  -0.287  17.413  17.413
   58   2HE   LYS   8          1HE       LYS   8   0.075  17.259  17.259
   59   1HZ   LYS   8          3HZ       LYS   8   2.051  16.918  16.918
   60   2HZ   LYS   8          2HZ       LYS   8   1.875  18.323  18.323
   61   3HZ   LYS   8          1HZ       LYS   8   2.377  16.870  16.870
   62    H    ILE   9           H        ILE   9   0.250  11.864  11.864
   63    HA   ILE   9           HA       ILE   9  -0.495  11.307  11.307
   64    HB   ILE   9           HB       ILE   9   1.141   9.988   9.988
   65   1HG1  ILE   9          2HG1      ILE   9   2.446  11.322  11.322
   66   2HG1  ILE   9          1HG1      ILE   9   1.238  10.043  10.043
   67   1HG2  ILE   9          3HG2      ILE   9   2.758  12.539  12.539
   68   2HG2  ILE   9          2HG2      ILE   9   3.490  10.967  10.967
   69   3HG2  ILE   9          1HG2      ILE   9   2.274  11.619  11.619
   70   1HD1  ILE   9          1HD1      ILE   9   3.028   8.935   8.935
   71   2HD1  ILE   9          3HD1      ILE   9   4.099   9.873   9.873
   72   3HD1  ILE   9          2HD1      ILE   9   3.038   8.651   8.651
   73    H    ILE  10           H        ILE  10   0.251  12.126  12.126
   74    HA   ILE  10           HA       ILE  10   1.395  14.886  14.886
   75    HB   ILE  10           HB       ILE  10   0.015  15.456  15.456
   76   1HG1  ILE  10          2HG1      ILE  10  -1.970  13.568  13.568
   77   2HG1  ILE  10          1HG1      ILE  10  -0.560  12.552  12.552
   78   1HG2  ILE  10          3HG2      ILE  10  -1.216  14.500  14.500
   79   2HG2  ILE  10          2HG2      ILE  10  -2.289  15.011  15.011
   80   3HG2  ILE  10          1HG2      ILE  10  -1.102  16.137  16.137
   81   1HD1  ILE  10          3HD1      ILE  10   0.618  13.679  13.679
   82   2HD1  ILE  10          2HD1      ILE  10  -0.830  14.635  14.635
   83   3HD1  ILE  10          1HD1      ILE  10  -0.863  12.886  12.886
   84    H    ARG  11           H        ARG  11   1.293  11.770  11.770
   85    HA   ARG  11           HA       ARG  11   3.850  12.482  12.482
   86   1HB   ARG  11          2HB       ARG  11   1.276  11.813  11.813
   87   2HB   ARG  11          1HB       ARG  11   2.706  10.997  10.997
   88   1HG   ARG  11          2HG       ARG  11   3.832  13.152  13.152
   89   2HG   ARG  11          1HG       ARG  11   2.446  13.994  13.994
   90   1HD   ARG  11          2HD       ARG  11   1.029  13.343  13.343
   91   2HD   ARG  11          1HD       ARG  11   2.239  12.217  12.217
   92    HE   ARG  11           HE       ARG  11   3.080  15.038  15.038
   93   1HH1  ARG  11          2HH1      ARG  11   4.678  14.144  14.144
   94   2HH1  ARG  11          1HH1      ARG  11   3.810  14.054  14.054
   95   1HH2  ARG  11          1HH2      ARG  11   0.686  14.177  14.177
   96   2HH2  ARG  11          2HH2      ARG  11   1.550  14.072  14.072
   97    H    SER  12           H        SER  12   4.928  10.434  10.434
   98    HA   SER  12           HA       SER  12   4.035   7.834   7.834
   99   1HB   SER  12          2HB       SER  12   5.323   7.416   7.416
  100   2HB   SER  12          1HB       SER  12   4.463   8.922   8.922
  101    HG   SER  12           HG       SER  12   7.059   8.501   8.501
  102    H    GLU  13           H        GLU  13   5.492   6.248   6.248
  103    HA   GLU  13           HA       GLU  13   8.154   7.112   7.112
  104   1HB   GLU  13          2HB       GLU  13   7.680   5.971   5.971
  105   2HB   GLU  13          1HB       GLU  13   6.806   7.480   7.480
  106   1HG   GLU  13          2HG       GLU  13   5.425   5.049   5.049
  107   2HG   GLU  13          1HG       GLU  13   5.612   5.153   5.153
  108    H    ASN  14           H        ASN  14   9.452   5.176   5.176
  109    HA   ASN  14           HA       ASN  14  10.332   3.056   3.056
  110   1HB   ASN  14          2HB       ASN  14   7.534   2.189   2.189
  111   2HB   ASN  14          1HB       ASN  14   8.843   1.200   1.200
  112   1HD2  ASN  14          2HD2      ASN  14   6.373   2.865   2.865
  113   2HD2  ASN  14          1HD2      ASN  14   6.036   2.732   2.732
  114    H    PHE  15           H        PHE  15  10.064   5.015   5.015
  115    HA   PHE  15           HA       PHE  15   9.261   3.629   3.629
  116   1HB   PHE  15          2HB       PHE  15   9.375   6.163   6.163
  117   2HB   PHE  15          1HB       PHE  15  11.115   6.004   6.004
  118    HD1  PHE  15           HD2      PHE  15  10.157   3.521   3.521
  119    HD2  PHE  15           HD1      PHE  15   9.949   7.793   7.793
  120    HE1  PHE  15           HE2      PHE  15  10.027   3.690   3.690
  121    HE2  PHE  15           HE1      PHE  15   9.803   7.949   7.949
  122    HZ   PHE  15           HZ       PHE  15   9.843   5.882   5.882
  123    H    GLU  16           H        GLU  16  12.509   4.776   4.776
  124    HA   GLU  16           HA       GLU  16  13.947   3.313   3.313
  125   1HB   GLU  16          2HB       GLU  16  14.684   4.414   4.414
  126   2HB   GLU  16          1HB       GLU  16  15.858   3.531   3.531
  127   1HG   GLU  16          2HG       GLU  16  14.311   5.658   5.658
  128   2HG   GLU  16          1HG       GLU  16  15.512   6.196   6.196
  129    H    GLU  17           H        GLU  17  12.868   2.330   2.330
  130    HA   GLU  17           HA       GLU  17  14.423  -0.073  -0.073
  131   1HB   GLU  17          2HB       GLU  17  12.991  -0.774  -0.774
  132   2HB   GLU  17          1HB       GLU  17  13.500   0.903   0.903
  133   1HG   GLU  17          2HG       GLU  17  11.322   1.391   1.391
  134   2HG   GLU  17          1HG       GLU  17  11.161   1.126   1.126
  135    H    LEU  18           H        LEU  18  11.308   0.725   0.725
  136    HA   LEU  18           HA       LEU  18  10.554  -2.056  -2.056
  137   1HB   LEU  18          2HB       LEU  18   8.909  -0.111  -0.111
  138   2HB   LEU  18          1HB       LEU  18   9.459   0.378   0.378
  139    HG   LEU  18           HG       LEU  18   8.911  -1.945  -1.945
  140   1HD1  LEU  18          2HD1      LEU  18   8.057  -2.139  -2.139
  141   2HD1  LEU  18          1HD1      LEU  18   7.088  -2.980  -2.980
  142   3HD1  LEU  18          3HD1      LEU  18   8.802  -3.357  -3.357
  143   1HD2  LEU  18          2HD2      LEU  18   7.274   0.262   0.262
  144   2HD2  LEU  18          1HD2      LEU  18   6.868  -1.178  -1.178
  145   3HD2  LEU  18          3HD2      LEU  18   6.313  -1.023  -1.023
  146    H    LEU  19           H        LEU  19  12.487   0.307   0.307
  147    HA   LEU  19           HA       LEU  19  12.308  -1.187  -1.187
  148   1HB   LEU  19          2HB       LEU  19  14.233   1.069   1.069
  149   2HB   LEU  19          1HB       LEU  19  13.552   0.573   0.573
  150    HG   LEU  19           HG       LEU  19  12.220   2.098   2.098
  151   1HD1  LEU  19          2HD1      LEU  19  13.501   2.889   2.889
  152   2HD1  LEU  19          1HD1      LEU  19  11.798   2.928   2.928
  153   3HD1  LEU  19          3HD1      LEU  19  12.363   3.853   3.853
  154   1HD2  LEU  19          1HD2      LEU  19  10.953   0.159   0.159
  155   2HD2  LEU  19          3HD2      LEU  19  10.246   1.081   1.081
  156   3HD2  LEU  19          2HD2      LEU  19  10.318   1.772   1.772
  157    H    LYS  20           H        LYS  20  14.202  -1.182  -1.182
  158    HA   LYS  20           HA       LYS  20  16.555  -2.402  -2.402
  159   1HB   LYS  20          2HB       LYS  20  15.980  -2.238  -2.238
  160   2HB   LYS  20          1HB       LYS  20  17.546  -2.409  -2.409
  161   1HG   LYS  20          2HG       LYS  20  16.232  -0.027  -0.027
  162   2HG   LYS  20          1HG       LYS  20  16.259  -0.009  -0.009
  163   1HD   LYS  20          2HD       LYS  20  18.675  -0.474  -0.474
  164   2HD   LYS  20          1HD       LYS  20  18.281   1.047   1.047
  165   1HE   LYS  20          2HE       LYS  20  18.383  -1.381  -1.381
  166   2HE   LYS  20          1HE       LYS  20  19.920  -0.759  -0.759
  167   1HZ   LYS  20          1HZ       LYS  20  17.869   0.881   0.881
  168   2HZ   LYS  20          3HZ       LYS  20  19.237   0.219   0.219
  169   3HZ   LYS  20          2HZ       LYS  20  19.423   1.381   1.381
  170    H    VAL  21           H        VAL  21  13.692  -3.277  -3.277
  171    HA   VAL  21           HA       VAL  21  14.421  -6.053  -6.053
  172    HB   VAL  21           HB       VAL  21  12.740  -4.816  -4.816
  173   1HG1  VAL  21          2HG1      VAL  21  11.733  -3.497  -3.497
  174   2HG1  VAL  21          1HG1      VAL  21  11.018  -4.954  -4.954
  175   3HG1  VAL  21          3HG1      VAL  21  10.515  -4.376  -4.376
  176   1HG2  VAL  21          3HG2      VAL  21  12.739  -7.347  -7.347
  177   2HG2  VAL  21          2HG2      VAL  21  11.209  -6.649  -6.649
  178   3HG2  VAL  21          1HG2      VAL  21  11.430  -7.105  -7.105
  179    H    LEU  22           H        LEU  22  12.620  -4.201  -4.201
  180    HA   LEU  22           HA       LEU  22  11.649  -6.398  -6.398
  181   1HB   LEU  22          2HB       LEU  22  11.793  -3.448  -3.448
  182   2HB   LEU  22          1HB       LEU  22  11.820  -4.226  -4.226
  183    HG   LEU  22           HG       LEU  22   9.727  -5.362  -5.362
  184   1HD1  LEU  22          1HD1      LEU  22  10.177  -5.699  -5.699
  185   2HD1  LEU  22          3HD1      LEU  22   9.773  -4.004  -4.004
  186   3HD1  LEU  22          2HD1      LEU  22   8.551  -5.118  -5.118
  187   1HD2  LEU  22          1HD2      LEU  22   9.902  -2.818  -2.818
  188   2HD2  LEU  22          3HD2      LEU  22   8.335  -3.478  -3.478
  189   3HD2  LEU  22          2HD2      LEU  22   9.293  -2.564  -2.564
  190    H    GLY  23           H        GLY  23  14.388  -4.187  -4.187
  191   1HA   GLY  23          2HA       GLY  23  15.489  -5.772  -5.772
  192   2HA   GLY  23          1HA       GLY  23  16.006  -4.151  -4.151
  193    H    VAL  24           H        VAL  24  18.174  -5.069  -5.069
  194    HA   VAL  24           HA       VAL  24  19.054  -6.165  -6.165
  195    HB   VAL  24           HB       VAL  24  20.505  -7.839  -7.839
  196   1HG1  VAL  24          1HG1      VAL  24  18.088  -8.236  -8.236
  197   2HG1  VAL  24          3HG1      VAL  24  17.642  -8.306  -8.306
  198   3HG1  VAL  24          2HG1      VAL  24  18.806  -9.458  -9.458
  199   1HG2  VAL  24          1HG2      VAL  24  18.978  -6.771  -6.771
  200   2HG2  VAL  24          3HG2      VAL  24  20.720  -6.983  -6.983
  201   3HG2  VAL  24          2HG2      VAL  24  19.675  -8.391  -8.391
  202    H    ASN  25           H        ASN  25  19.944  -4.747  -4.747
  203    HA   ASN  25           HA       ASN  25  22.685  -4.210  -4.210
  204   1HB   ASN  25          2HB       ASN  25  21.113  -3.959  -3.959
  205   2HB   ASN  25          1HB       ASN  25  21.119  -2.282  -2.282
  206   1HD2  ASN  25          2HD2      ASN  25  24.313  -1.710  -1.710
  207   2HD2  ASN  25          1HD2      ASN  25  22.815  -1.082  -1.082
  208    H    VAL  26           H        VAL  26  22.547  -1.224  -1.224
  209    HA   VAL  26           HA       VAL  26  21.512  -0.316  -0.316
  210    HB   VAL  26           HB       VAL  26  24.047   0.861   0.861
  211   1HG1  VAL  26          3HG1      VAL  26  22.562   0.699   0.699
  212   2HG1  VAL  26          2HG1      VAL  26  24.321   0.786   0.786
  213   3HG1  VAL  26          1HG1      VAL  26  23.413   2.063   2.063
  214   1HG2  VAL  26          1HG2      VAL  26  23.841  -1.711  -1.711
  215   2HG2  VAL  26          3HG2      VAL  26  24.570  -1.513  -1.513
  216   3HG2  VAL  26          2HG2      VAL  26  25.327  -0.779  -0.779
  217    H    MET  27           H        MET  27  22.718   0.685   0.685
  218    HA   MET  27           HA       MET  27  21.505   3.320   3.320
  219   1HB   MET  27          2HB       MET  27  23.393   2.223   2.223
  220   2HB   MET  27          1HB       MET  27  21.982   2.125   2.125
  221   1HG   MET  27          2HG       MET  27  21.699   4.436   4.436
  222   2HG   MET  27          1HG       MET  27  22.526   4.680   4.680
  223   1HE   MET  27          3HE       MET  27  24.189   6.312   6.312
  224   2HE   MET  27          2HE       MET  27  25.029   4.909   4.909
  225   3HE   MET  27          1HE       MET  27  25.790   5.869   5.869
  226    H    LEU  28           H        LEU  28  20.478   0.134   0.134
  227    HA   LEU  28           HA       LEU  28  18.239   0.729   0.729
  228   1HB   LEU  28          2HB       LEU  28  19.350  -1.518  -1.518
  229   2HB   LEU  28          1HB       LEU  28  17.592  -1.546  -1.546
  230    HG   LEU  28           HG       LEU  28  18.504  -2.771  -2.771
  231   1HD1  LEU  28          3HD1      LEU  28  16.378  -1.281  -1.281
  232   2HD1  LEU  28          2HD1      LEU  28  17.368  -0.202  -0.202
  233   3HD1  LEU  28          1HD1      LEU  28  17.066  -1.855  -1.855
  234   1HD2  LEU  28          2HD2      LEU  28  20.616  -1.501  -1.501
  235   2HD2  LEU  28          1HD2      LEU  28  19.755  -1.566  -1.566
  236   3HD2  LEU  28          3HD2      LEU  28  19.710  -0.097  -0.097
  237    H    ARG  29           H        ARG  29  18.672   1.256   1.256
  238    HA   ARG  29           HA       ARG  29  15.741   1.337   1.337
  239   1HB   ARG  29          2HB       ARG  29  18.027   1.725   1.725
  240   2HB   ARG  29          1HB       ARG  29  16.320   1.562   1.562
  241   1HG   ARG  29          2HG       ARG  29  16.954  -0.634  -0.634
  242   2HG   ARG  29          1HG       ARG  29  16.591  -0.685  -0.685
  243   1HD   ARG  29          2HD       ARG  29  18.716  -1.345  -1.345
  244   2HD   ARG  29          1HD       ARG  29  19.252   0.234   0.234
  245    HE   ARG  29           HE       ARG  29  19.981  -0.772  -0.772
  246   1HH1  ARG  29          2HH1      ARG  29  18.064  -3.029  -3.029
  247   2HH1  ARG  29          1HH1      ARG  29  18.061  -4.210  -4.210
  248   1HH2  ARG  29          1HH2      ARG  29  19.784  -2.243  -2.243
  249   2HH2  ARG  29          2HH2      ARG  29  19.023  -3.772  -3.772
  250    H    LYS  30           H        LYS  30  18.613   3.420   3.420
  251    HA   LYS  30           HA       LYS  30  17.210   5.781   5.781
  252   1HB   LYS  30          2HB       LYS  30  19.799   5.186   5.186
  253   2HB   LYS  30          1HB       LYS  30  19.703   5.973   5.973
  254   1HG   LYS  30          2HG       LYS  30  18.955   8.020   8.020
  255   2HG   LYS  30          1HG       LYS  30  18.578   7.257   7.257
  256   1HD   LYS  30          2HD       LYS  30  21.152   6.649   6.649
  257   2HD   LYS  30          1HD       LYS  30  21.245   8.023   8.023
  258   1HE   LYS  30          2HE       LYS  30  19.805   8.225   8.225
  259   2HE   LYS  30          1HE       LYS  30  21.540   8.513   8.513
  260   1HZ   LYS  30          1HZ       LYS  30  20.934  10.103  10.103
  261   2HZ   LYS  30          3HZ       LYS  30  19.336   9.995   9.995
  262   3HZ   LYS  30          2HZ       LYS  30  20.553  10.595  10.595
  263    H    ILE  31           H        ILE  31  17.575   4.243   4.243
  264    HA   ILE  31           HA       ILE  31  16.963   6.650   6.650
  265    HB   ILE  31           HB       ILE  31  16.865   3.719   3.719
  266   1HG1  ILE  31          2HG1      ILE  31  18.971   5.695   5.695
  267   2HG1  ILE  31          1HG1      ILE  31  19.089   4.931   4.931
  268   1HG2  ILE  31          2HG2      ILE  31  16.351   6.292   6.292
  269   2HG2  ILE  31          1HG2      ILE  31  17.270   5.065   5.065
  270   3HG2  ILE  31          3HG2      ILE  31  15.651   4.697   4.697
  271   1HD1  ILE  31          3HD1      ILE  31  18.558   2.748   2.748
  272   2HD1  ILE  31          2HD1      ILE  31  19.371   3.731   3.731
  273   3HD1  ILE  31          1HD1      ILE  31  20.201   3.325   3.325
  274    H    ALA  32           H        ALA  32  15.172   4.068   4.068
  275    HA   ALA  32           HA       ALA  32  12.653   4.735   4.735
  276   1HB   ALA  32          3HB       ALA  32  13.413   2.877   2.877
  277   2HB   ALA  32          2HB       ALA  32  11.731   3.157   3.157
  278   3HB   ALA  32          1HB       ALA  32  12.850   2.452   2.452
  279    H    VAL  33           H        VAL  33  14.392   5.646   5.646
  280    HA   VAL  33           HA       VAL  33  12.132   6.826   6.826
  281    HB   VAL  33           HB       VAL  33  15.062   7.465   7.465
  282   1HG1  VAL  33          2HG1      VAL  33  12.618   7.450   7.450
  283   2HG1  VAL  33          1HG1      VAL  33  14.263   7.719   7.719
  284   3HG1  VAL  33          3HG1      VAL  33  13.523   8.861   8.861
  285   1HG2  VAL  33          1HG2      VAL  33  14.019   4.877   4.877
  286   2HG2  VAL  33          3HG2      VAL  33  15.483   5.415   5.415
  287   3HG2  VAL  33          2HG2      VAL  33  13.951   5.384   5.384
  288    H    ALA  34           H        ALA  34  14.718   7.887   7.887
  289    HA   ALA  34           HA       ALA  34  13.977  10.701  10.701
  290   1HB   ALA  34          1HB       ALA  34  15.871   9.101   9.101
  291   2HB   ALA  34          3HB       ALA  34  15.562  10.809  10.809
  292   3HB   ALA  34          2HB       ALA  34  16.270  10.304  10.304
  293    H    ALA  35           H        ALA  35  13.297   7.934   7.934
  294    HA   ALA  35           HA       ALA  35  12.089   9.330   9.330
  295   1HB   ALA  35          3HB       ALA  35  12.031   6.517   6.517
  296   2HB   ALA  35          2HB       ALA  35  10.890   6.997   6.997
  297   3HB   ALA  35          1HB       ALA  35  12.626   7.114   7.114
  298    H    ALA  36           H        ALA  36  10.839   8.005   8.005
  299    HA   ALA  36           HA       ALA  36   8.067   8.336   8.336
  300   1HB   ALA  36          1HB       ALA  36   9.749   7.782   7.782
  301   2HB   ALA  36          3HB       ALA  36   8.520   8.961   8.961
  302   3HB   ALA  36          2HB       ALA  36   8.040   7.407   7.407
  303    H    SER  37           H        SER  37   9.989  10.510  10.510
  304    HA   SER  37           HA       SER  37   9.721  12.812  12.812
  305   1HB   SER  37          2HB       SER  37   9.675  12.492  12.492
  306   2HB   SER  37          1HB       SER  37   9.270  14.073  14.073
  307    HG   SER  37           HG       SER  37  11.529  13.794  13.794
  308    H    LYS  38           H        LYS  38   7.440  11.476  11.476
  309    HA   LYS  38           HA       LYS  38   5.164  11.838  11.838
  310   1HB   LYS  38          2HB       LYS  38   5.471  14.498  14.498
  311   2HB   LYS  38          1HB       LYS  38   4.264  14.058  14.058
  312   1HG   LYS  38          2HG       LYS  38   6.503  13.566  13.566
  313   2HG   LYS  38          1HG       LYS  38   7.111  14.839  14.839
  314   1HD   LYS  38          2HD       LYS  38   5.669  16.435  16.435
  315   2HD   LYS  38          1HD       LYS  38   4.453  15.241  15.241
  316   1HE   LYS  38          2HE       LYS  38   6.208  14.401  14.401
  317   2HE   LYS  38          1HE       LYS  38   7.020  15.940  15.940
  318   1HZ   LYS  38          3HZ       LYS  38   4.686  16.917  16.917
  319   2HZ   LYS  38          2HZ       LYS  38   4.373  15.431  15.431
  320   3HZ   LYS  38          1HZ       LYS  38   5.626  16.432  16.432
  321    HA   PRO  39           HA       PRO  39   4.510  10.670  10.670
  322   1HB   PRO  39          2HB       PRO  39   3.697   8.093   8.093
  323   2HB   PRO  39          1HB       PRO  39   5.376   8.564   8.564
  324   1HG   PRO  39          2HG       PRO  39   4.067   7.856   7.856
  325   2HG   PRO  39          1HG       PRO  39   5.763   7.686   7.686
  326   1HD   PRO  39          2HD       PRO  39   4.741   9.719   9.719
  327   2HD   PRO  39          1HD       PRO  39   6.313   9.752   9.752
  328    H    ALA  40           H        ALA  40   2.456  10.462  10.462
  329    HA   ALA  40           HA       ALA  40   0.156  11.173  11.173
  330   1HB   ALA  40          3HB       ALA  40   0.745  11.209  11.209
  331   2HB   ALA  40          2HB       ALA  40  -0.934  11.210  11.210
  332   3HB   ALA  40          1HB       ALA  40   0.151  12.508  12.508
  333    H    VAL  41           H        VAL  41  -1.992  10.092  10.092
  334    HA   VAL  41           HA       VAL  41  -1.731   7.279   7.279
  335    HB   VAL  41           HB       VAL  41  -2.446   8.202   8.202
  336   1HG1  VAL  41          1HG1      VAL  41  -3.260   5.553   5.553
  337   2HG1  VAL  41          3HG1      VAL  41  -3.402   5.968   5.968
  338   3HG1  VAL  41          2HG1      VAL  41  -4.364   6.830   6.830
  339   1HG2  VAL  41          1HG2      VAL  41  -0.711   6.024   6.024
  340   2HG2  VAL  41          3HG2      VAL  41  -0.182   7.465   7.465
  341   3HG2  VAL  41          2HG2      VAL  41  -1.040   6.183   6.183
  342    H    GLU  42           H        GLU  42  -3.957   6.318   6.318
  343    HA   GLU  42           HA       GLU  42  -6.202   8.229   8.229
  344   1HB   GLU  42          2HB       GLU  42  -5.065   8.662   8.662
  345   2HB   GLU  42          1HB       GLU  42  -5.125   6.937   6.937
  346   1HG   GLU  42          2HG       GLU  42  -7.650   7.095   7.095
  347   2HG   GLU  42          1HG       GLU  42  -7.466   8.844   8.844
  348    H    ILE  43           H        ILE  43  -7.766   7.048   7.048
  349    HA   ILE  43           HA       ILE  43  -7.846   4.115   4.115
  350    HB   ILE  43           HB       ILE  43  -8.920   5.822   5.822
  351   1HG1  ILE  43          2HG1      ILE  43  -7.311   3.539   3.539
  352   2HG1  ILE  43          1HG1      ILE  43  -6.454   4.471   4.471
  353   1HG2  ILE  43          1HG2      ILE  43  -9.624   3.047   3.047
  354   2HG2  ILE  43          3HG2      ILE  43  -9.361   3.330   3.330
  355   3HG2  ILE  43          2HG2      ILE  43 -10.593   4.248   4.248
  356   1HD1  ILE  43          1HD1      ILE  43  -7.735   6.135   6.135
  357   2HD1  ILE  43          3HD1      ILE  43  -6.488   5.060   5.060
  358   3HD1  ILE  43          2HD1      ILE  43  -6.097   6.207   6.207
  359    H    LYS  44           H        LYS  44  -9.632   3.192   3.192
  360    HA   LYS  44           HA       LYS  44 -11.928   4.968   4.968
  361   1HB   LYS  44          2HB       LYS  44 -11.721   2.584   2.584
  362   2HB   LYS  44          1HB       LYS  44 -11.871   4.268   4.268
  363   1HG   LYS  44          2HG       LYS  44  -9.489   4.591   4.591
  364   2HG   LYS  44          1HG       LYS  44  -9.239   3.067   3.067
  365   1HD   LYS  44          2HD       LYS  44  -9.603   1.791   1.791
  366   2HD   LYS  44          1HD       LYS  44 -10.609   3.025   3.025
  367   1HE   LYS  44          2HE       LYS  44  -8.665   4.416   4.416
  368   2HE   LYS  44          1HE       LYS  44  -7.625   3.306   3.306
  369   1HZ   LYS  44          1HZ       LYS  44  -8.294   1.566   1.566
  370   2HZ   LYS  44          3HZ       LYS  44  -9.067   2.770   2.770
  371   3HZ   LYS  44          2HZ       LYS  44  -7.386   2.834   2.834
  372    H    GLN  45           H        GLN  45 -13.629   4.364   4.364
  373    HA   GLN  45           HA       GLN  45 -13.708   1.556   1.556
  374   1HB   GLN  45          2HB       GLN  45 -13.888   3.330   3.330
  375   2HB   GLN  45          1HB       GLN  45 -15.313   3.976   3.976
  376   1HG   GLN  45          2HG       GLN  45 -16.537   1.901   1.901
  377   2HG   GLN  45          1HG       GLN  45 -15.105   1.162   1.162
  378   1HE2  GLN  45          2HE2      GLN  45 -16.451   2.237   2.237
  379   2HE2  GLN  45          1HE2      GLN  45 -16.113   0.905   0.905
  380    H    GLU  46           H        GLU  46 -14.887   0.159   0.159
  381    HA   GLU  46           HA       GLU  46 -17.442   1.137   1.137
  382   1HB   GLU  46          2HB       GLU  46 -15.296  -0.655  -0.655
  383   2HB   GLU  46          1HB       GLU  46 -16.960  -1.095  -1.095
  384   1HG   GLU  46          2HG       GLU  46 -17.187   1.448   1.448
  385   2HG   GLU  46          1HG       GLU  46 -15.429   1.373   1.373
  386    H    GLY  47           H        GLY  47 -17.728   0.493   0.493
  387   1HA   GLY  47          2HA       GLY  47 -19.275  -0.883  -0.883
  388   2HA   GLY  47          1HA       GLY  47 -19.132  -2.113  -2.113
  389    H    ASP  48           H        ASP  48 -18.231  -3.923  -3.923
  390    HA   ASP  48           HA       ASP  48 -16.394  -3.773  -3.773
  391   1HB   ASP  48          2HB       ASP  48 -16.148  -6.273  -6.273
  392   2HB   ASP  48          1HB       ASP  48 -17.751  -5.729  -5.729
  393    H    THR  49           H        THR  49 -15.904  -3.151  -3.151
  394    HA   THR  49           HA       THR  49 -13.270  -4.482  -4.482
  395    HB   THR  49           HB       THR  49 -15.034  -3.063  -3.063
  396    HG1  THR  49           HG1      THR  49 -15.495  -5.180  -5.180
  397   1HG2  THR  49          3HG2      THR  49 -12.100  -3.679  -3.679
  398   2HG2  THR  49          2HG2      THR  49 -13.119  -3.777  -3.777
  399   3HG2  THR  49          1HG2      THR  49 -12.978  -2.255  -2.255
  400    H    PHE  50           H        PHE  50 -11.385  -3.319  -3.319
  401    HA   PHE  50           HA       PHE  50 -11.594  -0.353  -0.353
  402   1HB   PHE  50          2HB       PHE  50 -10.107  -2.126  -2.126
  403   2HB   PHE  50          1HB       PHE  50  -9.984  -0.365  -0.365
  404    HD1  PHE  50           HD2      PHE  50 -11.874   1.057   1.057
  405    HD2  PHE  50           HD1      PHE  50 -12.160  -3.218  -3.218
  406    HE1  PHE  50           HE2      PHE  50 -13.987   1.242   1.242
  407    HE2  PHE  50           HE1      PHE  50 -14.278  -3.039  -3.039
  408    HZ   PHE  50           HZ       PHE  50 -15.199  -0.811  -0.811
  409    H    TYR  51           H        TYR  51 -10.345   0.402   0.402
  410    HA   TYR  51           HA       TYR  51  -7.966  -1.139  -1.139
  411   1HB   TYR  51          2HB       TYR  51  -9.737  -0.584  -0.584
  412   2HB   TYR  51          1HB       TYR  51  -9.489   1.123   1.123
  413    HD1  TYR  51           HD1      TYR  51  -7.000   1.971   1.971
  414    HD2  TYR  51           HD2      TYR  51  -8.545  -1.595  -1.595
  415    HE1  TYR  51           HE1      TYR  51  -5.188   2.053   2.053
  416    HE2  TYR  51           HE2      TYR  51  -6.724  -1.512  -1.512
  417    HH   TYR  51           HH       TYR  51  -5.163   0.767   0.767
  418    H    ILE  52           H        ILE  52  -5.992  -0.337  -0.337
  419    HA   ILE  52           HA       ILE  52  -5.908   2.484   2.484
  420    HB   ILE  52           HB       ILE  52  -3.591   0.698   0.698
  421   1HG1  ILE  52          2HG1      ILE  52  -5.592  -0.802  -0.802
  422   2HG1  ILE  52          1HG1      ILE  52  -4.578  -0.526  -0.526
  423   1HG2  ILE  52          1HG2      ILE  52  -5.142   2.778   2.778
  424   2HG2  ILE  52          3HG2      ILE  52  -3.838   1.840   1.840
  425   3HG2  ILE  52          2HG2      ILE  52  -3.505   2.896   2.896
  426   1HD1  ILE  52          2HD1      ILE  52  -7.125   1.006   1.006
  427   2HD1  ILE  52          1HD1      ILE  52  -7.028  -0.380  -0.380
  428   3HD1  ILE  52          3HD1      ILE  52  -6.156   1.104   1.104
  429    H    LYS  53           H        LYS  53  -4.406   3.930   3.930
  430    HA   LYS  53           HA       LYS  53  -2.593   2.793   2.793
  431   1HB   LYS  53          2HB       LYS  53  -4.822   3.756   3.756
  432   2HB   LYS  53          1HB       LYS  53  -4.167   5.326   5.326
  433   1HG   LYS  53          2HG       LYS  53  -2.084   3.954   3.954
  434   2HG   LYS  53          1HG       LYS  53  -3.549   3.707   3.707
  435   1HD   LYS  53          2HD       LYS  53  -3.884   6.018   6.018
  436   2HD   LYS  53          1HD       LYS  53  -2.819   6.445   6.445
  437   1HE   LYS  53          2HE       LYS  53  -0.918   6.216   6.216
  438   2HE   LYS  53          1HE       LYS  53  -1.583   4.886   4.886
  439   1HZ   LYS  53          2HZ       LYS  53  -2.471   7.703   7.703
  440   2HZ   LYS  53          1HZ       LYS  53  -1.274   6.996   6.996
  441   3HZ   LYS  53          3HZ       LYS  53  -2.859   6.396   6.396
  442    H    THR  54           H        THR  54  -0.689   3.326   3.326
  443    HA   THR  54           HA       THR  54  -0.423   6.081   6.081
  444    HB   THR  54           HB       THR  54   1.482   3.740   3.740
  445    HG1  THR  54           HG1      THR  54  -0.378   3.166   3.166
  446   1HG2  THR  54          1HG2      THR  54   2.371   6.066   6.066
  447   2HG2  THR  54          3HG2      THR  54   1.194   6.259   6.259
  448   3HG2  THR  54          2HG2      THR  54   2.457   5.038   5.038
  449    H    SER  55           H        SER  55   1.240   7.462   7.462
  450    HA   SER  55           HA       SER  55   2.920   6.538   6.538
  451   1HB   SER  55          2HB       SER  55   2.245   8.982   8.982
  452   2HB   SER  55          1HB       SER  55   1.404   7.505   7.505
  453    HG   SER  55           HG       SER  55   0.701   9.227   9.227
  454    H    THR  56           H        THR  56   4.907   7.548   7.548
  455    HA   THR  56           HA       THR  56   5.464   9.541   9.541
  456    HB   THR  56           HB       THR  56   7.916   8.645   8.645
  457    HG1  THR  56           HG1      THR  56   6.243   6.429   6.429
  458   1HG2  THR  56          3HG2      THR  56   5.823   7.281   7.281
  459   2HG2  THR  56          2HG2      THR  56   7.530   6.838   6.838
  460   3HG2  THR  56          1HG2      THR  56   7.030   8.461   8.461
  461    H    THR  57           H        THR  57   6.887   8.550   8.550
  462    HA   THR  57           HA       THR  57   6.496  10.966  10.966
  463    HB   THR  57           HB       THR  57   7.969  12.051  12.051
  464    HG1  THR  57           HG1      THR  57   9.530  12.729  12.729
  465   1HG2  THR  57          2HG2      THR  57   8.986   9.912   9.912
  466   2HG2  THR  57          1HG2      THR  57  10.004   9.897   9.897
  467   3HG2  THR  57          3HG2      THR  57  10.156  11.205  11.205
  468    H    VAL  58           H        VAL  58   8.734   8.357   8.357
  469    HA   VAL  58           HA       VAL  58   8.955   7.757   7.757
  470    HB   VAL  58           HB       VAL  58  10.880   6.985   6.985
  471   1HG1  VAL  58          3HG1      VAL  58  10.697   6.480   6.480
  472   2HG1  VAL  58          2HG1      VAL  58  12.296   6.700   6.700
  473   3HG1  VAL  58          1HG1      VAL  58  11.245   5.406   5.406
  474   1HG2  VAL  58          2HG2      VAL  58  10.637   9.397   9.397
  475   2HG2  VAL  58          1HG2      VAL  58  11.478   9.183   9.183
  476   3HG2  VAL  58          3HG2      VAL  58  12.245   8.674   8.674
  477    H    ARG  59           H        ARG  59   7.689   6.703   6.703
  478    HA   ARG  59           HA       ARG  59   7.336   3.946   3.946
  479   1HB   ARG  59          2HB       ARG  59   8.785   4.055   4.055
  480   2HB   ARG  59          1HB       ARG  59   7.426   4.768   4.768
  481   1HG   ARG  59          2HG       ARG  59   6.161   2.812   2.812
  482   2HG   ARG  59          1HG       ARG  59   7.025   2.198   2.198
  483   1HD   ARG  59          2HD       ARG  59   8.571   2.609   2.609
  484   2HD   ARG  59          1HD       ARG  59   7.501   1.211   1.211
  485    HE   ARG  59           HE       ARG  59  10.005   1.549   1.549
  486   1HH1  ARG  59          1HH2      ARG  59   8.934   1.014   1.014
  487   2HH1  ARG  59          2HH2      ARG  59   8.448  -0.649  -0.649
  488   1HH2  ARG  59          2HH1      ARG  59   8.483  -0.978  -0.978
  489   2HH2  ARG  59          1HH1      ARG  59   8.193  -1.776  -1.776
  490    H    THR  60           H        THR  60   5.258   2.930   2.930
  491    HA   THR  60           HA       THR  60   3.165   4.700   4.700
  492    HB   THR  60           HB       THR  60   2.925   3.628   3.628
  493    HG1  THR  60           HG1      THR  60   3.081   5.911   5.911
  494   1HG2  THR  60          1HG2      THR  60   1.202   5.288   5.288
  495   2HG2  THR  60          3HG2      THR  60   1.026   5.408   5.408
  496   3HG2  THR  60          2HG2      THR  60   0.758   3.864   3.864
  497    H    THR  61           H        THR  61   2.633   3.123   3.123
  498    HA   THR  61           HA       THR  61   2.349   0.314   0.314
  499    HB   THR  61           HB       THR  61   1.129   1.107   1.107
  500    HG1  THR  61           HG1      THR  61   2.893   1.973   1.973
  501   1HG2  THR  61          1HG2      THR  61   2.008  -1.176  -1.176
  502   2HG2  THR  61          3HG2      THR  61   3.595  -0.561  -0.561
  503   3HG2  THR  61          2HG2      THR  61   2.328  -0.737  -0.737
  504    H    GLU  62           H        GLU  62   0.321  -0.855  -0.855
  505    HA   GLU  62           HA       GLU  62  -2.185   0.669   0.669
  506   1HB   GLU  62          2HB       GLU  62  -0.937  -0.095  -0.095
  507   2HB   GLU  62          1HB       GLU  62  -2.639  -0.525  -0.525
  508   1HG   GLU  62          2HG       GLU  62  -3.174   1.798   1.798
  509   2HG   GLU  62          1HG       GLU  62  -1.473   2.233   2.233
  510    H    ILE  63           H        ILE  63  -2.920  -0.781  -0.781
  511    HA   ILE  63           HA       ILE  63  -3.013  -3.669  -3.669
  512    HB   ILE  63           HB       ILE  63  -3.304  -4.219  -4.219
  513   1HG1  ILE  63          2HG1      ILE  63  -3.439  -1.224  -1.224
  514   2HG1  ILE  63          1HG1      ILE  63  -4.800  -2.340  -2.340
  515   1HG2  ILE  63          1HG2      ILE  63  -1.025  -3.427  -3.427
  516   2HG2  ILE  63          3HG2      ILE  63  -1.261  -2.020  -2.020
  517   3HG2  ILE  63          2HG2      ILE  63  -1.182  -3.633  -3.633
  518   1HD1  ILE  63          2HD1      ILE  63  -2.615  -3.374  -3.374
  519   2HD1  ILE  63          1HD1      ILE  63  -3.003  -1.728  -1.728
  520   3HD1  ILE  63          3HD1      ILE  63  -4.257  -2.968  -2.968
  521    H    ASN  64           H        ASN  64  -5.110  -4.801  -4.801
  522    HA   ASN  64           HA       ASN  64  -7.497  -3.149  -3.149
  523   1HB   ASN  64          2HB       ASN  64  -8.512  -3.567  -3.567
  524   2HB   ASN  64          1HB       ASN  64  -6.891  -2.961  -2.961
  525   1HD2  ASN  64          2HD2      ASN  64  -7.792  -6.841  -6.841
  526   2HD2  ASN  64          1HD2      ASN  64  -8.799  -5.962  -5.962
  527    H    PHE  65           H        PHE  65  -9.129  -4.375  -4.375
  528    HA   PHE  65           HA       PHE  65  -9.246  -7.284  -7.284
  529   1HB   PHE  65          2HB       PHE  65  -8.676  -7.889  -7.889
  530   2HB   PHE  65          1HB       PHE  65  -7.344  -7.006  -7.006
  531    HD1  PHE  65           HD2      PHE  65  -6.916  -4.632  -4.632
  532    HD2  PHE  65           HD1      PHE  65  -9.962  -6.938  -6.938
  533    HE1  PHE  65           HE2      PHE  65  -7.089  -2.902  -2.902
  534    HE2  PHE  65           HE1      PHE  65 -10.148  -5.214  -5.214
  535    HZ   PHE  65           HZ       PHE  65  -8.715  -3.187  -3.187
  536    H    LYS  66           H        LYS  66 -10.611  -8.178  -8.178
  537    HA   LYS  66           HA       LYS  66 -12.943  -6.373  -6.373
  538   1HB   LYS  66          2HB       LYS  66 -14.362  -8.501  -8.501
  539   2HB   LYS  66          1HB       LYS  66 -13.763  -7.899  -7.899
  540   1HG   LYS  66          2HG       LYS  66 -11.815  -9.490  -9.490
  541   2HG   LYS  66          1HG       LYS  66 -12.620 -10.176 -10.176
  542   1HD   LYS  66          2HD       LYS  66 -13.503 -11.583 -11.583
  543   2HD   LYS  66          1HD       LYS  66 -14.673 -10.271 -10.271
  544   1HE   LYS  66          2HE       LYS  66 -12.181 -10.022 -10.022
  545   2HE   LYS  66          1HE       LYS  66 -13.333 -11.255 -11.255
  546   1HZ   LYS  66          3HZ       LYS  66 -15.051  -9.391  -9.391
  547   2HZ   LYS  66          2HZ       LYS  66 -13.717  -8.339  -8.339
  548   3HZ   LYS  66          1HZ       LYS  66 -14.040  -9.366  -9.366
  549    H    VAL  67           H        VAL  67 -13.999  -6.834  -6.834
  550    HA   VAL  67           HA       VAL  67 -12.059  -7.874  -7.874
  551    HB   VAL  67           HB       VAL  67 -14.768  -7.220  -7.220
  552   1HG1  VAL  67          2HG1      VAL  67 -11.892  -6.709  -6.709
  553   2HG1  VAL  67          1HG1      VAL  67 -13.143  -5.702  -5.702
  554   3HG1  VAL  67          3HG1      VAL  67 -13.159  -7.447  -7.447
  555   1HG2  VAL  67          1HG2      VAL  67 -13.180  -5.282  -5.282
  556   2HG2  VAL  67          3HG2      VAL  67 -14.927  -5.414  -5.414
  557   3HG2  VAL  67          2HG2      VAL  67 -13.949  -4.692  -4.692
  558    H    GLY  68           H        GLY  68 -11.965 -10.133 -10.133
  559   1HA   GLY  68          2HA       GLY  68 -13.378 -11.895 -11.895
  560   2HA   GLY  68          1HA       GLY  68 -14.517 -11.642 -11.642
  561    H    GLU  69           H        GLU  69 -12.170 -11.296 -11.296
  562    HA   GLU  69           HA       GLU  69 -11.413 -14.194 -14.194
  563   1HB   GLU  69          2HB       GLU  69 -12.019 -12.325 -12.325
  564   2HB   GLU  69          1HB       GLU  69 -11.568 -14.025 -14.025
  565   1HG   GLU  69          2HG       GLU  69 -13.887 -13.366 -13.366
  566   2HG   GLU  69          1HG       GLU  69 -14.132 -13.240 -13.240
  567    H    GLU  70           H        GLU  70  -9.358 -14.631 -14.631
  568    HA   GLU  70           HA       GLU  70  -7.348 -12.565 -12.565
  569   1HB   GLU  70          2HB       GLU  70  -6.998 -15.358 -15.358
  570   2HB   GLU  70          1HB       GLU  70  -5.719 -14.325 -14.325
  571   1HG   GLU  70          2HG       GLU  70  -6.131 -15.522 -15.522
  572   2HG   GLU  70          1HG       GLU  70  -7.388 -14.302 -14.302
  573    H    PHE  71           H        PHE  71  -5.585 -12.216 -12.216
  574    HA   PHE  71           HA       PHE  71  -6.355 -12.523 -12.523
  575   1HB   PHE  71          2HB       PHE  71  -6.371 -10.033 -10.033
  576   2HB   PHE  71          1HB       PHE  71  -7.753 -10.613 -10.613
  577    HD1  PHE  71           HD2      PHE  71  -7.670 -10.447 -10.447
  578    HD2  PHE  71           HD1      PHE  71  -4.873  -8.439  -8.439
  579    HE1  PHE  71           HE2      PHE  71  -7.050  -8.931  -8.931
  580    HE2  PHE  71           HE1      PHE  71  -4.252  -6.921  -6.921
  581    HZ   PHE  71           HZ       PHE  71  -5.336  -7.167  -7.167
  582    H    GLU  72           H        GLU  72  -4.727 -11.183 -11.183
  583    HA   GLU  72           HA       GLU  72  -2.069 -11.413 -11.413
  584   1HB   GLU  72          2HB       GLU  72  -2.378 -11.067 -11.067
  585   2HB   GLU  72          1HB       GLU  72  -1.078 -11.835 -11.835
  586   1HG   GLU  72          2HG       GLU  72  -2.674 -13.660 -13.660
  587   2HG   GLU  72          1HG       GLU  72  -3.868 -12.938 -12.938
  588    H    GLU  73           H        GLU  73  -0.682  -9.638  -9.638
  589    HA   GLU  73           HA       GLU  73  -1.350  -7.183  -7.183
  590   1HB   GLU  73          2HB       GLU  73  -1.561  -5.815  -5.815
  591   2HB   GLU  73          1HB       GLU  73  -2.905  -6.931  -6.931
  592   1HG   GLU  73          2HG       GLU  73  -2.342  -8.200  -8.200
  593   2HG   GLU  73          1HG       GLU  73  -0.611  -8.038  -8.038
  594    H    GLN  74           H        GLN  74   0.181  -5.369  -5.369
  595    HA   GLN  74           HA       GLN  74   2.876  -6.673  -6.673
  596   1HB   GLN  74          2HB       GLN  74   1.972  -3.834  -3.834
  597   2HB   GLN  74          1HB       GLN  74   3.667  -4.260  -4.260
  598   1HG   GLN  74          2HG       GLN  74   1.897  -5.647  -5.647
  599   2HG   GLN  74          1HG       GLN  74   2.893  -4.247  -4.247
  600   1HE2  GLN  74          2HE2      GLN  74   5.882  -6.110  -6.110
  601   2HE2  GLN  74          1HE2      GLN  74   5.124  -4.604  -4.604
  602    H    THR  75           H        THR  75   4.421  -5.905  -5.905
  603    HA   THR  75           HA       THR  75   3.049  -5.304  -5.304
  604    HB   THR  75           HB       THR  75   4.677  -7.231  -7.231
  605    HG1  THR  75           HG1      THR  75   4.134  -6.208  -6.208
  606   1HG2  THR  75          2HG2      THR  75   6.355  -5.169  -5.169
  607   2HG2  THR  75          1HG2      THR  75   7.073  -5.749  -5.749
  608   3HG2  THR  75          3HG2      THR  75   6.731  -6.879  -6.879
  609    H    VAL  76           H        VAL  76   5.787  -4.130  -4.130
  610    HA   VAL  76           HA       VAL  76   5.247  -1.404  -1.404
  611    HB   VAL  76           HB       VAL  76   6.609  -2.166  -2.166
  612   1HG1  VAL  76          1HG1      VAL  76   5.714   0.413   0.413
  613   2HG1  VAL  76          3HG1      VAL  76   5.836   0.274   0.274
  614   3HG1  VAL  76          2HG1      VAL  76   7.265   0.030   0.030
  615   1HG2  VAL  76          1HG2      VAL  76   3.738  -1.375  -1.375
  616   2HG2  VAL  76          3HG2      VAL  76   4.294  -2.925  -2.925
  617   3HG2  VAL  76          2HG2      VAL  76   4.442  -1.468  -1.468
  618    H    ASP  77           H        ASP  77   7.693  -3.863  -3.863
  619    HA   ASP  77           HA       ASP  77   9.883  -1.985  -1.985
  620   1HB   ASP  77          2HB       ASP  77   9.871  -4.307  -4.307
  621   2HB   ASP  77          1HB       ASP  77  10.285  -4.914  -4.914
  622    H    GLY  78           H        GLY  78   8.054  -4.516  -4.516
  623   1HA   GLY  78          2HA       GLY  78   7.636  -3.821  -3.821
  624   2HA   GLY  78          1HA       GLY  78   9.396  -3.810  -3.810
  625    H    ARG  79           H        ARG  79   7.235  -6.083  -6.083
  626    HA   ARG  79           HA       ARG  79   8.239  -8.252  -8.252
  627   1HB   ARG  79          2HB       ARG  79   8.276  -8.001  -8.001
  628   2HB   ARG  79          1HB       ARG  79   7.949  -9.588  -9.588
  629   1HG   ARG  79          2HG       ARG  79  10.178  -8.251  -8.251
  630   2HG   ARG  79          1HG       ARG  79  10.468  -8.452  -8.452
  631   1HD   ARG  79          2HD       ARG  79   9.324 -10.806 -10.806
  632   2HD   ARG  79          1HD       ARG  79  10.987 -10.392 -10.392
  633    HE   ARG  79           HE       ARG  79  10.083 -10.933 -10.933
  634   1HH1  ARG  79          1HH2      ARG  79  12.641  -9.728  -9.728
  635   2HH1  ARG  79          2HH2      ARG  79  13.771 -11.014 -11.014
  636   1HH2  ARG  79          2HH1      ARG  79  11.432 -13.131 -13.131
  637   2HH2  ARG  79          1HH1      ARG  79  13.087 -12.940 -12.940
  638    HA   PRO  80           HA       PRO  80   3.920  -9.230  -9.230
  639   1HB   PRO  80          2HB       PRO  80   4.078 -11.868 -11.868
  640   2HB   PRO  80          1HB       PRO  80   4.379 -10.505 -10.505
  641   1HG   PRO  80          2HG       PRO  80   6.331 -12.381 -12.381
  642   2HG   PRO  80          1HG       PRO  80   6.469 -11.452 -11.452
  643   1HD   PRO  80          2HD       PRO  80   7.680 -10.800 -10.800
  644   2HD   PRO  80          1HD       PRO  80   7.545  -9.731  -9.731
  645    H    CYS  81           H        CYS  81   2.355 -10.058 -10.058
  646    HA   CYS  81           HA       CYS  81   2.863 -12.341 -12.341
  647   1HB   CYS  81          2HB       CYS  81   2.450 -11.011 -11.011
  648   2HB   CYS  81          1HB       CYS  81   4.015 -10.713 -10.713
  649    HG   CYS  81           HG       CYS  81   2.000  -8.707  -8.707
  650    H    LYS  82           H        LYS  82   0.927 -13.211 -13.211
  651    HA   LYS  82           HA       LYS  82  -1.539 -11.960 -11.960
  652   1HB   LYS  82          2HB       LYS  82  -1.149 -14.370 -14.370
  653   2HB   LYS  82          1HB       LYS  82  -1.090 -14.646 -14.646
  654   1HG   LYS  82          2HG       LYS  82  -3.437 -13.486 -13.486
  655   2HG   LYS  82          1HG       LYS  82  -3.433 -13.931 -13.931
  656   1HD   LYS  82          2HD       LYS  82  -2.690 -16.004 -16.004
  657   2HD   LYS  82          1HD       LYS  82  -4.393 -15.606 -15.606
  658   1HE   LYS  82          2HE       LYS  82  -2.918 -15.982 -15.982
  659   2HE   LYS  82          1HE       LYS  82  -3.002 -17.429 -17.429
  660   1HZ   LYS  82          2HZ       LYS  82  -5.397 -15.784 -15.784
  661   2HZ   LYS  82          1HZ       LYS  82  -4.903 -16.998 -16.998
  662   3HZ   LYS  82          3HZ       LYS  82  -5.313 -17.401 -17.401
  663    H    SER  83           H        SER  83  -2.480 -10.527 -10.527
  664    HA   SER  83           HA       SER  83  -2.106 -10.814 -10.814
  665   1HB   SER  83          2HB       SER  83  -1.724  -8.669  -8.669
  666   2HB   SER  83          1HB       SER  83  -3.455  -8.482  -8.482
  667    HG   SER  83           HG       SER  83  -1.796  -7.599  -7.599
  668    H    LEU  84           H        LEU  84  -4.155  -9.992  -9.992
  669    HA   LEU  84           HA       LEU  84  -6.700 -10.771 -10.771
  670   1HB   LEU  84          2HB       LEU  84  -5.961 -12.915 -12.915
  671   2HB   LEU  84          1HB       LEU  84  -5.572 -12.155 -12.155
  672    HG   LEU  84           HG       LEU  84  -7.942 -11.650 -11.650
  673   1HD1  LEU  84          3HD1      LEU  84  -8.203 -11.916 -11.916
  674   2HD1  LEU  84          2HD1      LEU  84  -9.015 -13.344 -13.344
  675   3HD1  LEU  84          1HD1      LEU  84  -9.523 -11.739 -11.739
  676   1HD2  LEU  84          1HD2      LEU  84  -7.046 -14.440 -14.440
  677   2HD2  LEU  84          3HD2      LEU  84  -7.469 -13.702 -13.702
  678   3HD2  LEU  84          2HD2      LEU  84  -8.739 -14.173 -14.173
  679    H    VAL  85           H        VAL  85  -8.524  -9.898  -9.898
  680    HA   VAL  85           HA       VAL  85  -7.701  -8.101  -8.101
  681    HB   VAL  85           HB       VAL  85  -9.474  -7.110  -7.110
  682   1HG1  VAL  85          2HG1      VAL  85  -7.827  -5.746  -5.746
  683   2HG1  VAL  85          1HG1      VAL  85  -8.787  -4.917  -4.917
  684   3HG1  VAL  85          3HG1      VAL  85  -9.583  -5.917  -5.917
  685   1HG2  VAL  85          3HG2      VAL  85  -6.492  -7.225  -7.225
  686   2HG2  VAL  85          2HG2      VAL  85  -7.545  -7.332  -7.332
  687   3HG2  VAL  85          1HG2      VAL  85  -7.230  -5.768  -5.768
  688    H    LYS  86           H        LYS  86  -9.099  -8.171  -8.171
  689    HA   LYS  86           HA       LYS  86 -11.934  -8.933  -8.933
  690   1HB   LYS  86          2HB       LYS  86 -11.711  -9.805  -9.805
  691   2HB   LYS  86          1HB       LYS  86 -11.284 -10.848 -10.848
  692   1HG   LYS  86          2HG       LYS  86  -8.920 -10.297 -10.297
  693   2HG   LYS  86          1HG       LYS  86  -9.316  -9.129  -9.129
  694   1HD   LYS  86          2HD       LYS  86  -8.748 -10.987 -10.987
  695   2HD   LYS  86          1HD       LYS  86 -10.492 -11.203 -11.203
  696   1HE   LYS  86          2HE       LYS  86 -10.286 -12.988 -12.988
  697   2HE   LYS  86          1HE       LYS  86  -8.807 -12.365 -12.365
  698   1HZ   LYS  86          3HZ       LYS  86  -7.608 -12.956 -12.956
  699   2HZ   LYS  86          2HZ       LYS  86  -9.034 -13.565 -13.565
  700   3HZ   LYS  86          1HZ       LYS  86  -8.362 -14.318 -14.318
  701    H    TRP  87           H        TRP  87 -13.383  -8.047  -8.047
  702    HA   TRP  87           HA       TRP  87 -12.521  -5.293  -5.293
  703   1HB   TRP  87          2HB       TRP  87 -15.101  -6.813  -6.813
  704   2HB   TRP  87          1HB       TRP  87 -14.879  -5.205  -5.205
  705    HD1  TRP  87           HD1      TRP  87 -15.726  -6.997  -6.997
  706    HE1  TRP  87           HE1      TRP  87 -15.932  -5.360  -5.360
  707    HE3  TRP  87           HE3      TRP  87 -13.682  -2.846  -2.846
  708    HZ2  TRP  87           HZ2      TRP  87 -15.307  -2.632  -2.632
  709    HZ3  TRP  87           HZ3      TRP  87 -13.473  -0.742  -0.742
  710    HH2  TRP  87           HH2      TRP  87 -14.281  -0.638  -0.638
  711    H    GLU  88           H        GLU  88 -13.060  -4.441  -4.441
  712    HA   GLU  88           HA       GLU  88 -12.463  -6.401  -6.401
  713   1HB   GLU  88          2HB       GLU  88 -10.466  -4.930  -4.930
  714   2HB   GLU  88          1HB       GLU  88 -11.317  -3.616  -3.616
  715   1HG   GLU  88          2HG       GLU  88  -9.779  -4.541  -4.541
  716   2HG   GLU  88          1HG       GLU  88 -11.404  -5.029  -5.029
  717    H    SER  89           H        SER  89 -13.492  -3.151  -3.151
  718    HA   SER  89           HA       SER  89 -15.590  -3.251  -3.251
  719   1HB   SER  89          2HB       SER  89 -15.147  -0.937  -0.937
  720   2HB   SER  89          1HB       SER  89 -13.623  -1.813  -1.813
  721    HG   SER  89           HG       SER  89 -14.078   0.318   0.318
  722    H    GLU  90           H        GLU  90 -16.529  -0.580  -0.580
  723    HA   GLU  90           HA       GLU  90 -18.021  -1.427  -1.427
  724   1HB   GLU  90          2HB       GLU  90 -19.065   0.836   0.836
  725   2HB   GLU  90          1HB       GLU  90 -19.130  -0.063  -0.063
  726   1HG   GLU  90          2HG       GLU  90 -16.671   1.317   1.317
  727   2HG   GLU  90          1HG       GLU  90 -17.837   2.476   2.476
  728    H    ASN  91           H        ASN  91 -15.166   0.519   0.519
  729    HA   ASN  91           HA       ASN  91 -14.919   0.837   0.837
  730   1HB   ASN  91          2HB       ASN  91 -14.380   3.128   3.128
  731   2HB   ASN  91          1HB       ASN  91 -14.388   3.166   3.166
  732   1HD2  ASN  91          2HD2      ASN  91 -17.751   4.096   4.096
  733   2HD2  ASN  91          1HD2      ASN  91 -16.186   4.270   4.270
  734    H    LYS  92           H        LYS  92 -13.500  -0.825  -0.825
  735    HA   LYS  92           HA       LYS  92 -10.769   0.161   0.161
  736   1HB   LYS  92          2HB       LYS  92 -11.268   0.742   0.742
  737   2HB   LYS  92          1HB       LYS  92 -11.651  -0.946  -0.946
  738   1HG   LYS  92          2HG       LYS  92  -9.216  -1.299  -1.299
  739   2HG   LYS  92          1HG       LYS  92  -9.005   0.343   0.343
  740   1HD   LYS  92          2HD       LYS  92  -9.737  -0.376  -0.376
  741   2HD   LYS  92          1HD       LYS  92  -9.952  -2.022  -2.022
  742   1HE   LYS  92          2HE       LYS  92  -7.319  -0.532  -0.532
  743   2HE   LYS  92          1HE       LYS  92  -7.753  -1.620  -1.620
  744   1HZ   LYS  92          2HZ       LYS  92  -8.256  -3.255  -3.255
  745   2HZ   LYS  92          1HZ       LYS  92  -7.243  -2.243  -2.243
  746   3HZ   LYS  92          3HZ       LYS  92  -6.645  -3.008  -3.008
  747    H    MET  93           H        MET  93 -10.067  -1.398  -1.398
  748    HA   MET  93           HA       MET  93 -10.705  -4.240  -4.240
  749   1HB   MET  93          2HB       MET  93 -10.109  -4.590  -4.590
  750   2HB   MET  93          1HB       MET  93 -11.705  -4.000  -4.000
  751   1HG   MET  93          2HG       MET  93 -11.255  -1.834  -1.834
  752   2HG   MET  93          1HG       MET  93  -9.517  -2.024  -2.024
  753   1HE   MET  93          3HE       MET  93 -12.554  -3.411  -3.411
  754   2HE   MET  93          2HE       MET  93 -12.399  -2.057  -2.057
  755   3HE   MET  93          1HE       MET  93 -12.185  -3.702  -3.702
  756    H    VAL  94           H        VAL  94  -9.064  -5.804  -5.804
  757    HA   VAL  94           HA       VAL  94  -6.306  -4.694  -4.694
  758    HB   VAL  94           HB       VAL  94  -7.125  -7.503  -7.503
  759   1HG1  VAL  94          1HG1      VAL  94  -4.780  -5.757  -5.757
  760   2HG1  VAL  94          3HG1      VAL  94  -5.221  -6.665  -6.665
  761   3HG1  VAL  94          2HG1      VAL  94  -4.875  -7.513  -7.513
  762   1HG2  VAL  94          1HG2      VAL  94  -7.425  -4.990  -4.990
  763   2HG2  VAL  94          3HG2      VAL  94  -8.648  -6.215  -6.215
  764   3HG2  VAL  94          2HG2      VAL  94  -7.297  -6.590  -6.590
  765    H    CYS  95           H        CYS  95  -4.598  -6.323  -6.323
  766    HA   CYS  95           HA       CYS  95  -5.630  -7.792  -7.792
  767   1HB   CYS  95          2HB       CYS  95  -5.195  -5.440  -5.440
  768   2HB   CYS  95          1HB       CYS  95  -3.520  -5.628  -5.628
  769    HG   CYS  95           HG       CYS  95  -4.598  -6.542  -6.542
  770    H    GLU  96           H        GLU  96  -4.472  -9.611  -9.611
  771    HA   GLU  96           HA       GLU  96  -1.882  -9.945  -9.945
  772   1HB   GLU  96          2HB       GLU  96  -3.522 -12.097 -12.097
  773   2HB   GLU  96          1HB       GLU  96  -2.228 -12.317 -12.317
  774   1HG   GLU  96          2HG       GLU  96  -4.365 -10.617 -10.617
  775   2HG   GLU  96          1HG       GLU  96  -4.966 -12.202 -12.202
  776    H    GLN  97           H        GLN  97  -0.169 -11.193 -11.193
  777    HA   GLN  97           HA       GLN  97  -0.526 -11.058 -11.058
  778   1HB   GLN  97          2HB       GLN  97   0.077  -8.695  -8.695
  779   2HB   GLN  97          1HB       GLN  97   1.706  -9.360  -9.360
  780   1HG   GLN  97          2HG       GLN  97   1.138 -10.028 -10.028
  781   2HG   GLN  97          1HG       GLN  97  -0.195  -8.887  -8.887
  782   1HE2  GLN  97          2HE2      GLN  97   1.865  -6.049  -6.049
  783   2HE2  GLN  97          1HE2      GLN  97   0.289  -6.666  -6.666
  784    H    LYS  98           H        LYS  98   0.856 -12.377 -12.377
  785    HA   LYS  98           HA       LYS  98   3.364 -13.278 -13.278
  786   1HB   LYS  98          2HB       LYS  98   2.779 -15.663 -15.663
  787   2HB   LYS  98          1HB       LYS  98   1.715 -14.945 -14.945
  788   1HG   LYS  98          2HG       LYS  98   0.004 -14.531 -14.531
  789   2HG   LYS  98          1HG       LYS  98   1.071 -15.154 -15.154
  790   1HD   LYS  98          2HD       LYS  98   1.157 -17.321 -17.321
  791   2HD   LYS  98          1HD       LYS  98  -0.230 -16.671 -16.671
  792   1HE   LYS  98          2HE       LYS  98  -1.389 -17.757 -17.757
  793   2HE   LYS  98          1HE       LYS  98  -1.078 -16.254 -16.254
  794   1HZ   LYS  98          1HZ       LYS  98   0.819 -18.521 -18.521
  795   2HZ   LYS  98          3HZ       LYS  98  -0.478 -18.409 -18.409
  796   3HZ   LYS  98          2HZ       LYS  98   0.712 -17.197 -17.197
  797    H    LEU  99           H        LEU  99   4.897 -14.042 -14.042
  798    HA   LEU  99           HA       LEU  99   4.710 -12.753 -12.753
  799   1HB   LEU  99          2HB       LEU  99   6.372 -15.108 -15.108
  800   2HB   LEU  99          1HB       LEU  99   6.585 -14.295 -14.295
  801    HG   LEU  99           HG       LEU  99   6.533 -12.578 -12.578
  802   1HD1  LEU  99          3HD1      LEU  99   8.793 -14.450 -14.450
  803   2HD1  LEU  99          2HD1      LEU  99   9.010 -13.035 -13.035
  804   3HD1  LEU  99          1HD1      LEU  99   7.957 -14.352 -14.352
  805   1HD2  LEU  99          3HD2      LEU  99   7.943 -12.678 -12.678
  806   2HD2  LEU  99          2HD2      LEU  99   6.840 -11.444 -11.444
  807   3HD2  LEU  99          1HD2      LEU  99   8.469 -11.575 -11.575
  808    H    LEU 100           H        LEU 100   4.829 -13.894 -13.894
  809    HA   LEU 100           HA       LEU 100   2.725 -15.973 -15.973
  810   1HB   LEU 100          2HB       LEU 100   3.930 -14.057 -14.057
  811   2HB   LEU 100          1HB       LEU 100   2.926 -15.418 -15.418
  812    HG   LEU 100           HG       LEU 100   1.985 -13.479 -13.479
  813   1HD1  LEU 100          1HD1      LEU 100   2.157 -13.124 -13.124
  814   2HD1  LEU 100          3HD1      LEU 100   0.642 -12.650 -12.650
  815   3HD1  LEU 100          2HD1      LEU 100   2.160 -11.911 -11.911
  816   1HD2  LEU 100          2HD2      LEU 100   0.792 -15.595 -15.595
  817   2HD2  LEU 100          1HD2      LEU 100   0.569 -15.338 -15.338
  818   3HD2  LEU 100          3HD2      LEU 100  -0.225 -14.272 -14.272
  819    H    LYS 101           H        LYS 101   6.102 -15.695 -15.695
  820    HA   LYS 101           HA       LYS 101   6.400 -18.447 -18.447
  821   1HB   LYS 101          2HB       LYS 101   6.799 -16.561 -16.561
  822   2HB   LYS 101          1HB       LYS 101   8.378 -16.482 -16.482
  823   1HG   LYS 101          2HG       LYS 101   7.351 -19.209 -19.209
  824   2HG   LYS 101          1HG       LYS 101   7.799 -18.241 -18.241
  825   1HD   LYS 101          2HD       LYS 101   9.705 -18.202 -18.202
  826   2HD   LYS 101          1HD       LYS 101   9.587 -19.719 -19.719
  827   1HE   LYS 101          2HE       LYS 101   9.996 -18.511 -18.511
  828   2HE   LYS 101          1HE       LYS 101  10.118 -16.994 -16.994
  829   1HZ   LYS 101          1HZ       LYS 101  11.915 -18.182 -18.182
  830   2HZ   LYS 101          3HZ       LYS 101  11.934 -19.322 -19.322
  831   3HZ   LYS 101          2HZ       LYS 101  12.305 -17.697 -17.697
  832    H    GLY 102           H        GLY 102   8.016 -19.508 -19.508
  833   1HA   GLY 102          2HA       GLY 102   9.696 -19.843 -19.843
  834   2HA   GLY 102          1HA       GLY 102  10.276 -18.222 -18.222
  835    H    GLU 103           H        GLU 103  10.632 -17.953 -17.953
  836    HA   GLU 103           HA       GLU 103   8.502 -16.534 -16.534
  837   1HB   GLU 103          2HB       GLU 103   7.596 -18.828 -18.828
  838   2HB   GLU 103          1HB       GLU 103   9.071 -19.285 -19.285
  839   1HG   GLU 103          2HG       GLU 103   8.613 -17.830 -17.830
  840   2HG   GLU 103          1HG       GLU 103   7.396 -16.942 -16.942
  841    H    GLY 104           H        GLY 104   9.286 -15.365 -15.365
  842   1HA   GLY 104          2HA       GLY 104  11.765 -16.115 -16.115
  843   2HA   GLY 104          1HA       GLY 104  11.898 -14.679 -14.679
  844    HA   PRO 105           HA       PRO 105  10.075 -12.436 -12.436
  845   1HB   PRO 105          2HB       PRO 105   9.260 -10.189 -10.189
  846   2HB   PRO 105          1HB       PRO 105  10.956 -10.527 -10.527
  847   1HG   PRO 105          2HG       PRO 105   9.577 -10.663 -10.663
  848   2HG   PRO 105          1HG       PRO 105  11.302 -10.470 -10.470
  849   1HD   PRO 105          2HD       PRO 105   9.971 -12.878 -12.878
  850   2HD   PRO 105          1HD       PRO 105  11.663 -12.714 -12.714
  851    H    LYS 106           H        LYS 106   7.902 -11.000 -11.000
  852    HA   LYS 106           HA       LYS 106   5.636 -12.284 -12.284
  853   1HB   LYS 106          2HB       LYS 106   5.937 -13.481 -13.481
  854   2HB   LYS 106          1HB       LYS 106   5.910 -11.947 -11.947
  855   1HG   LYS 106          2HG       LYS 106   3.633 -11.547 -11.547
  856   2HG   LYS 106          1HG       LYS 106   3.635 -12.861 -12.861
  857   1HD   LYS 106          2HD       LYS 106   2.670 -14.015 -14.015
  858   2HD   LYS 106          1HD       LYS 106   4.354 -14.242 -14.242
  859   1HE   LYS 106          2HE       LYS 106   3.240 -13.445 -13.445
  860   2HE   LYS 106          1HE       LYS 106   4.130 -12.062 -12.062
  861   1HZ   LYS 106          3HZ       LYS 106   1.928 -11.646 -11.646
  862   2HZ   LYS 106          2HZ       LYS 106   1.242 -12.600 -12.600
  863   3HZ   LYS 106          1HZ       LYS 106   2.064 -11.167 -11.167
  864    H    THR 107           H        THR 107   4.048 -10.766 -10.766
  865    HA   THR 107           HA       THR 107   4.365  -8.064  -8.064
  866    HB   THR 107           HB       THR 107   3.143  -7.546  -7.546
  867    HG1  THR 107           HG1      THR 107   3.626  -9.807  -9.807
  868   1HG2  THR 107          2HG2      THR 107   5.303  -6.667  -6.667
  869   2HG2  THR 107          1HG2      THR 107   6.123  -7.650  -7.650
  870   3HG2  THR 107          3HG2      THR 107   5.053  -6.340  -6.340
  871    H    SER 108           H        SER 108   2.542  -6.933  -6.933
  872    HA   SER 108           HA       SER 108  -0.148  -7.827  -7.827
  873   1HB   SER 108          2HB       SER 108  -0.768  -8.138  -8.138
  874   2HB   SER 108          1HB       SER 108   0.201  -9.435  -9.435
  875    HG   SER 108           HG       SER 108   0.914  -8.578  -8.578
  876    H    TRP 109           H        TRP 109  -1.453  -5.960  -5.960
  877    HA   TRP 109           HA       TRP 109  -0.484  -3.751  -3.751
  878   1HB   TRP 109          2HB       TRP 109  -1.019  -2.123  -2.123
  879   2HB   TRP 109          1HB       TRP 109   0.408  -3.117  -3.117
  880    HD1  TRP 109           HD1      TRP 109   0.368  -4.853  -4.853
  881    HE1  TRP 109           HE1      TRP 109  -1.267  -5.279  -5.279
  882    HE3  TRP 109           HE3      TRP 109  -3.618  -2.067  -2.067
  883    HZ2  TRP 109           HZ2      TRP 109  -3.913  -4.535  -4.535
  884    HZ3  TRP 109           HZ3      TRP 109  -5.675  -1.941  -1.941
  885    HH2  TRP 109           HH2      TRP 109  -5.830  -3.169  -3.169
  886    H    THR 110           H        THR 110  -2.147  -1.958  -1.958
  887    HA   THR 110           HA       THR 110  -4.922  -3.036  -3.036
  888    HB   THR 110           HB       THR 110  -5.506  -2.384  -2.384
  889    HG1  THR 110           HG1      THR 110  -4.617  -0.659  -0.659
  890   1HG2  THR 110          2HG2      THR 110  -3.521  -4.266  -4.266
  891   2HG2  THR 110          1HG2      THR 110  -2.842  -3.249  -3.249
  892   3HG2  THR 110          3HG2      THR 110  -4.407  -4.026  -4.026
  893    H    MET 111           H        MET 111  -6.544  -1.211  -1.211
  894    HA   MET 111           HA       MET 111  -5.606   1.511   1.511
  895   1HB   MET 111          2HB       MET 111  -7.085   1.691   1.691
  896   2HB   MET 111          1HB       MET 111  -5.713   0.610   0.610
  897   1HG   MET 111          2HG       MET 111  -7.032  -1.295  -1.295
  898   2HG   MET 111          1HG       MET 111  -8.285  -0.536  -0.536
  899   1HE   MET 111          3HE       MET 111  -7.787  -2.184  -2.184
  900   2HE   MET 111          2HE       MET 111  -8.356  -1.306  -1.306
  901   3HE   MET 111          1HE       MET 111  -6.766  -0.948  -0.948
  902    H    GLU 112           H        GLU 112  -7.008   2.958   2.958
  903    HA   GLU 112           HA       GLU 112  -9.680   1.906   1.906
  904   1HB   GLU 112          2HB       GLU 112  -7.994   1.967   1.967
  905   2HB   GLU 112          1HB       GLU 112  -7.907   3.715   3.715
  906   1HG   GLU 112          2HG       GLU 112 -10.005   4.069   4.069
  907   2HG   GLU 112          1HG       GLU 112 -10.626   2.532   2.532
  908    H    LEU 113           H        LEU 113 -11.334   3.517   3.517
  909    HA   LEU 113           HA       LEU 113 -10.691   6.063   6.063
  910   1HB   LEU 113          2HB       LEU 113 -12.497   4.094   4.094
  911   2HB   LEU 113          1HB       LEU 113 -13.517   5.203   5.203
  912    HG   LEU 113           HG       LEU 113 -13.436   5.631   5.631
  913   1HD1  LEU 113          1HD1      LEU 113 -13.102   7.533   7.533
  914   2HD1  LEU 113          3HD1      LEU 113 -12.406   8.162   8.162
  915   3HD1  LEU 113          2HD1      LEU 113 -14.090   7.651   7.651
  916   1HD2  LEU 113          3HD2      LEU 113 -10.914   5.078   5.078
  917   2HD2  LEU 113          2HD2      LEU 113 -11.489   6.421   6.421
  918   3HD2  LEU 113          1HD2      LEU 113 -10.673   6.737   6.737
  919    H    THR 114           H        THR 114 -11.456   7.991   7.991
  920    HA   THR 114           HA       THR 114 -12.218   7.647   7.647
  921    HB   THR 114           HB       THR 114 -11.607   9.930   9.930
  922    HG1  THR 114           HG1      THR 114 -11.275  11.309  11.309
  923   1HG2  THR 114          1HG2      THR 114  -9.704   8.381   8.381
  924   2HG2  THR 114          3HG2      THR 114  -9.729   8.796   8.796
  925   3HG2  THR 114          2HG2      THR 114  -9.330  10.026  10.026
  926    H    ASN 115           H        ASN 115 -13.966   9.040   9.040
  927    HA   ASN 115           HA       ASN 115 -16.421   8.677   8.677
  928   1HB   ASN 115          2HB       ASN 115 -16.150   8.974   8.974
  929   2HB   ASN 115          1HB       ASN 115 -15.897  10.695  10.695
  930   1HD2  ASN 115          2HD2      ASN 115 -19.338  11.355  11.355
  931   2HD2  ASN 115          1HD2      ASN 115 -17.767  11.958  11.958
  932    H    ASP 116           H        ASP 116 -14.062  11.237  11.237
  933    HA   ASP 116           HA       ASP 116 -15.924  13.165  13.165
  934   1HB   ASP 116          2HB       ASP 116 -13.651  13.531  13.531
  935   2HB   ASP 116          1HB       ASP 116 -12.974  13.518  13.518
  936    H    GLY 117           H        GLY 117 -13.640  10.724  10.724
  937   1HA   GLY 117          2HA       GLY 117 -14.224   9.858   9.858
  938   2HA   GLY 117          1HA       GLY 117 -14.147  11.543  11.543
  939    H    GLU 118           H        GLU 118 -11.766  11.529  11.529
  940    HA   GLU 118           HA       GLU 118  -9.627  11.601  11.601
  941   1HB   GLU 118          2HB       GLU 118  -9.582  10.993  10.993
  942   2HB   GLU 118          1HB       GLU 118  -8.159  11.388  11.388
  943   1HG   GLU 118          2HG       GLU 118  -9.172  13.561  13.561
  944   2HG   GLU 118          1HG       GLU 118 -10.582  13.171  13.171
  945    H    LEU 119           H        LEU 119  -7.675  10.006  10.006
  946    HA   LEU 119           HA       LEU 119  -8.586   7.200   7.200
  947   1HB   LEU 119          2HB       LEU 119  -9.016   7.887   7.887
  948   2HB   LEU 119          1HB       LEU 119  -7.291   8.173   8.173
  949    HG   LEU 119           HG       LEU 119  -8.386   5.503   5.503
  950   1HD1  LEU 119          1HD1      LEU 119  -8.212   6.715   6.715
  951   2HD1  LEU 119          3HD1      LEU 119  -7.864   4.997   4.997
  952   3HD1  LEU 119          2HD1      LEU 119  -9.436   5.636   5.636
  953   1HD2  LEU 119          3HD2      LEU 119  -5.765   6.615   6.615
  954   2HD2  LEU 119          2HD2      LEU 119  -6.086   5.420   5.420
  955   3HD2  LEU 119          1HD2      LEU 119  -6.157   4.953   4.953
  956    H    ILE 120           H        ILE 120  -7.091   6.502   6.502
  957    HA   ILE 120           HA       ILE 120  -4.237   7.304   7.304
  958    HB   ILE 120           HB       ILE 120  -5.060   7.806   7.806
  959   1HG1  ILE 120          2HG1      ILE 120  -3.375   5.307   5.307
  960   2HG1  ILE 120          1HG1      ILE 120  -2.718   6.821   6.821
  961   1HG2  ILE 120          1HG2      ILE 120  -5.966   4.937   4.937
  962   2HG2  ILE 120          3HG2      ILE 120  -5.659   5.709   5.709
  963   3HG2  ILE 120          2HG2      ILE 120  -6.885   6.367   6.367
  964   1HD1  ILE 120          1HD1      ILE 120  -3.420   7.967   7.967
  965   2HD1  ILE 120          3HD1      ILE 120  -4.039   6.438   6.438
  966   3HD1  ILE 120          2HD1      ILE 120  -2.310   6.638   6.638
  967    H    LEU 121           H        LEU 121  -2.612   5.504   5.504
  968    HA   LEU 121           HA       LEU 121  -3.752   2.821   2.821
  969   1HB   LEU 121          2HB       LEU 121  -3.280   3.897   3.897
  970   2HB   LEU 121          1HB       LEU 121  -1.637   4.257   4.257
  971    HG   LEU 121           HG       LEU 121  -2.460   1.402   1.402
  972   1HD1  LEU 121          1HD1      LEU 121  -2.145   2.919   2.919
  973   2HD1  LEU 121          3HD1      LEU 121  -1.872   1.180   1.180
  974   3HD1  LEU 121          2HD1      LEU 121  -3.463   1.848   1.848
  975   1HD2  LEU 121          2HD2      LEU 121  -0.016   2.947   2.947
  976   2HD2  LEU 121          1HD2      LEU 121  -0.196   2.013   2.013
  977   3HD2  LEU 121          3HD2      LEU 121  -0.131   1.189   1.189
  978    H    THR 122           H        THR 122  -2.276   1.127   1.127
  979    HA   THR 122           HA       THR 122   0.232   1.908   1.908
  980    HB   THR 122           HB       THR 122  -0.734  -0.344  -0.344
  981    HG1  THR 122           HG1      THR 122  -2.721   1.671   1.671
  982   1HG2  THR 122          2HG2      THR 122  -0.420   2.583   2.583
  983   2HG2  THR 122          1HG2      THR 122  -1.097   1.505   1.505
  984   3HG2  THR 122          3HG2      THR 122   0.527   1.219   1.219
  985    H    MET 123           H        MET 123   1.656  -0.111  -0.111
  986    HA   MET 123           HA       MET 123   0.965  -2.187  -2.187
  987   1HB   MET 123          2HB       MET 123   3.498  -0.527  -0.527
  988   2HB   MET 123          1HB       MET 123   3.073  -1.878  -1.878
  989   1HG   MET 123          2HG       MET 123   0.916  -0.525  -0.525
  990   2HG   MET 123          1HG       MET 123   1.801   0.848   0.848
  991   1HE   MET 123          2HE       MET 123   1.910  -2.132  -2.132
  992   2HE   MET 123          1HE       MET 123   0.823  -0.889  -0.889
  993   3HE   MET 123          3HE       MET 123   2.292  -1.306  -1.306
  994    H    THR 124           H        THR 124   2.600  -3.941  -3.941
  995    HA   THR 124           HA       THR 124   4.293  -4.067  -4.067
  996    HB   THR 124           HB       THR 124   2.414  -6.332  -6.332
  997    HG1  THR 124           HG1      THR 124   0.867  -5.214  -5.214
  998   1HG2  THR 124          3HG2      THR 124   4.468  -6.658  -6.658
  999   2HG2  THR 124          2HG2      THR 124   3.847  -5.447  -5.447
 1000   3HG2  THR 124          1HG2      THR 124   2.973  -6.960  -6.960
 1001    H    ALA 125           H        ALA 125   5.928  -5.635  -5.635
 1002    HA   ALA 125           HA       ALA 125   6.052  -7.346  -7.346
 1003   1HB   ALA 125          2HB       ALA 125   7.580  -4.811  -4.811
 1004   2HB   ALA 125          1HB       ALA 125   8.482  -6.210  -6.210
 1005   3HB   ALA 125          3HB       ALA 125   7.050  -5.662  -5.662
 1006    H    ASP 126           H        ASP 126   6.271  -9.080  -9.080
 1007    HA   ASP 126           HA       ASP 126   7.528 -10.683 -10.683
 1008   1HB   ASP 126          2HB       ASP 126   9.537  -9.003  -9.003
 1009   2HB   ASP 126          1HB       ASP 126   9.938  -9.209  -9.209
 1010    H    ASP 127           H        ASP 127   8.948  -7.761  -7.761
 1011    HA   ASP 127           HA       ASP 127   7.119  -8.003  -8.003
 1012   1HB   ASP 127          2HB       ASP 127   9.333  -9.406  -9.406
 1013   2HB   ASP 127          1HB       ASP 127  10.057  -7.826  -7.826
 1014    H    VAL 128           H        VAL 128   7.791  -6.100  -6.100
 1015    HA   VAL 128           HA       VAL 128   8.443  -3.719  -3.719
 1016    HB   VAL 128           HB       VAL 128   9.322  -2.666  -2.666
 1017   1HG1  VAL 128          1HG1      VAL 128  10.397  -5.464  -5.464
 1018   2HG1  VAL 128          3HG1      VAL 128  11.251  -4.195  -4.195
 1019   3HG1  VAL 128          2HG1      VAL 128  10.902  -3.997  -3.997
 1020   1HG2  VAL 128          3HG2      VAL 128   7.974  -4.964  -4.964
 1021   2HG2  VAL 128          2HG2      VAL 128   8.337  -3.369  -3.369
 1022   3HG2  VAL 128          1HG2      VAL 128   9.578  -4.621  -4.621
 1023    H    VAL 129           H        VAL 129   7.469  -1.696  -1.696
 1024    HA   VAL 129           HA       VAL 129   4.930  -2.321  -2.321
 1025    HB   VAL 129           HB       VAL 129   5.116  -1.471  -1.471
 1026   1HG1  VAL 129          3HG1      VAL 129   3.071  -0.402  -0.402
 1027   2HG1  VAL 129          2HG1      VAL 129   2.645  -0.669  -0.669
 1028   3HG1  VAL 129          1HG1      VAL 129   3.932   0.462   0.462
 1029   1HG2  VAL 129          3HG2      VAL 129   3.549  -3.356  -3.356
 1030   2HG2  VAL 129          2HG2      VAL 129   4.341  -3.630  -3.630
 1031   3HG2  VAL 129          1HG2      VAL 129   2.803  -2.770  -2.770
 1032    H    CYS 130           H        CYS 130   4.839  -0.899  -0.899
 1033    HA   CYS 130           HA       CYS 130   6.091   1.786   1.786
 1034   1HB   CYS 130          2HB       CYS 130   6.610   0.215   0.215
 1035   2HB   CYS 130          1HB       CYS 130   5.008   0.654   0.654
 1036    HG   CYS 130           HG       CYS 130   6.097   3.247   3.247
 1037    H    THR 131           H        THR 131   4.669   3.299   3.299
 1038    HA   THR 131           HA       THR 131   1.812   3.090   3.090
 1039    HB   THR 131           HB       THR 131   3.078   4.583   4.583
 1040    HG1  THR 131           HG1      THR 131   2.626   2.860   2.860
 1041   1HG2  THR 131          1HG2      THR 131   0.216   4.352   4.352
 1042   2HG2  THR 131          3HG2      THR 131   0.637   4.826   4.826
 1043   3HG2  THR 131          2HG2      THR 131   1.146   5.823   5.823
 1044    H    ARG 132           H        ARG 132   0.801   4.875   4.875
 1045    HA   ARG 132           HA       ARG 132   2.250   7.391   7.391
 1046   1HB   ARG 132          2HB       ARG 132   1.534   7.173   7.173
 1047   2HB   ARG 132          1HB       ARG 132   3.072   6.521   6.521
 1048   1HG   ARG 132          2HG       ARG 132   0.667   4.739   4.739
 1049   2HG   ARG 132          1HG       ARG 132   1.397   5.043   5.043
 1050   1HD   ARG 132          2HD       ARG 132   3.404   4.463   4.463
 1051   2HD   ARG 132          1HD       ARG 132   2.251   3.145   3.145
 1052    HE   ARG 132           HE       ARG 132   2.832   3.270   3.270
 1053   1HH1  ARG 132          1HH2      ARG 132   4.714   5.558   5.558
 1054   2HH1  ARG 132          2HH2      ARG 132   6.241   4.914   4.914
 1055   1HH2  ARG 132          2HH1      ARG 132   4.896   1.957   1.957
 1056   2HH2  ARG 132          1HH1      ARG 132   6.344   2.875   2.875
 1057    H    VAL 133           H        VAL 133   0.694   8.927   8.927
 1058    HA   VAL 133           HA       VAL 133  -2.155   8.181   8.181
 1059    HB   VAL 133           HB       VAL 133  -0.873  10.829  10.829
 1060   1HG1  VAL 133          3HG1      VAL 133  -3.643   9.682   9.682
 1061   2HG1  VAL 133          2HG1      VAL 133  -3.096  10.922  10.922
 1062   3HG1  VAL 133          1HG1      VAL 133  -3.152  11.266  11.266
 1063   1HG2  VAL 133          3HG2      VAL 133  -1.600   8.429   8.429
 1064   2HG2  VAL 133          2HG2      VAL 133  -0.010   9.171   9.171
 1065   3HG2  VAL 133          1HG2      VAL 133  -1.293  10.027  10.027
 1066    H    TYR 134           H        TYR 134  -3.670   9.060   9.060
 1067    HA   TYR 134           HA       TYR 134  -2.531  10.815  10.815
 1068   1HB   TYR 134          2HB       TYR 134  -4.077   8.263   8.263
 1069   2HB   TYR 134          1HB       TYR 134  -4.234   9.518   9.518
 1070    HD1  TYR 134           HD1      TYR 134  -1.929   7.127   7.127
 1071    HD2  TYR 134           HD2      TYR 134  -2.359  10.163  10.163
 1072    HE1  TYR 134           HE1      TYR 134   0.204   6.413   6.413
 1073    HE2  TYR 134           HE2      TYR 134  -0.221   9.444   9.444
 1074    HH   TYR 134           HH       TYR 134   1.216   6.579   6.579
 1075    H    VAL 135           H        VAL 135  -3.703  12.585  12.585
 1076    HA   VAL 135           HA       VAL 135  -6.529  12.601  12.601
 1077    HB   VAL 135           HB       VAL 135  -4.398  14.364  14.364
 1078   1HG1  VAL 135          1HG1      VAL 135  -4.839  15.468  15.468
 1079   2HG1  VAL 135          3HG1      VAL 135  -6.467  15.839  15.839
 1080   3HG1  VAL 135          2HG1      VAL 135  -5.067  16.534  16.534
 1081   1HG2  VAL 135          3HG2      VAL 135  -7.386  14.450  14.450
 1082   2HG2  VAL 135          2HG2      VAL 135  -6.144  13.995  13.995
 1083   3HG2  VAL 135          1HG2      VAL 135  -6.330  15.683  15.683
 1084    H    ARG 136           H        ARG 136  -8.129  13.125  13.125
 1085    HA   ARG 136           HA       ARG 136  -7.672  12.602  12.602
 1086   1HB   ARG 136          2HB       ARG 136  -9.851  13.642  13.642
 1087   2HB   ARG 136          1HB       ARG 136  -9.757  14.501  14.501
 1088   1HG   ARG 136          2HG       ARG 136 -10.110  12.600  12.600
 1089   2HG   ARG 136          1HG       ARG 136  -9.474  11.526  11.526
 1090   1HD   ARG 136          2HD       ARG 136 -12.159  12.931  12.931
 1091   2HD   ARG 136          1HD       ARG 136 -11.863  11.195  11.195
 1092    HE   ARG 136           HE       ARG 136 -10.679  12.029  12.029
 1093   1HH1  ARG 136          2HH1      ARG 136 -13.243  10.305  10.305
 1094   2HH1  ARG 136          1HH1      ARG 136 -14.358  11.121  11.121
 1095   1HH2  ARG 136          1HH2      ARG 136 -12.343  13.917  13.917
 1096   2HH2  ARG 136          2HH2      ARG 136 -13.847  13.167  13.167
 1097    H    GLU 137           HN       GLU 137  -6.760  13.606  13.606
 1098    HA   GLU 137           HA       GLU 137  -5.240  15.944  15.944
 1099   1HB   GLU 137          2HB       GLU 137  -5.040  14.284  14.284
 1100   2HB   GLU 137          1HB       GLU 137  -6.606  14.786  14.786
 1101   1HG   GLU 137          2HG       GLU 137  -5.706  16.502  16.502
 1102   2HG   GLU 137          1HG       GLU 137  -4.898  17.088  17.088

  Start of MODEL   10
    1   1H    PRO   1          1H        PRO   1  16.604   7.698   7.698
    2   2H    PRO   1          2H        PRO   1  16.143   6.895   6.895
    3    HA   PRO   1           HA       PRO   1  16.472   4.923   4.923
    4   1HB   PRO   1          2HB       PRO   1  19.098   5.154   5.154
    5   2HB   PRO   1          1HB       PRO   1  18.625   4.337   4.337
    6   1HG   PRO   1          2HG       PRO   1  20.051   6.805   6.805
    7   2HG   PRO   1          1HG       PRO   1  19.585   5.978   5.978
    8   1HD   PRO   1          1HD       PRO   1  18.476   8.378   8.378
    9   2HD   PRO   1          2HD       PRO   1  18.002   7.536   7.536
   10    H    ASN   2           H        ASN   2  15.188   6.826   6.826
   11    HA   ASN   2           HA       ASN   2  15.682   5.648   5.648
   12   1HB   ASN   2          2HB       ASN   2  16.141   8.579   8.579
   13   2HB   ASN   2          1HB       ASN   2  15.778   7.991   7.991
   14   1HD2  ASN   2          2HD2      ASN   2  19.488   7.441   7.441
   15   2HD2  ASN   2          1HD2      ASN   2  18.269   8.219   8.219
   16    H    PHE   3           H        PHE   3  13.726   5.256   5.256
   17    HA   PHE   3           HA       PHE   3  11.367   6.730   6.730
   18   1HB   PHE   3          2HB       PHE   3  11.630   4.211   4.211
   19   2HB   PHE   3          1HB       PHE   3  10.107   4.910   4.910
   20    HD1  PHE   3           HD1      PHE   3  13.387   3.977   3.977
   21    HD2  PHE   3           HD2      PHE   3   9.096   3.874   3.874
   22    HE1  PHE   3           HE1      PHE   3  13.506   2.694   2.694
   23    HE2  PHE   3           HE2      PHE   3   9.226   2.578   2.578
   24    HZ   PHE   3           HZ       PHE   3  11.433   1.977   1.977
   25    H    SER   4           H        SER   4  13.501   6.831   6.831
   26    HA   SER   4           HA       SER   4  11.699   7.200   7.200
   27   1HB   SER   4          2HB       SER   4  13.617   7.963   7.963
   28   2HB   SER   4          1HB       SER   4  14.161   6.676   6.676
   29    HG   SER   4           HG       SER   4  15.489   8.596   8.596
   30    H    GLY   5           H        GLY   5  10.297   8.808   8.808
   31   1HA   GLY   5          2HA       GLY   5  10.790  11.488  11.488
   32   2HA   GLY   5          1HA       GLY   5  10.513  11.344  11.344
   33    H    ASN   6           H        ASN   6   8.606  12.793  12.793
   34    HA   ASN   6           HA       ASN   6   6.350  11.156  11.156
   35   1HB   ASN   6          2HB       ASN   6   6.863  14.111  14.111
   36   2HB   ASN   6          1HB       ASN   6   5.200  13.525  13.525
   37   1HD2  ASN   6          2HD2      ASN   6   5.808  12.133  12.133
   38   2HD2  ASN   6          1HD2      ASN   6   5.255  11.539  11.539
   39    H    TRP   7           H        TRP   7   4.240  11.507  11.507
   40    HA   TRP   7           HA       TRP   7   4.816  11.985  11.985
   41   1HB   TRP   7          2HB       TRP   7   3.930   9.319   9.319
   42   2HB   TRP   7          1HB       TRP   7   3.927   9.728   9.728
   43    HD1  TRP   7           HD1      TRP   7   6.151   8.585   8.585
   44    HE1  TRP   7           HE1      TRP   7   8.600   8.436   8.436
   45    HE3  TRP   7           HE3      TRP   7   5.669  10.997  10.997
   46    HZ2  TRP   7           HZ2      TRP   7  10.139   9.279   9.279
   47    HZ3  TRP   7           HZ3      TRP   7   7.621  11.352  11.352
   48    HH2  TRP   7           HH2      TRP   7   9.837  10.493  10.493
   49    H    LYS   8           H        LYS   8   3.166  13.034  13.034
   50    HA   LYS   8           HA       LYS   8   0.426  12.541  12.541
   51   1HB   LYS   8          2HB       LYS   8   1.607  15.113  15.113
   52   2HB   LYS   8          1HB       LYS   8  -0.097  14.890  14.890
   53   1HG   LYS   8          2HG       LYS   8   0.723  14.185  14.185
   54   2HG   LYS   8          1HG       LYS   8   2.275  14.878  14.878
   55   1HD   LYS   8          2HD       LYS   8   0.907  16.978  16.978
   56   2HD   LYS   8          1HD       LYS   8  -0.381  16.269  16.269
   57   1HE   LYS   8          2HE       LYS   8   1.054  16.222  16.222
   58   2HE   LYS   8          1HE       LYS   8   2.436  16.761  16.761
   59   1HZ   LYS   8          3HZ       LYS   8   1.059  18.777  18.777
   60   2HZ   LYS   8          2HZ       LYS   8  -0.015  18.279  18.279
   61   3HZ   LYS   8          1HZ       LYS   8   1.594  18.662  18.662
   62    H    ILE   9           H        ILE   9  -0.653  11.385  11.385
   63    HA   ILE   9           HA       ILE   9   0.081  10.933  10.933
   64    HB   ILE   9           HB       ILE   9  -1.450   9.498   9.498
   65   1HG1  ILE   9          2HG1      ILE   9  -2.759  10.808  10.808
   66   2HG1  ILE   9          1HG1      ILE   9  -1.629   9.456   9.456
   67   1HG2  ILE   9          3HG2      ILE   9  -2.604  11.836  11.836
   68   2HG2  ILE   9          2HG2      ILE   9  -3.799  11.263  11.263
   69   3HG2  ILE   9          1HG2      ILE   9  -3.320  10.236  10.236
   70   1HD1  ILE   9          2HD1      ILE   9  -3.393   8.329   8.329
   71   2HD1  ILE   9          1HD1      ILE   9  -4.494   9.508   9.508
   72   3HD1  ILE   9          3HD1      ILE   9  -3.671   8.335   8.335
   73    H    ILE  10           H        ILE  10  -0.505  11.874  11.874
   74    HA   ILE  10           HA       ILE  10  -2.056  14.421  14.421
   75    HB   ILE  10           HB       ILE  10  -0.595  15.313  15.313
   76   1HG1  ILE  10          2HG1      ILE  10   1.654  13.727  13.727
   77   2HG1  ILE  10          1HG1      ILE  10   0.374  12.518  12.518
   78   1HG2  ILE  10          1HG2      ILE  10  -0.039  15.633  15.633
   79   2HG2  ILE  10          3HG2      ILE  10   0.998  14.209  14.209
   80   3HG2  ILE  10          2HG2      ILE  10   1.388  15.641  15.641
   81   1HD1  ILE  10          3HD1      ILE  10  -0.719  14.052  14.052
   82   2HD1  ILE  10          2HD1      ILE  10   0.948  14.576  14.576
   83   3HD1  ILE  10          1HD1      ILE  10   0.521  12.875  12.875
   84    H    ARG  11           H        ARG  11  -1.519  11.391  11.391
   85    HA   ARG  11           HA       ARG  11  -3.867  12.000  12.000
   86   1HB   ARG  11          2HB       ARG  11  -1.269  12.042  12.042
   87   2HB   ARG  11          1HB       ARG  11  -1.844  10.430  10.430
   88   1HG   ARG  11          2HG       ARG  11  -4.007  11.723  11.723
   89   2HG   ARG  11          1HG       ARG  11  -2.915  13.106  13.106
   90   1HD   ARG  11          2HD       ARG  11  -2.554  10.461  10.461
   91   2HD   ARG  11          1HD       ARG  11  -2.979  12.004  12.004
   92    HE   ARG  11           HE       ARG  11  -0.417  11.853  11.853
   93   1HH1  ARG  11          1HH2      ARG  11  -1.784  13.705  13.705
   94   2HH1  ARG  11          2HH2      ARG  11  -0.614  13.461  13.461
   95   1HH2  ARG  11          2HH1      ARG  11   0.934  10.801  10.801
   96   2HH2  ARG  11          1HH1      ARG  11   0.924  11.817  11.817
   97    H    SER  12           H        SER  12  -4.400   9.828   9.828
   98    HA   SER  12           HA       SER  12  -3.777   7.259   7.259
   99   1HB   SER  12          2HB       SER  12  -4.478   7.715   7.715
  100   2HB   SER  12          1HB       SER  12  -5.891   8.612   8.612
  101    HG   SER  12           HG       SER  12  -5.564   5.947   5.947
  102    H    GLU  13           H        GLU  13  -5.712   5.700   5.700
  103    HA   GLU  13           HA       GLU  13  -7.858   6.919   6.919
  104   1HB   GLU  13          2HB       GLU  13  -7.132   6.149   6.149
  105   2HB   GLU  13          1HB       GLU  13  -5.894   7.188   7.188
  106   1HG   GLU  13          2HG       GLU  13  -5.252   4.590   4.590
  107   2HG   GLU  13          1HG       GLU  13  -5.705   4.403   4.403
  108    H    ASN  14           H        ASN  14  -7.509   4.786   4.786
  109    HA   ASN  14           HA       ASN  14  -9.365   2.883   2.883
  110   1HB   ASN  14          2HB       ASN  14  -7.293   1.171   1.171
  111   2HB   ASN  14          1HB       ASN  14  -7.993   1.192   1.192
  112   1HD2  ASN  14          2HD2      ASN  14  -4.855   2.143   2.143
  113   2HD2  ASN  14          1HD2      ASN  14  -6.185   1.113   1.113
  114    H    PHE  15           H        PHE  15  -9.315   4.700   4.700
  115    HA   PHE  15           HA       PHE  15  -8.844   3.352   3.352
  116   1HB   PHE  15          2HB       PHE  15  -9.191   5.879   5.879
  117   2HB   PHE  15          1HB       PHE  15 -10.907   5.512   5.512
  118    HD1  PHE  15           HD2      PHE  15 -10.089   3.202   3.202
  119    HD2  PHE  15           HD1      PHE  15  -9.711   7.457   7.457
  120    HE1  PHE  15           HE2      PHE  15 -10.074   3.441   3.441
  121    HE2  PHE  15           HE1      PHE  15  -9.683   7.683   7.683
  122    HZ   PHE  15           HZ       PHE  15  -9.863   5.664   5.664
  123    H    GLU  16           H        GLU  16 -11.965   4.139   4.139
  124    HA   GLU  16           HA       GLU  16 -13.572   2.611   2.611
  125   1HB   GLU  16          2HB       GLU  16 -15.259   2.685   2.685
  126   2HB   GLU  16          1HB       GLU  16 -14.548   4.260   4.260
  127   1HG   GLU  16          2HG       GLU  16 -13.117   4.152   4.152
  128   2HG   GLU  16          1HG       GLU  16 -13.465   2.441   2.441
  129    H    GLU  17           H        GLU  17 -11.627   1.559   1.559
  130    HA   GLU  17           HA       GLU  17 -13.072  -0.935  -0.935
  131   1HB   GLU  17          2HB       GLU  17 -11.247  -1.686  -1.686
  132   2HB   GLU  17          1HB       GLU  17 -11.736  -0.049  -0.049
  133   1HG   GLU  17          2HG       GLU  17  -9.765   0.862   0.862
  134   2HG   GLU  17          1HG       GLU  17  -9.573  -0.266  -0.266
  135    H    LEU  18           H        LEU  18 -10.409   0.104   0.104
  136    HA   LEU  18           HA       LEU  18  -9.745  -2.622  -2.622
  137   1HB   LEU  18          2HB       LEU  18  -8.497  -0.074  -0.074
  138   2HB   LEU  18          1HB       LEU  18  -8.778  -0.627  -0.627
  139    HG   LEU  18           HG       LEU  18  -7.719  -2.803  -2.803
  140   1HD1  LEU  18          1HD1      LEU  18  -8.150  -2.003  -2.003
  141   2HD1  LEU  18          3HD1      LEU  18  -6.407  -1.818  -1.818
  142   3HD1  LEU  18          2HD1      LEU  18  -7.170  -3.375  -3.375
  143   1HD2  LEU  18          3HD2      LEU  18  -6.370  -0.182  -0.182
  144   2HD2  LEU  18          2HD2      LEU  18  -6.027  -1.634  -1.634
  145   3HD2  LEU  18          1HD2      LEU  18  -5.394  -1.475  -1.475
  146    H    LEU  19           H        LEU  19 -12.047  -0.222  -0.222
  147    HA   LEU  19           HA       LEU  19 -12.332  -1.413  -1.413
  148   1HB   LEU  19          2HB       LEU  19 -14.059   0.743   0.743
  149   2HB   LEU  19          1HB       LEU  19 -13.900   0.359   0.359
  150    HG   LEU  19           HG       LEU  19 -11.769   1.559   1.559
  151   1HD1  LEU  19          3HD1      LEU  19 -13.712   2.624   2.624
  152   2HD1  LEU  19          2HD1      LEU  19 -12.059   3.136   3.136
  153   3HD1  LEU  19          1HD1      LEU  19 -12.764   3.438   3.438
  154   1HD2  LEU  19          2HD2      LEU  19 -10.846  -0.133  -0.133
  155   2HD2  LEU  19          1HD2      LEU  19 -10.257   1.505   1.505
  156   3HD2  LEU  19          3HD2      LEU  19 -11.513   0.857   0.857
  157    H    LYS  20           H        LYS  20 -13.604  -1.844  -1.844
  158    HA   LYS  20           HA       LYS  20 -16.111  -3.083  -3.083
  159   1HB   LYS  20          2HB       LYS  20 -14.999  -3.267  -3.267
  160   2HB   LYS  20          1HB       LYS  20 -16.676  -3.404  -3.404
  161   1HG   LYS  20          2HG       LYS  20 -15.647  -0.843  -0.843
  162   2HG   LYS  20          1HG       LYS  20 -15.305  -1.077  -1.077
  163   1HD   LYS  20          2HD       LYS  20 -18.027  -1.439  -1.439
  164   2HD   LYS  20          1HD       LYS  20 -17.518  -0.012  -0.012
  165   1HE   LYS  20          2HE       LYS  20 -17.589  -2.822  -2.822
  166   2HE   LYS  20          1HE       LYS  20 -18.825  -1.595  -1.595
  167   1HZ   LYS  20          2HZ       LYS  20 -16.990  -0.150  -0.150
  168   2HZ   LYS  20          1HZ       LYS  20 -15.982  -1.517  -1.517
  169   3HZ   LYS  20          3HZ       LYS  20 -17.356  -1.499  -1.499
  170    H    VAL  21           H        VAL  21 -12.891  -3.920  -3.920
  171    HA   VAL  21           HA       VAL  21 -13.380  -6.776  -6.776
  172    HB   VAL  21           HB       VAL  21 -11.552  -5.564  -5.564
  173   1HG1  VAL  21          2HG1      VAL  21 -10.959  -4.033  -4.033
  174   2HG1  VAL  21          1HG1      VAL  21 -10.220  -5.387  -5.387
  175   3HG1  VAL  21          3HG1      VAL  21  -9.563  -4.841  -4.841
  176   1HG2  VAL  21          3HG2      VAL  21 -11.519  -8.058  -8.058
  177   2HG2  VAL  21          2HG2      VAL  21  -9.993  -7.336  -7.336
  178   3HG2  VAL  21          1HG2      VAL  21 -10.330  -7.562  -7.562
  179    H    LEU  22           H        LEU  22 -12.052  -4.556  -4.556
  180    HA   LEU  22           HA       LEU  22 -11.283  -6.476  -6.476
  181   1HB   LEU  22          2HB       LEU  22 -11.674  -3.546  -3.546
  182   2HB   LEU  22          1HB       LEU  22 -11.888  -4.185  -4.185
  183    HG   LEU  22           HG       LEU  22  -9.657  -5.098  -5.098
  184   1HD1  LEU  22          2HD1      LEU  22  -9.673  -5.810  -5.810
  185   2HD1  LEU  22          1HD1      LEU  22  -9.343  -4.136  -4.136
  186   3HD1  LEU  22          3HD1      LEU  22  -8.174  -5.046  -5.046
  187   1HD2  LEU  22          2HD2      LEU  22 -10.047  -2.283  -2.283
  188   2HD2  LEU  22          1HD2      LEU  22  -9.421  -2.878  -2.878
  189   3HD2  LEU  22          3HD2      LEU  22  -8.396  -2.893  -2.893
  190    H    GLY  23           H        GLY  23 -14.117  -4.411  -4.411
  191   1HA   GLY  23          2HA       GLY  23 -15.571  -5.988  -5.988
  192   2HA   GLY  23          1HA       GLY  23 -16.043  -4.389  -4.389
  193    H    VAL  24           H        VAL  24 -18.134  -4.996  -4.996
  194    HA   VAL  24           HA       VAL  24 -18.394  -6.325  -6.325
  195    HB   VAL  24           HB       VAL  24 -20.164  -7.892  -7.892
  196   1HG1  VAL  24          2HG1      VAL  24 -17.668  -8.460  -8.460
  197   2HG1  VAL  24          1HG1      VAL  24 -17.545  -8.394  -8.394
  198   3HG1  VAL  24          3HG1      VAL  24 -18.619  -9.565  -9.565
  199   1HG2  VAL  24          2HG2      VAL  24 -19.088  -6.901  -6.901
  200   2HG2  VAL  24          1HG2      VAL  24 -20.752  -6.808  -6.808
  201   3HG2  VAL  24          3HG2      VAL  24 -20.046  -8.372  -8.372
  202    H    ASN  25           H        ASN  25 -20.064  -4.911  -4.911
  203    HA   ASN  25           HA       ASN  25 -22.515  -4.222  -4.222
  204   1HB   ASN  25          2HB       ASN  25 -21.549  -3.971  -3.971
  205   2HB   ASN  25          1HB       ASN  25 -21.288  -2.323  -2.323
  206   1HD2  ASN  25          2HD2      ASN  25 -24.663  -1.445  -1.445
  207   2HD2  ASN  25          1HD2      ASN  25 -23.060  -0.942  -0.942
  208    H    VAL  26           H        VAL  26 -22.918  -1.545  -1.545
  209    HA   VAL  26           HA       VAL  26 -20.984  -0.569  -0.569
  210    HB   VAL  26           HB       VAL  26 -22.956   0.944   0.944
  211   1HG1  VAL  26          3HG1      VAL  26 -22.162  -0.970  -0.970
  212   2HG1  VAL  26          2HG1      VAL  26 -23.169  -2.055  -2.055
  213   3HG1  VAL  26          1HG1      VAL  26 -23.918  -0.836  -0.836
  214   1HG2  VAL  26          2HG2      VAL  26 -24.463  -1.169  -1.169
  215   2HG2  VAL  26          1HG2      VAL  26 -24.362   0.542   0.542
  216   3HG2  VAL  26          3HG2      VAL  26 -25.193   0.039   0.039
  217    H    MET  27           H        MET  27 -23.014   0.484   0.484
  218    HA   MET  27           HA       MET  27 -21.929   3.167   3.167
  219   1HB   MET  27          2HB       MET  27 -24.087   2.068   2.068
  220   2HB   MET  27          1HB       MET  27 -22.962   1.884   1.884
  221   1HG   MET  27          2HG       MET  27 -22.686   4.176   4.176
  222   2HG   MET  27          1HG       MET  27 -23.095   4.523   4.523
  223   1HE   MET  27          3HE       MET  27 -23.875   4.888   4.888
  224   2HE   MET  27          2HE       MET  27 -24.439   6.290   6.290
  225   3HE   MET  27          1HE       MET  27 -25.577   5.366   5.366
  226    H    LEU  28           H        LEU  28 -20.922   0.070   0.070
  227    HA   LEU  28           HA       LEU  28 -19.188   0.790   0.790
  228   1HB   LEU  28          2HB       LEU  28 -19.583  -1.472  -1.472
  229   2HB   LEU  28          1HB       LEU  28 -17.930  -1.324  -1.324
  230    HG   LEU  28           HG       LEU  28 -19.267  -2.750  -2.750
  231   1HD1  LEU  28          3HD1      LEU  28 -17.910  -0.300  -0.300
  232   2HD1  LEU  28          2HD1      LEU  28 -19.116  -0.797  -0.797
  233   3HD1  LEU  28          1HD1      LEU  28 -17.835  -1.911  -1.911
  234   1HD2  LEU  28          2HD2      LEU  28 -20.978  -0.264  -0.264
  235   2HD2  LEU  28          1HD2      LEU  28 -21.472  -1.767  -1.767
  236   3HD2  LEU  28          3HD2      LEU  28 -21.140  -1.740  -1.740
  237    H    ARG  29           H        ARG  29 -18.511   0.611   0.611
  238    HA   ARG  29           HA       ARG  29 -15.732   1.219   1.219
  239   1HB   ARG  29          2HB       ARG  29 -17.551   2.000   2.000
  240   2HB   ARG  29          1HB       ARG  29 -15.824   1.665   1.665
  241   1HG   ARG  29          2HG       ARG  29 -16.271  -0.501  -0.501
  242   2HG   ARG  29          1HG       ARG  29 -17.062  -0.633  -0.633
  243   1HD   ARG  29          2HD       ARG  29 -18.510  -1.259  -1.259
  244   2HD   ARG  29          1HD       ARG  29 -19.192  -0.030  -0.030
  245    HE   ARG  29           HE       ARG  29 -17.670   1.075   1.075
  246   1HH1  ARG  29          2HH1      ARG  29 -19.757   2.752   2.752
  247   2HH1  ARG  29          1HH1      ARG  29 -21.107   2.413   2.413
  248   1HH2  ARG  29          1HH2      ARG  29 -19.818  -0.594  -0.594
  249   2HH2  ARG  29          2HH2      ARG  29 -21.141   0.520   0.520
  250    H    LYS  30           H        LYS  30 -18.588   3.301   3.301
  251    HA   LYS  30           HA       LYS  30 -17.198   5.751   5.751
  252   1HB   LYS  30          2HB       LYS  30 -19.774   5.130   5.130
  253   2HB   LYS  30          1HB       LYS  30 -19.772   5.711   5.711
  254   1HG   LYS  30          2HG       LYS  30 -20.209   7.668   7.668
  255   2HG   LYS  30          1HG       LYS  30 -18.464   7.752   7.752
  256   1HD   LYS  30          2HD       LYS  30 -18.119   6.714   6.714
  257   2HD   LYS  30          1HD       LYS  30 -19.865   6.717   6.717
  258   1HE   LYS  30          2HE       LYS  30 -19.963   9.101   9.101
  259   2HE   LYS  30          1HE       LYS  30 -18.323   9.237   9.237
  260   1HZ   LYS  30          3HZ       LYS  30 -17.666   8.004   8.004
  261   2HZ   LYS  30          2HZ       LYS  30 -19.199   8.454   8.454
  262   3HZ   LYS  30          1HZ       LYS  30 -18.076   9.645   9.645
  263    H    ILE  31           H        ILE  31 -17.646   3.830   3.830
  264    HA   ILE  31           HA       ILE  31 -17.153   6.060   6.060
  265    HB   ILE  31           HB       ILE  31 -17.047   3.062   3.062
  266   1HG1  ILE  31          2HG1      ILE  31 -19.229   5.029   5.029
  267   2HG1  ILE  31          1HG1      ILE  31 -19.262   4.092   4.092
  268   1HG2  ILE  31          1HG2      ILE  31 -17.154   5.419   5.419
  269   2HG2  ILE  31          3HG2      ILE  31 -17.263   3.723   3.723
  270   3HG2  ILE  31          2HG2      ILE  31 -15.775   4.345   4.345
  271   1HD1  ILE  31          3HD1      ILE  31 -18.769   2.088   2.088
  272   2HD1  ILE  31          2HD1      ILE  31 -19.600   3.178   3.178
  273   3HD1  ILE  31          1HD1      ILE  31 -20.411   2.625   2.625
  274    H    ALA  32           H        ALA  32 -15.258   3.663   3.663
  275    HA   ALA  32           HA       ALA  32 -12.820   4.214   4.214
  276   1HB   ALA  32          3HB       ALA  32 -13.531   2.484   2.484
  277   2HB   ALA  32          2HB       ALA  32 -11.837   2.848   2.848
  278   3HB   ALA  32          1HB       ALA  32 -12.812   2.023   2.023
  279    H    VAL  33           H        VAL  33 -14.397   5.360   5.360
  280    HA   VAL  33           HA       VAL  33 -12.075   6.685   6.685
  281    HB   VAL  33           HB       VAL  33 -14.975   7.383   7.383
  282   1HG1  VAL  33          1HG1      VAL  33 -12.828   8.624   8.624
  283   2HG1  VAL  33          3HG1      VAL  33 -12.787   7.268   7.268
  284   3HG1  VAL  33          2HG1      VAL  33 -14.203   8.318   8.318
  285   1HG2  VAL  33          3HG2      VAL  33 -13.996   4.805   4.805
  286   2HG2  VAL  33          2HG2      VAL  33 -15.358   5.447   5.447
  287   3HG2  VAL  33          1HG2      VAL  33 -13.748   5.445   5.445
  288    H    ALA  34           H        ALA  34 -14.841   7.563   7.563
  289    HA   ALA  34           HA       ALA  34 -14.148  10.367  10.367
  290   1HB   ALA  34          2HB       ALA  34 -16.435   9.086   9.086
  291   2HB   ALA  34          1HB       ALA  34 -15.778   9.014   9.014
  292   3HB   ALA  34          3HB       ALA  34 -16.037  10.575  10.575
  293    H    ALA  35           H        ALA  35 -13.548   7.472   7.472
  294    HA   ALA  35           HA       ALA  35 -12.372   8.712   8.712
  295   1HB   ALA  35          2HB       ALA  35 -12.027   5.976   5.976
  296   2HB   ALA  35          1HB       ALA  35 -11.263   6.436   6.436
  297   3HB   ALA  35          3HB       ALA  35 -13.022   6.398   6.398
  298    H    ALA  36           H        ALA  36 -11.071   7.631   7.631
  299    HA   ALA  36           HA       ALA  36  -8.309   8.059   8.059
  300   1HB   ALA  36          3HB       ALA  36  -9.941   7.586   7.586
  301   2HB   ALA  36          2HB       ALA  36  -8.448   8.482   8.482
  302   3HB   ALA  36          1HB       ALA  36  -8.392   6.883   6.883
  303    H    SER  37           H        SER  37 -10.339  10.006  10.006
  304    HA   SER  37           HA       SER  37 -10.234  12.299  12.299
  305   1HB   SER  37          2HB       SER  37 -11.332  12.371  12.371
  306   2HB   SER  37          1HB       SER  37  -9.748  12.487  12.487
  307    HG   SER  37           HG       SER  37 -11.128  14.480  14.480
  308    H    LYS  38           H        LYS  38  -7.898  11.121  11.121
  309    HA   LYS  38           HA       LYS  38  -5.638  11.578  11.578
  310   1HB   LYS  38          2HB       LYS  38  -6.165  14.268  14.268
  311   2HB   LYS  38          1HB       LYS  38  -4.841  13.865  13.865
  312   1HG   LYS  38          2HG       LYS  38  -7.570  13.349  13.349
  313   2HG   LYS  38          1HG       LYS  38  -7.136  15.044  15.044
  314   1HD   LYS  38          2HD       LYS  38  -4.859  14.019  14.019
  315   2HD   LYS  38          1HD       LYS  38  -6.128  13.081  13.081
  316   1HE   LYS  38          2HE       LYS  38  -5.936  16.104  16.104
  317   2HE   LYS  38          1HE       LYS  38  -5.733  15.099  15.099
  318   1HZ   LYS  38          3HZ       LYS  38  -8.033  14.331  14.331
  319   2HZ   LYS  38          2HZ       LYS  38  -8.210  15.411  15.411
  320   3HZ   LYS  38          1HZ       LYS  38  -7.939  16.003  16.003
  321    HA   PRO  39           HA       PRO  39  -4.984  10.582  10.582
  322   1HB   PRO  39          2HB       PRO  39  -3.982   8.054   8.054
  323   2HB   PRO  39          1HB       PRO  39  -5.693   8.414   8.414
  324   1HG   PRO  39          2HG       PRO  39  -4.294   7.740   7.740
  325   2HG   PRO  39          1HG       PRO  39  -5.982   7.462   7.462
  326   1HD   PRO  39          2HD       PRO  39  -5.083   9.519   9.519
  327   2HD   PRO  39          1HD       PRO  39  -6.662   9.469   9.469
  328    H    ALA  40           H        ALA  40  -2.932  10.323  10.323
  329    HA   ALA  40           HA       ALA  40  -0.611  11.070  11.070
  330   1HB   ALA  40          3HB       ALA  40  -1.413  11.657  11.657
  331   2HB   ALA  40          2HB       ALA  40   0.307  11.599  11.599
  332   3HB   ALA  40          1HB       ALA  40  -0.745  12.740  12.740
  333    H    VAL  41           H        VAL  41   1.538  10.282  10.282
  334    HA   VAL  41           HA       VAL  41   1.392   7.686   7.686
  335    HB   VAL  41           HB       VAL  41   2.288   8.021   8.021
  336   1HG1  VAL  41          3HG1      VAL  41   2.828   5.728   5.728
  337   2HG1  VAL  41          2HG1      VAL  41   3.034   5.630   5.630
  338   3HG1  VAL  41          1HG1      VAL  41   4.029   6.739   6.739
  339   1HG2  VAL  41          3HG2      VAL  41   0.282   6.259   6.259
  340   2HG2  VAL  41          2HG2      VAL  41  -0.042   7.495   7.495
  341   3HG2  VAL  41          1HG2      VAL  41   0.784   6.004   6.004
  342    H    GLU  42           H        GLU  42   3.646   6.935   6.935
  343    HA   GLU  42           HA       GLU  42   5.768   8.974   8.974
  344   1HB   GLU  42          2HB       GLU  42   4.700   9.639   9.639
  345   2HB   GLU  42          1HB       GLU  42   4.841   7.997   7.997
  346   1HG   GLU  42          2HG       GLU  42   7.289   8.156   8.156
  347   2HG   GLU  42          1HG       GLU  42   7.177   9.767   9.767
  348    H    ILE  43           H        ILE  43   7.326   7.750   7.750
  349    HA   ILE  43           HA       ILE  43   7.545   4.904   4.904
  350    HB   ILE  43           HB       ILE  43   8.643   6.496   6.496
  351   1HG1  ILE  43          2HG1      ILE  43   7.068   4.073   4.073
  352   2HG1  ILE  43          1HG1      ILE  43   6.179   5.254   5.254
  353   1HG2  ILE  43          1HG2      ILE  43   9.261   3.687   3.687
  354   2HG2  ILE  43          3HG2      ILE  43   9.299   4.110   4.110
  355   3HG2  ILE  43          2HG2      ILE  43  10.369   4.932   4.932
  356   1HD1  ILE  43          3HD1      ILE  43   7.609   6.549   6.549
  357   2HD1  ILE  43          2HD1      ILE  43   6.535   5.285   5.285
  358   3HD1  ILE  43          1HD1      ILE  43   5.889   6.589   6.589
  359    H    LYS  44           H        LYS  44   9.228   4.124   4.124
  360    HA   LYS  44           HA       LYS  44  11.490   5.977   5.977
  361   1HB   LYS  44          2HB       LYS  44  11.241   3.673   3.673
  362   2HB   LYS  44          1HB       LYS  44  11.384   5.379   5.379
  363   1HG   LYS  44          2HG       LYS  44   8.997   5.705   5.705
  364   2HG   LYS  44          1HG       LYS  44   8.780   4.119   4.119
  365   1HD   LYS  44          2HD       LYS  44   9.247   2.996   2.996
  366   2HD   LYS  44          1HD       LYS  44   9.980   4.429   4.429
  367   1HE   LYS  44          2HE       LYS  44   7.095   4.484   4.484
  368   2HE   LYS  44          1HE       LYS  44   7.547   3.771   3.771
  369   1HZ   LYS  44          3HZ       LYS  44   8.480   6.458   6.458
  370   2HZ   LYS  44          2HZ       LYS  44   6.986   6.231   6.231
  371   3HZ   LYS  44          1HZ       LYS  44   8.427   5.781   5.781
  372    H    GLN  45           H        GLN  45  13.177   5.342   5.342
  373    HA   GLN  45           HA       GLN  45  13.383   2.461   2.461
  374   1HB   GLN  45          2HB       GLN  45  13.476   4.089   4.089
  375   2HB   GLN  45          1HB       GLN  45  14.901   4.835   4.835
  376   1HG   GLN  45          2HG       GLN  45  16.139   2.722   2.722
  377   2HG   GLN  45          1HG       GLN  45  14.715   1.937   1.937
  378   1HE2  GLN  45          2HE2      GLN  45  16.225   2.792   2.792
  379   2HE2  GLN  45          1HE2      GLN  45  15.965   1.532   1.532
  380    H    GLU  46           H        GLU  46  14.715   1.190   1.190
  381    HA   GLU  46           HA       GLU  46  17.188   2.384   2.384
  382   1HB   GLU  46          2HB       GLU  46  15.564   0.043   0.043
  383   2HB   GLU  46          1HB       GLU  46  17.022   0.708   0.708
  384   1HG   GLU  46          2HG       GLU  46  15.916   2.822   2.822
  385   2HG   GLU  46          1HG       GLU  46  14.489   2.304   2.304
  386    H    GLY  47           H        GLY  47  17.407   1.611   1.611
  387   1HA   GLY  47          2HA       GLY  47  19.034   0.297   0.297
  388   2HA   GLY  47          1HA       GLY  47  19.040  -0.857  -0.857
  389    H    ASP  48           H        ASP  48  18.242  -2.788  -2.788
  390    HA   ASP  48           HA       ASP  48  16.364  -2.967  -2.967
  391   1HB   ASP  48          2HB       ASP  48  16.246  -5.422  -5.422
  392   2HB   ASP  48          1HB       ASP  48  17.794  -4.850  -4.850
  393    H    THR  49           H        THR  49  15.875  -2.082  -2.082
  394    HA   THR  49           HA       THR  49  13.316  -3.521  -3.521
  395    HB   THR  49           HB       THR  49  14.973  -1.776  -1.776
  396    HG1  THR  49           HG1      THR  49  15.713  -3.726  -3.726
  397   1HG2  THR  49          2HG2      THR  49  12.108  -2.561  -2.561
  398   2HG2  THR  49          1HG2      THR  49  13.085  -2.693  -2.693
  399   3HG2  THR  49          3HG2      THR  49  12.935  -1.140  -1.140
  400    H    PHE  50           H        PHE  50  11.372  -2.488  -2.488
  401    HA   PHE  50           HA       PHE  50  11.418   0.454   0.454
  402   1HB   PHE  50          2HB       PHE  50  10.017  -1.604  -1.604
  403   2HB   PHE  50          1HB       PHE  50   9.770   0.142   0.142
  404    HD1  PHE  50           HD2      PHE  50  11.665   1.634   1.634
  405    HD2  PHE  50           HD1      PHE  50  12.024  -2.641  -2.641
  406    HE1  PHE  50           HE2      PHE  50  13.745   1.820   1.820
  407    HE2  PHE  50           HE1      PHE  50  14.103  -2.456  -2.456
  408    HZ   PHE  50           HZ       PHE  50  14.974  -0.231  -0.231
  409    H    TYR  51           H        TYR  51  10.194   1.262   1.262
  410    HA   TYR  51           HA       TYR  51   7.863  -0.258  -0.258
  411   1HB   TYR  51          2HB       TYR  51   9.636   0.583   0.583
  412   2HB   TYR  51          1HB       TYR  51   9.210   2.224   2.224
  413    HD1  TYR  51           HD1      TYR  51   6.719   2.869   2.869
  414    HD2  TYR  51           HD2      TYR  51   8.478  -0.469  -0.469
  415    HE1  TYR  51           HE1      TYR  51   4.859   2.888   2.888
  416    HE2  TYR  51           HE2      TYR  51   6.611  -0.445  -0.445
  417    HH   TYR  51           HH       TYR  51   4.650   2.032   2.032
  418    H    ILE  52           H        ILE  52   5.769   0.814   0.814
  419    HA   ILE  52           HA       ILE  52   5.647   3.374   3.374
  420    HB   ILE  52           HB       ILE  52   3.724   1.279   1.279
  421   1HG1  ILE  52          2HG1      ILE  52   6.667   1.267   1.267
  422   2HG1  ILE  52          1HG1      ILE  52   5.788  -0.034  -0.034
  423   1HG2  ILE  52          3HG2      ILE  52   5.352   3.432   3.432
  424   2HG2  ILE  52          2HG2      ILE  52   4.137   2.427   2.427
  425   3HG2  ILE  52          1HG2      ILE  52   3.661   3.554   3.554
  426   1HD1  ILE  52          2HD1      ILE  52   4.301   0.440   0.440
  427   2HD1  ILE  52          1HD1      ILE  52   5.970   0.619   0.619
  428   3HD1  ILE  52          3HD1      ILE  52   5.450  -0.876  -0.876
  429    H    LYS  53           H        LYS  53   4.617   4.572   4.572
  430    HA   LYS  53           HA       LYS  53   2.230   3.430   3.430
  431   1HB   LYS  53          2HB       LYS  53   3.993   4.562   4.562
  432   2HB   LYS  53          1HB       LYS  53   3.681   6.053   6.053
  433   1HG   LYS  53          2HG       LYS  53   1.143   5.219   5.219
  434   2HG   LYS  53          1HG       LYS  53   2.172   4.837   4.837
  435   1HD   LYS  53          2HD       LYS  53   3.120   7.298   7.298
  436   2HD   LYS  53          1HD       LYS  53   1.457   7.481   7.481
  437   1HE   LYS  53          2HE       LYS  53   0.594   7.342   7.342
  438   2HE   LYS  53          1HE       LYS  53   1.790   6.155   6.155
  439   1HZ   LYS  53          3HZ       LYS  53   3.440   8.020   8.020
  440   2HZ   LYS  53          2HZ       LYS  53   2.133   9.087   9.087
  441   3HZ   LYS  53          1HZ       LYS  53   2.259   8.141   8.141
  442    H    THR  54           H        THR  54   0.382   3.801   3.801
  443    HA   THR  54           HA       THR  54   0.147   6.318   6.318
  444    HB   THR  54           HB       THR  54  -1.740   3.941   3.941
  445    HG1  THR  54           HG1      THR  54  -0.197   2.961   2.961
  446   1HG2  THR  54          2HG2      THR  54  -1.937   6.501   6.501
  447   2HG2  THR  54          1HG2      THR  54  -1.511   5.422   5.422
  448   3HG2  THR  54          3HG2      THR  54  -2.944   5.099   5.099
  449    H    SER  55           H        SER  55  -1.639   7.754   7.754
  450    HA   SER  55           HA       SER  55  -3.344   7.121   7.121
  451   1HB   SER  55          2HB       SER  55  -2.814   9.687   9.687
  452   2HB   SER  55          1HB       SER  55  -1.860   8.356   8.356
  453    HG   SER  55           HG       SER  55  -0.301   9.461   9.461
  454    H    THR  56           H        THR  56  -5.389   7.693   7.693
  455    HA   THR  56           HA       THR  56  -5.990   9.588   9.588
  456    HB   THR  56           HB       THR  56  -8.356   8.437   8.437
  457    HG1  THR  56           HG1      THR  56  -8.291   6.651   6.651
  458   1HG2  THR  56          3HG2      THR  56  -5.955   7.245   7.245
  459   2HG2  THR  56          2HG2      THR  56  -7.574   6.561   6.561
  460   3HG2  THR  56          1HG2      THR  56  -7.254   8.209   8.209
  461    H    THR  57           H        THR  57  -7.505   8.444   8.444
  462    HA   THR  57           HA       THR  57  -7.537  10.880  10.880
  463    HB   THR  57           HB       THR  57  -8.958  11.783  11.783
  464    HG1  THR  57           HG1      THR  57  -9.735  12.528  12.528
  465   1HG2  THR  57          1HG2      THR  57  -9.683   9.449   9.449
  466   2HG2  THR  57          3HG2      THR  57 -10.904   9.536   9.536
  467   3HG2  THR  57          2HG2      THR  57 -10.917  10.708  10.708
  468    H    VAL  58           H        VAL  58  -9.365   8.011   8.011
  469    HA   VAL  58           HA       VAL  58  -9.820   7.450   7.450
  470    HB   VAL  58           HB       VAL  58 -11.597   6.657   6.657
  471   1HG1  VAL  58          2HG1      VAL  58 -11.647   6.211   6.211
  472   2HG1  VAL  58          1HG1      VAL  58 -13.171   6.335   6.335
  473   3HG1  VAL  58          3HG1      VAL  58 -12.009   5.077   5.077
  474   1HG2  VAL  58          3HG2      VAL  58 -11.352   9.193   9.193
  475   2HG2  VAL  58          2HG2      VAL  58 -12.853   8.539   8.539
  476   3HG2  VAL  58          1HG2      VAL  58 -12.573   8.538   8.538
  477    H    ARG  59           H        ARG  59  -8.295   6.343   6.343
  478    HA   ARG  59           HA       ARG  59  -8.434   3.509   3.509
  479   1HB   ARG  59          2HB       ARG  59  -8.833   3.808   3.808
  480   2HB   ARG  59          1HB       ARG  59  -7.360   4.757   4.757
  481   1HG   ARG  59          2HG       ARG  59  -6.001   2.912   2.912
  482   2HG   ARG  59          1HG       ARG  59  -7.028   2.054   2.054
  483   1HD   ARG  59          2HD       ARG  59  -7.708   2.490   2.490
  484   2HD   ARG  59          1HD       ARG  59  -7.043   0.998   0.998
  485    HE   ARG  59           HE       ARG  59  -9.197   1.129   1.129
  486   1HH1  ARG  59          1HH2      ARG  59 -11.184   2.597   2.597
  487   2HH1  ARG  59          2HH2      ARG  59 -11.820   2.111   2.111
  488   1HH2  ARG  59          2HH1      ARG  59  -9.007   0.286   0.286
  489   2HH2  ARG  59          1HH1      ARG  59 -10.587   0.802   0.802
  490    H    THR  60           H        THR  60  -5.710   5.190   5.190
  491    HA   THR  60           HA       THR  60  -3.489   5.468   5.468
  492    HB   THR  60           HB       THR  60  -4.246   4.621   4.621
  493    HG1  THR  60           HG1      THR  60  -5.088   6.610   6.610
  494   1HG2  THR  60          3HG2      THR  60  -1.878   5.357   5.357
  495   2HG2  THR  60          2HG2      THR  60  -2.522   6.960   6.960
  496   3HG2  THR  60          1HG2      THR  60  -2.351   5.775   5.775
  497    H    THR  61           H        THR  61  -2.839   3.633   3.633
  498    HA   THR  61           HA       THR  61  -2.757   1.025   1.025
  499    HB   THR  61           HB       THR  61  -1.726   0.458   0.458
  500    HG1  THR  61           HG1      THR  61  -3.592   2.534   2.534
  501   1HG2  THR  61          1HG2      THR  61  -3.823  -0.396  -0.396
  502   2HG2  THR  61          3HG2      THR  61  -4.700   0.828   0.828
  503   3HG2  THR  61          2HG2      THR  61  -3.838  -0.459  -0.459
  504    H    GLU  62           H        GLU  62  -0.650  -0.241  -0.241
  505    HA   GLU  62           HA       GLU  62   1.794   1.352   1.352
  506   1HB   GLU  62          2HB       GLU  62   0.779   0.484   0.484
  507   2HB   GLU  62          1HB       GLU  62   2.514   0.443   0.443
  508   1HG   GLU  62          2HG       GLU  62   2.460   2.631   2.631
  509   2HG   GLU  62          1HG       GLU  62   1.844   2.903   2.903
  510    H    ILE  63           H        ILE  63   2.913  -0.056  -0.056
  511    HA   ILE  63           HA       ILE  63   2.904  -2.958  -2.958
  512    HB   ILE  63           HB       ILE  63   3.474  -3.426  -3.426
  513   1HG1  ILE  63          2HG1      ILE  63   2.890  -0.487  -0.487
  514   2HG1  ILE  63          1HG1      ILE  63   4.521  -1.154  -1.154
  515   1HG2  ILE  63          2HG2      ILE  63   1.051  -3.048  -3.048
  516   2HG2  ILE  63          1HG2      ILE  63   1.039  -1.693  -1.693
  517   3HG2  ILE  63          3HG2      ILE  63   1.275  -3.335  -3.335
  518   1HD1  ILE  63          3HD1      ILE  63   2.538  -2.465  -2.465
  519   2HD1  ILE  63          2HD1      ILE  63   3.253  -0.934  -0.934
  520   3HD1  ILE  63          1HD1      ILE  63   4.288  -2.321  -2.321
  521    H    ASN  64           H        ASN  64   5.073  -4.044  -4.044
  522    HA   ASN  64           HA       ASN  64   7.384  -2.318  -2.318
  523   1HB   ASN  64          2HB       ASN  64   8.377  -2.515  -2.515
  524   2HB   ASN  64          1HB       ASN  64   6.727  -1.950  -1.950
  525   1HD2  ASN  64          2HD2      ASN  64   7.765  -5.706  -5.706
  526   2HD2  ASN  64          1HD2      ASN  64   8.741  -4.881  -4.881
  527    H    PHE  65           H        PHE  65   9.011  -3.532  -3.532
  528    HA   PHE  65           HA       PHE  65   9.336  -6.389  -6.389
  529   1HB   PHE  65          2HB       PHE  65   8.782  -7.225  -7.225
  530   2HB   PHE  65          1HB       PHE  65   7.394  -6.351  -6.351
  531    HD1  PHE  65           HD2      PHE  65   6.880  -4.036  -4.036
  532    HD2  PHE  65           HD1      PHE  65  10.001  -6.409  -6.409
  533    HE1  PHE  65           HE2      PHE  65   6.971  -2.489  -2.489
  534    HE2  PHE  65           HE1      PHE  65  10.107  -4.866  -4.866
  535    HZ   PHE  65           HZ       PHE  65   8.590  -2.899  -2.899
  536    H    LYS  66           H        LYS  66  10.756  -7.339  -7.339
  537    HA   LYS  66           HA       LYS  66  12.886  -5.371  -5.371
  538   1HB   LYS  66          2HB       LYS  66  14.558  -7.249  -7.249
  539   2HB   LYS  66          1HB       LYS  66  13.850  -6.550  -6.550
  540   1HG   LYS  66          2HG       LYS  66  12.094  -8.419  -8.419
  541   2HG   LYS  66          1HG       LYS  66  13.170  -9.164  -9.164
  542   1HD   LYS  66          2HD       LYS  66  14.098 -10.133 -10.133
  543   2HD   LYS  66          1HD       LYS  66  14.953  -8.596  -8.596
  544   1HE   LYS  66          2HE       LYS  66  13.549  -7.781  -7.781
  545   2HE   LYS  66          1HE       LYS  66  12.232  -8.872  -8.872
  546   1HZ   LYS  66          3HZ       LYS  66  13.944 -10.682 -10.682
  547   2HZ   LYS  66          2HZ       LYS  66  14.666  -9.419  -9.419
  548   3HZ   LYS  66          1HZ       LYS  66  13.060  -9.869  -9.869
  549    H    VAL  67           H        VAL  67  14.067  -6.036  -6.036
  550    HA   VAL  67           HA       VAL  67  12.234  -7.429  -7.429
  551    HB   VAL  67           HB       VAL  67  14.897  -6.748  -6.748
  552   1HG1  VAL  67          1HG1      VAL  67  12.031  -6.058  -6.058
  553   2HG1  VAL  67          3HG1      VAL  67  13.430  -5.629  -5.629
  554   3HG1  VAL  67          2HG1      VAL  67  13.021  -7.324  -7.324
  555   1HG2  VAL  67          1HG2      VAL  67  13.239  -4.703  -4.703
  556   2HG2  VAL  67          3HG2      VAL  67  14.992  -4.822  -4.822
  557   3HG2  VAL  67          2HG2      VAL  67  14.039  -4.251  -4.251
  558    H    GLY  68           H        GLY  68  12.270  -9.634  -9.634
  559   1HA   GLY  68          2HA       GLY  68  13.956 -11.401 -11.401
  560   2HA   GLY  68          1HA       GLY  68  14.868 -11.001 -11.001
  561    H    GLU  69           H        GLU  69  12.129 -10.659 -10.659
  562    HA   GLU  69           HA       GLU  69  11.402 -13.555 -13.555
  563   1HB   GLU  69          2HB       GLU  69  11.354 -13.336 -13.336
  564   2HB   GLU  69          1HB       GLU  69  12.967 -13.277 -13.277
  565   1HG   GLU  69          2HG       GLU  69  13.273 -11.090 -11.090
  566   2HG   GLU  69          1HG       GLU  69  11.580 -10.673 -10.673
  567    H    GLU  70           H        GLU  70   9.363 -13.922 -13.922
  568    HA   GLU  70           HA       GLU  70   7.384 -11.859 -11.859
  569   1HB   GLU  70          2HB       GLU  70   6.927 -14.557 -14.557
  570   2HB   GLU  70          1HB       GLU  70   5.728 -13.554 -13.554
  571   1HG   GLU  70          2HG       GLU  70   7.266 -13.754 -13.754
  572   2HG   GLU  70          1HG       GLU  70   8.018 -15.097 -15.097
  573    H    PHE  71           H        PHE  71   5.628 -11.441 -11.441
  574    HA   PHE  71           HA       PHE  71   6.365 -11.595 -11.595
  575   1HB   PHE  71          2HB       PHE  71   6.369  -9.092  -9.092
  576   2HB   PHE  71          1HB       PHE  71   7.757  -9.701  -9.701
  577    HD1  PHE  71           HD2      PHE  71   7.661  -9.673  -9.673
  578    HD2  PHE  71           HD1      PHE  71   4.871  -7.546  -7.546
  579    HE1  PHE  71           HE2      PHE  71   7.021  -8.257  -8.257
  580    HE2  PHE  71           HE1      PHE  71   4.232  -6.131  -6.131
  581    HZ   PHE  71           HZ       PHE  71   5.306  -6.483  -6.483
  582    H    GLU  72           H        GLU  72   4.691 -10.185 -10.185
  583    HA   GLU  72           HA       GLU  72   2.065 -10.568 -10.568
  584   1HB   GLU  72          2HB       GLU  72   2.328  -9.901  -9.901
  585   2HB   GLU  72          1HB       GLU  72   1.042 -10.767 -10.767
  586   1HG   GLU  72          2HG       GLU  72   2.587 -12.662 -12.662
  587   2HG   GLU  72          1HG       GLU  72   3.847 -11.812 -11.812
  588    H    GLU  73           H        GLU  73   0.638  -8.821  -8.821
  589    HA   GLU  73           HA       GLU  73   1.243  -6.212  -6.212
  590   1HB   GLU  73          2HB       GLU  73   1.461  -5.073  -5.073
  591   2HB   GLU  73          1HB       GLU  73   2.819  -6.139  -6.139
  592   1HG   GLU  73          2HG       GLU  73   2.199  -7.703  -7.703
  593   2HG   GLU  73          1HG       GLU  73   0.487  -7.299  -7.299
  594    H    GLN  74           H        GLN  74  -0.307  -4.557  -4.557
  595    HA   GLN  74           HA       GLN  74  -2.969  -5.945  -5.945
  596   1HB   GLN  74          2HB       GLN  74  -2.062  -3.182  -3.182
  597   2HB   GLN  74          1HB       GLN  74  -3.695  -3.382  -3.382
  598   1HG   GLN  74          2HG       GLN  74  -3.744  -5.393  -5.393
  599   2HG   GLN  74          1HG       GLN  74  -2.510  -4.417  -4.417
  600   1HE2  GLN  74          2HE2      GLN  74  -6.354  -3.325  -3.325
  601   2HE2  GLN  74          1HE2      GLN  74  -5.869  -4.829  -4.829
  602    H    THR  75           H        THR  75  -4.481  -5.366  -5.366
  603    HA   THR  75           HA       THR  75  -3.118  -4.730  -4.730
  604    HB   THR  75           HB       THR  75  -4.637  -6.718  -6.718
  605    HG1  THR  75           HG1      THR  75  -4.250  -5.818  -5.818
  606   1HG2  THR  75          3HG2      THR  75  -6.415  -4.766  -4.766
  607   2HG2  THR  75          2HG2      THR  75  -7.137  -5.422  -5.422
  608   3HG2  THR  75          1HG2      THR  75  -6.664  -6.504  -6.504
  609    H    VAL  76           H        VAL  76  -5.089  -3.511  -3.511
  610    HA   VAL  76           HA       VAL  76  -5.124  -0.837  -0.837
  611    HB   VAL  76           HB       VAL  76  -4.421  -1.130  -1.130
  612   1HG1  VAL  76          1HG1      VAL  76  -7.006  -2.565  -2.565
  613   2HG1  VAL  76          3HG1      VAL  76  -6.652  -1.520  -1.520
  614   3HG1  VAL  76          2HG1      VAL  76  -5.530  -2.806  -2.806
  615   1HG2  VAL  76          1HG2      VAL  76  -5.975   0.860   0.860
  616   2HG2  VAL  76          3HG2      VAL  76  -5.385   0.833   0.833
  617   3HG2  VAL  76          2HG2      VAL  76  -7.020   0.281   0.281
  618    H    ASP  77           H        ASP  77  -7.297  -3.440  -3.440
  619    HA   ASP  77           HA       ASP  77  -9.678  -1.685  -1.685
  620   1HB   ASP  77          2HB       ASP  77  -9.315  -4.189  -4.189
  621   2HB   ASP  77          1HB       ASP  77 -10.031  -4.562  -4.562
  622    H    GLY  78           H        GLY  78  -8.274  -4.245  -4.245
  623   1HA   GLY  78          2HA       GLY  78  -8.020  -3.197  -3.197
  624   2HA   GLY  78          1HA       GLY  78  -9.779  -3.264  -3.264
  625    H    ARG  79           H        ARG  79  -7.318  -5.532  -5.532
  626    HA   ARG  79           HA       ARG  79  -8.382  -7.614  -7.614
  627   1HB   ARG  79          2HB       ARG  79  -8.207  -7.609  -7.609
  628   2HB   ARG  79          1HB       ARG  79  -8.008  -9.120  -9.120
  629   1HG   ARG  79          2HG       ARG  79 -10.321  -7.327  -7.327
  630   2HG   ARG  79          1HG       ARG  79 -10.407  -8.373  -8.373
  631   1HD   ARG  79          2HD       ARG  79  -9.749  -9.348  -9.348
  632   2HD   ARG  79          1HD       ARG  79 -11.353  -9.433  -9.433
  633    HE   ARG  79           HE       ARG  79  -8.983 -10.849 -10.849
  634   1HH1  ARG  79          2HH1      ARG  79 -12.075 -10.322 -10.322
  635   2HH1  ARG  79          1HH1      ARG  79 -12.619 -11.964 -11.964
  636   1HH2  ARG  79          1HH2      ARG  79  -9.777 -13.092 -13.092
  637   2HH2  ARG  79          2HH2      ARG  79 -11.317 -13.532 -13.532
  638    HA   PRO  80           HA       PRO  80  -4.040  -8.421  -8.421
  639   1HB   PRO  80          2HB       PRO  80  -4.136 -11.006 -11.006
  640   2HB   PRO  80          1HB       PRO  80  -4.523  -9.587  -9.587
  641   1HG   PRO  80          2HG       PRO  80  -6.364 -11.610 -11.610
  642   2HG   PRO  80          1HG       PRO  80  -6.589 -10.589 -10.589
  643   1HD   PRO  80          2HD       PRO  80  -7.728 -10.148 -10.148
  644   2HD   PRO  80          1HD       PRO  80  -7.685  -8.986  -8.986
  645    H    CYS  81           H        CYS  81  -2.410  -9.274  -9.274
  646    HA   CYS  81           HA       CYS  81  -2.783 -11.675 -11.675
  647   1HB   CYS  81          2HB       CYS  81  -2.363 -10.481 -10.481
  648   2HB   CYS  81          1HB       CYS  81  -3.945 -10.145 -10.145
  649    HG   CYS  81           HG       CYS  81  -1.537  -8.146  -8.146
  650    H    LYS  82           H        LYS  82  -0.802 -12.516 -12.516
  651    HA   LYS  82           HA       LYS  82   1.586 -11.168 -11.168
  652   1HB   LYS  82          2HB       LYS  82   1.260 -13.565 -13.565
  653   2HB   LYS  82          1HB       LYS  82   1.212 -13.893 -13.893
  654   1HG   LYS  82          2HG       LYS  82   3.557 -12.697 -12.697
  655   2HG   LYS  82          1HG       LYS  82   3.537 -13.121 -13.121
  656   1HD   LYS  82          2HD       LYS  82   2.679 -15.418 -15.418
  657   2HD   LYS  82          1HD       LYS  82   4.153 -14.805 -14.805
  658   1HE   LYS  82          2HE       LYS  82   4.907 -16.298 -16.298
  659   2HE   LYS  82          1HE       LYS  82   5.118 -14.692 -14.692
  660   1HZ   LYS  82          3HZ       LYS  82   2.736 -16.408 -16.408
  661   2HZ   LYS  82          2HZ       LYS  82   4.044 -16.292 -16.292
  662   3HZ   LYS  82          1HZ       LYS  82   3.079 -14.931 -14.931
  663    H    SER  83           H        SER  83   2.692  -9.828  -9.828
  664    HA   SER  83           HA       SER  83   2.340 -10.040 -10.040
  665   1HB   SER  83          2HB       SER  83   1.937  -7.832  -7.832
  666   2HB   SER  83          1HB       SER  83   3.119  -7.872  -7.872
  667    HG   SER  83           HG       SER  83   3.708  -6.654  -6.654
  668    H    LEU  84           H        LEU  84   4.351  -9.543  -9.543
  669    HA   LEU  84           HA       LEU  84   6.909 -10.317 -10.317
  670   1HB   LEU  84          2HB       LEU  84   6.040 -12.485 -12.485
  671   2HB   LEU  84          1HB       LEU  84   5.687 -11.812 -11.812
  672    HG   LEU  84           HG       LEU  84   8.069 -11.457 -11.457
  673   1HD1  LEU  84          2HD1      LEU  84   8.301 -11.630 -11.630
  674   2HD1  LEU  84          1HD1      LEU  84   9.204 -12.990 -12.990
  675   3HD1  LEU  84          3HD1      LEU  84   9.589 -11.349 -11.349
  676   1HD2  LEU  84          3HD2      LEU  84   6.826 -13.777 -13.777
  677   2HD2  LEU  84          2HD2      LEU  84   8.565 -13.674 -13.674
  678   3HD2  LEU  84          1HD2      LEU  84   7.952 -14.242 -14.242
  679    H    VAL  85           H        VAL  85   8.724  -9.576  -9.576
  680    HA   VAL  85           HA       VAL  85   7.935  -7.968  -7.968
  681    HB   VAL  85           HB       VAL  85   9.613  -6.783  -6.783
  682   1HG1  VAL  85          2HG1      VAL  85   9.766  -5.954  -5.954
  683   2HG1  VAL  85          1HG1      VAL  85   8.092  -5.428  -5.428
  684   3HG1  VAL  85          3HG1      VAL  85   9.346  -4.736  -4.736
  685   1HG2  VAL  85          2HG2      VAL  85   6.645  -6.758  -6.758
  686   2HG2  VAL  85          1HG2      VAL  85   7.532  -6.918  -6.918
  687   3HG2  VAL  85          3HG2      VAL  85   7.426  -5.353  -5.353
  688    H    LYS  86           H        LYS  86   9.342  -8.198  -8.198
  689    HA   LYS  86           HA       LYS  86  12.183  -8.852  -8.852
  690   1HB   LYS  86          2HB       LYS  86  12.003  -9.850  -9.850
  691   2HB   LYS  86          1HB       LYS  86  11.653 -10.835 -10.835
  692   1HG   LYS  86          2HG       LYS  86   9.223 -10.211 -10.211
  693   2HG   LYS  86          1HG       LYS  86   9.653  -9.418  -9.418
  694   1HD   LYS  86          2HD       LYS  86  10.661 -11.623 -11.623
  695   2HD   LYS  86          1HD       LYS  86   9.925 -12.356 -12.356
  696   1HE   LYS  86          2HE       LYS  86   7.701 -11.501 -11.501
  697   2HE   LYS  86          1HE       LYS  86   8.474 -10.923 -10.923
  698   1HZ   LYS  86          2HZ       LYS  86   9.325 -13.350 -13.350
  699   2HZ   LYS  86          1HZ       LYS  86   8.015 -13.684 -13.684
  700   3HZ   LYS  86          3HZ       LYS  86   7.740 -12.989 -12.989
  701    H    TRP  87           H        TRP  87  13.686  -7.895  -7.895
  702    HA   TRP  87           HA       TRP  87  12.747  -5.254  -5.254
  703   1HB   TRP  87          2HB       TRP  87  15.384  -6.727  -6.727
  704   2HB   TRP  87          1HB       TRP  87  15.142  -5.183  -5.183
  705    HD1  TRP  87           HD1      TRP  87  16.014  -6.700  -6.700
  706    HE1  TRP  87           HE1      TRP  87  16.161  -4.911  -4.911
  707    HE3  TRP  87           HE3      TRP  87  13.861  -2.785  -2.785
  708    HZ2  TRP  87           HZ2      TRP  87  15.452  -2.167  -2.167
  709    HZ3  TRP  87           HZ3      TRP  87  13.580  -0.596  -0.596
  710    HH2  TRP  87           HH2      TRP  87  14.374  -0.287  -0.287
  711    H    GLU  88           H        GLU  88  13.462  -4.561  -4.561
  712    HA   GLU  88           HA       GLU  88  12.958  -6.667  -6.667
  713   1HB   GLU  88          2HB       GLU  88  10.893  -5.205  -5.205
  714   2HB   GLU  88          1HB       GLU  88  11.742  -3.923  -3.923
  715   1HG   GLU  88          2HG       GLU  88  10.451  -4.866  -4.866
  716   2HG   GLU  88          1HG       GLU  88  12.006  -5.673  -5.673
  717    H    SER  89           H        SER  89  13.845  -3.324  -3.324
  718    HA   SER  89           HA       SER  89  16.035  -3.501  -3.501
  719   1HB   SER  89          2HB       SER  89  15.560  -1.246  -1.246
  720   2HB   SER  89          1HB       SER  89  14.047  -2.143  -2.143
  721    HG   SER  89           HG       SER  89  13.846  -0.087  -0.087
  722    H    GLU  90           H        GLU  90  16.874  -0.757  -0.757
  723    HA   GLU  90           HA       GLU  90  18.296  -1.455  -1.455
  724   1HB   GLU  90          2HB       GLU  90  18.241   1.259   1.259
  725   2HB   GLU  90          1HB       GLU  90  19.499   0.602   0.602
  726   1HG   GLU  90          2HG       GLU  90  19.482  -1.310  -1.310
  727   2HG   GLU  90          1HG       GLU  90  18.947   0.060   0.060
  728    H    ASN  91           H        ASN  91  15.432   0.389   0.389
  729    HA   ASN  91           HA       ASN  91  15.063   0.879   0.879
  730   1HB   ASN  91          2HB       ASN  91  14.504   3.034   3.034
  731   2HB   ASN  91          1HB       ASN  91  14.500   3.179   3.179
  732   1HD2  ASN  91          2HD2      ASN  91  17.846   4.100   4.100
  733   2HD2  ASN  91          1HD2      ASN  91  16.281   4.192   4.192
  734    H    LYS  92           H        LYS  92  13.787  -0.957  -0.957
  735    HA   LYS  92           HA       LYS  92  10.998  -0.020  -0.020
  736   1HB   LYS  92          2HB       LYS  92  11.572   0.416   0.416
  737   2HB   LYS  92          1HB       LYS  92  12.034  -1.274  -1.274
  738   1HG   LYS  92          2HG       LYS  92   9.646  -1.829  -1.829
  739   2HG   LYS  92          1HG       LYS  92   9.287  -0.132  -0.132
  740   1HD   LYS  92          2HD       LYS  92  10.231  -0.491  -0.491
  741   2HD   LYS  92          1HD       LYS  92  10.225  -2.218  -2.218
  742   1HE   LYS  92          2HE       LYS  92   7.765  -1.967  -1.967
  743   2HE   LYS  92          1HE       LYS  92   7.849  -0.345  -0.345
  744   1HZ   LYS  92          1HZ       LYS  92   8.611  -1.317  -1.317
  745   2HZ   LYS  92          3HZ       LYS  92   8.495  -2.873  -2.873
  746   3HZ   LYS  92          2HZ       LYS  92   7.093  -1.938  -1.938
  747    H    MET  93           H        MET  93  10.286  -1.516  -1.516
  748    HA   MET  93           HA       MET  93  10.991  -4.376  -4.376
  749   1HB   MET  93          2HB       MET  93  10.700  -4.794  -4.794
  750   2HB   MET  93          1HB       MET  93  11.955  -3.602  -3.602
  751   1HG   MET  93          2HG       MET  93   9.654  -2.070  -2.070
  752   2HG   MET  93          1HG       MET  93   9.411  -3.323  -3.323
  753   1HE   MET  93          2HE       MET  93  11.176  -4.201  -4.201
  754   2HE   MET  93          1HE       MET  93  12.823  -3.749  -3.749
  755   3HE   MET  93          3HE       MET  93  12.117  -3.186  -3.186
  756    H    VAL  94           H        VAL  94   9.352  -5.921  -5.921
  757    HA   VAL  94           HA       VAL  94   6.601  -4.839  -4.839
  758    HB   VAL  94           HB       VAL  94   7.349  -7.714  -7.714
  759   1HG1  VAL  94          2HG1      VAL  94   5.203  -5.814  -5.814
  760   2HG1  VAL  94          1HG1      VAL  94   5.615  -7.084  -7.084
  761   3HG1  VAL  94          3HG1      VAL  94   5.082  -7.504  -7.504
  762   1HG2  VAL  94          2HG2      VAL  94   7.978  -5.366  -5.366
  763   2HG2  VAL  94          1HG2      VAL  94   9.012  -6.731  -6.731
  764   3HG2  VAL  94          3HG2      VAL  94   7.656  -6.960  -6.960
  765    H    CYS  95           H        CYS  95   4.882  -6.431  -6.431
  766    HA   CYS  95           HA       CYS  95   5.869  -7.683  -7.683
  767   1HB   CYS  95          2HB       CYS  95   5.389  -5.309  -5.309
  768   2HB   CYS  95          1HB       CYS  95   3.740  -5.521  -5.521
  769    HG   CYS  95           HG       CYS  95   3.486  -7.405  -7.405
  770    H    GLU  96           H        GLU  96   4.699  -9.438  -9.438
  771    HA   GLU  96           HA       GLU  96   2.173  -9.972  -9.972
  772   1HB   GLU  96          2HB       GLU  96   3.825 -11.940 -11.940
  773   2HB   GLU  96          1HB       GLU  96   2.546 -12.310 -12.310
  774   1HG   GLU  96          2HG       GLU  96   4.960 -10.774 -10.774
  775   2HG   GLU  96          1HG       GLU  96   5.063 -12.525 -12.525
  776    H    GLN  97           H        GLN  97   0.452 -11.100 -11.100
  777    HA   GLN  97           HA       GLN  97   0.707 -10.651 -10.651
  778   1HB   GLN  97          2HB       GLN  97   0.043  -8.441  -8.441
  779   2HB   GLN  97          1HB       GLN  97  -1.559  -9.151  -9.151
  780   1HG   GLN  97          2HG       GLN  97  -0.916  -9.472  -9.472
  781   2HG   GLN  97          1HG       GLN  97   0.358  -8.301  -8.301
  782   1HE2  GLN  97          2HE2      GLN  97  -1.835  -5.539  -5.539
  783   2HE2  GLN  97          1HE2      GLN  97  -0.235  -6.093  -6.093
  784    H    LYS  98           H        LYS  98  -0.611 -11.983 -11.983
  785    HA   LYS  98           HA       LYS  98  -3.065 -13.054 -13.054
  786   1HB   LYS  98          2HB       LYS  98  -2.428 -15.365 -15.365
  787   2HB   LYS  98          1HB       LYS  98  -1.342 -14.720 -14.720
  788   1HG   LYS  98          2HG       LYS  98   0.274 -14.076 -14.076
  789   2HG   LYS  98          1HG       LYS  98  -0.812 -14.691 -14.691
  790   1HD   LYS  98          2HD       LYS  98  -0.133 -16.569 -16.569
  791   2HD   LYS  98          1HD       LYS  98   1.164 -16.185 -16.185
  792   1HE   LYS  98          2HE       LYS  98   0.229 -17.869 -17.869
  793   2HE   LYS  98          1HE       LYS  98  -0.882 -16.599 -16.599
  794   1HZ   LYS  98          3HZ       LYS  98  -1.326 -18.385 -18.385
  795   2HZ   LYS  98          2HZ       LYS  98  -2.016 -18.615 -18.615
  796   3HZ   LYS  98          1HZ       LYS  98  -2.414 -17.241 -17.241
  797    H    LEU  99           H        LEU  99  -4.634 -13.747 -13.747
  798    HA   LEU  99           HA       LEU  99  -4.597 -12.253 -12.253
  799   1HB   LEU  99          2HB       LEU  99  -6.150 -14.726 -14.726
  800   2HB   LEU  99          1HB       LEU  99  -6.455 -13.796 -13.796
  801    HG   LEU  99           HG       LEU  99  -6.347 -12.276 -12.276
  802   1HD1  LEU  99          1HD1      LEU  99  -8.488 -14.267 -14.267
  803   2HD1  LEU  99          3HD1      LEU  99  -8.854 -12.859 -12.859
  804   3HD1  LEU  99          2HD1      LEU  99  -7.687 -14.057 -14.057
  805   1HD2  LEU  99          3HD2      LEU  99  -6.856 -11.545 -11.545
  806   2HD2  LEU  99          2HD2      LEU  99  -7.739 -10.817 -10.817
  807   3HD2  LEU  99          1HD2      LEU  99  -8.477 -12.112 -12.112
  808    H    LEU 100           H        LEU 100  -4.750 -13.223 -13.223
  809    HA   LEU 100           HA       LEU 100  -2.615 -15.236 -15.236
  810   1HB   LEU 100          2HB       LEU 100  -3.903 -13.174 -13.174
  811   2HB   LEU 100          1HB       LEU 100  -2.910 -14.479 -14.479
  812    HG   LEU 100           HG       LEU 100  -1.943 -12.650 -12.650
  813   1HD1  LEU 100          3HD1      LEU 100  -1.904 -12.319 -12.319
  814   2HD1  LEU 100          2HD1      LEU 100  -0.583 -11.673 -11.673
  815   3HD1  LEU 100          1HD1      LEU 100  -2.234 -11.114 -11.114
  816   1HD2  LEU 100          1HD2      LEU 100  -0.824 -14.842 -14.842
  817   2HD2  LEU 100          3HD2      LEU 100  -0.461 -14.412 -14.412
  818   3HD2  LEU 100          2HD2      LEU 100   0.245 -13.483 -13.483
  819    H    LYS 101           H        LYS 101  -5.980 -15.061 -15.061
  820    HA   LYS 101           HA       LYS 101  -6.263 -17.708 -17.708
  821   1HB   LYS 101          2HB       LYS 101  -6.786 -15.633 -15.633
  822   2HB   LYS 101          1HB       LYS 101  -8.343 -15.733 -15.733
  823   1HG   LYS 101          2HG       LYS 101  -7.150 -18.296 -18.296
  824   2HG   LYS 101          1HG       LYS 101  -7.783 -17.208 -17.208
  825   1HD   LYS 101          2HD       LYS 101  -9.963 -17.227 -17.227
  826   2HD   LYS 101          1HD       LYS 101  -9.386 -17.938 -17.938
  827   1HE   LYS 101          2HE       LYS 101  -8.946 -19.450 -19.450
  828   2HE   LYS 101          1HE       LYS 101 -10.562 -19.445 -19.445
  829   1HZ   LYS 101          1HZ       LYS 101  -8.240 -19.997 -19.997
  830   2HZ   LYS 101          3HZ       LYS 101  -8.839 -21.228 -21.228
  831   3HZ   LYS 101          2HZ       LYS 101  -9.849 -20.515 -20.515
  832    H    GLY 102           H        GLY 102  -7.790 -18.911 -18.911
  833   1HA   GLY 102          2HA       GLY 102  -9.399 -19.435 -19.435
  834   2HA   GLY 102          1HA       GLY 102 -10.035 -17.804 -17.804
  835    H    GLU 103           H        GLU 103 -10.303 -17.750 -17.750
  836    HA   GLU 103           HA       GLU 103  -8.166 -16.386 -16.386
  837   1HB   GLU 103          2HB       GLU 103  -7.221 -18.703 -18.703
  838   2HB   GLU 103          1HB       GLU 103  -8.626 -19.219 -19.219
  839   1HG   GLU 103          2HG       GLU 103  -8.050 -17.827 -17.827
  840   2HG   GLU 103          1HG       GLU 103  -6.871 -16.929 -16.929
  841    H    GLY 104           H        GLY 104  -8.938 -15.369 -15.369
  842   1HA   GLY 104          2HA       GLY 104 -11.322 -16.335 -16.335
  843   2HA   GLY 104          1HA       GLY 104 -11.553 -14.829 -14.829
  844    HA   PRO 105           HA       PRO 105  -9.691 -12.791 -12.791
  845   1HB   PRO 105          2HB       PRO 105  -9.025 -10.406 -10.406
  846   2HB   PRO 105          1HB       PRO 105 -10.688 -10.849 -10.849
  847   1HG   PRO 105          2HG       PRO 105  -9.413 -10.708 -10.708
  848   2HG   PRO 105          1HG       PRO 105 -11.129 -10.620 -10.620
  849   1HD   PRO 105          2HD       PRO 105  -9.739 -12.894 -12.894
  850   2HD   PRO 105          1HD       PRO 105 -11.413 -12.846 -12.846
  851    H    LYS 106           H        LYS 106  -7.559 -11.290 -11.290
  852    HA   LYS 106           HA       LYS 106  -5.316 -12.375 -12.375
  853   1HB   LYS 106          2HB       LYS 106  -5.506 -13.723 -13.723
  854   2HB   LYS 106          1HB       LYS 106  -5.438 -12.247 -12.247
  855   1HG   LYS 106          2HG       LYS 106  -3.202 -11.847 -11.847
  856   2HG   LYS 106          1HG       LYS 106  -3.265 -12.847 -12.847
  857   1HD   LYS 106          2HD       LYS 106  -3.454 -14.872 -14.872
  858   2HD   LYS 106          1HD       LYS 106  -3.447 -13.889 -13.889
  859   1HE   LYS 106          2HE       LYS 106  -1.199 -14.135 -14.135
  860   2HE   LYS 106          1HE       LYS 106  -1.204 -14.756 -14.756
  861   1HZ   LYS 106          1HZ       LYS 106  -1.570 -12.390 -12.390
  862   2HZ   LYS 106          3HZ       LYS 106  -1.208 -11.928 -11.928
  863   3HZ   LYS 106          2HZ       LYS 106  -0.040 -12.730 -12.730
  864    H    THR 107           H        THR 107  -3.760 -10.792 -10.792
  865    HA   THR 107           HA       THR 107  -4.115  -8.189  -8.189
  866    HB   THR 107           HB       THR 107  -2.989  -7.479  -7.479
  867    HG1  THR 107           HG1      THR 107  -3.455  -9.708  -9.708
  868   1HG2  THR 107          2HG2      THR 107  -5.874  -7.627  -7.627
  869   2HG2  THR 107          1HG2      THR 107  -5.360  -6.782  -6.782
  870   3HG2  THR 107          3HG2      THR 107  -4.776  -6.251  -6.251
  871    H    SER 108           H        SER 108  -2.295  -7.051  -7.051
  872    HA   SER 108           HA       SER 108   0.387  -7.831  -7.831
  873   1HB   SER 108          2HB       SER 108  -0.381  -8.240  -8.240
  874   2HB   SER 108          1HB       SER 108   1.201  -8.522  -8.522
  875    HG   SER 108           HG       SER 108   0.139 -10.475 -10.475
  876    H    TRP 109           H        TRP 109   1.714  -5.973  -5.973
  877    HA   TRP 109           HA       TRP 109   0.710  -3.906  -3.906
  878   1HB   TRP 109          2HB       TRP 109   1.148  -2.134  -2.134
  879   2HB   TRP 109          1HB       TRP 109  -0.240  -3.165  -3.165
  880    HD1  TRP 109           HD1      TRP 109  -0.180  -4.666  -4.666
  881    HE1  TRP 109           HE1      TRP 109   1.485  -4.926  -4.926
  882    HE3  TRP 109           HE3      TRP 109   3.781  -2.038  -2.038
  883    HZ2  TRP 109           HZ2      TRP 109   4.141  -4.125  -4.125
  884    HZ3  TRP 109           HZ3      TRP 109   5.855  -1.806  -1.806
  885    HH2  TRP 109           HH2      TRP 109   6.051  -2.842  -2.842
  886    H    THR 110           H        THR 110   2.379  -2.010  -2.010
  887    HA   THR 110           HA       THR 110   5.143  -3.099  -3.099
  888    HB   THR 110           HB       THR 110   5.741  -2.519  -2.519
  889    HG1  THR 110           HG1      THR 110   4.778  -0.975  -0.975
  890   1HG2  THR 110          2HG2      THR 110   3.852  -4.427  -4.427
  891   2HG2  THR 110          1HG2      THR 110   3.020  -3.410  -3.410
  892   3HG2  THR 110          3HG2      THR 110   4.586  -4.116  -4.116
  893    H    MET 111           H        MET 111   6.782  -1.338  -1.338
  894    HA   MET 111           HA       MET 111   5.819   1.418   1.418
  895   1HB   MET 111          2HB       MET 111   7.348   1.637   1.637
  896   2HB   MET 111          1HB       MET 111   5.906   0.661   0.661
  897   1HG   MET 111          2HG       MET 111   7.224  -1.390  -1.390
  898   2HG   MET 111          1HG       MET 111   8.665  -0.407  -0.407
  899   1HE   MET 111          3HE       MET 111   9.905   0.591   0.591
  900   2HE   MET 111          2HE       MET 111   9.336   1.523   1.523
  901   3HE   MET 111          1HE       MET 111  10.269   0.052   0.052
  902    H    GLU 112           H        GLU 112   7.023   2.620   2.620
  903    HA   GLU 112           HA       GLU 112   9.819   1.691   1.691
  904   1HB   GLU 112          2HB       GLU 112   8.222   1.525   1.525
  905   2HB   GLU 112          1HB       GLU 112   7.999   3.270   3.270
  906   1HG   GLU 112          2HG       GLU 112  10.142   3.729   3.729
  907   2HG   GLU 112          1HG       GLU 112  10.791   2.202   2.202
  908    H    LEU 113           H        LEU 113  11.427   3.317   3.317
  909    HA   LEU 113           HA       LEU 113  10.724   5.976   5.976
  910   1HB   LEU 113          2HB       LEU 113  12.523   4.099   4.099
  911   2HB   LEU 113          1HB       LEU 113  13.557   5.133   5.133
  912    HG   LEU 113           HG       LEU 113  13.372   5.758   5.758
  913   1HD1  LEU 113          2HD1      LEU 113  14.024   7.343   7.343
  914   2HD1  LEU 113          1HD1      LEU 113  12.359   7.918   7.918
  915   3HD1  LEU 113          3HD1      LEU 113  13.361   8.105   8.105
  916   1HD2  LEU 113          1HD2      LEU 113  10.827   5.292   5.292
  917   2HD2  LEU 113          3HD2      LEU 113  11.407   6.694   6.694
  918   3HD2  LEU 113          2HD2      LEU 113  10.682   6.907   6.907
  919    H    THR 114           H        THR 114  11.497   7.802   7.802
  920    HA   THR 114           HA       THR 114  12.432   7.143   7.143
  921    HB   THR 114           HB       THR 114  11.817   9.457   9.457
  922    HG1  THR 114           HG1      THR 114  11.013   9.628   9.628
  923   1HG2  THR 114          3HG2      THR 114   9.876   7.660   7.660
  924   2HG2  THR 114          2HG2      THR 114   9.330   9.249   9.249
  925   3HG2  THR 114          1HG2      THR 114   9.965   8.091   8.091
  926    H    ASN 115           H        ASN 115  14.157   8.498   8.498
  927    HA   ASN 115           HA       ASN 115  16.522   8.503   8.503
  928   1HB   ASN 115          2HB       ASN 115  15.926  10.036  10.036
  929   2HB   ASN 115          1HB       ASN 115  17.535   9.744   9.744
  930   1HD2  ASN 115          2HD2      ASN 115  17.759   6.525   6.525
  931   2HD2  ASN 115          1HD2      ASN 115  18.547   7.826   7.826
  932    H    ASP 116           H        ASP 116  14.005  10.885  10.885
  933    HA   ASP 116           HA       ASP 116  15.668  13.096  13.096
  934   1HB   ASP 116          2HB       ASP 116  12.701  12.786  12.786
  935   2HB   ASP 116          1HB       ASP 116  13.403  14.259  14.259
  936    H    GLY 117           H        GLY 117  13.491  10.675  10.675
  937   1HA   GLY 117          2HA       GLY 117  14.013  10.127  10.127
  938   2HA   GLY 117          1HA       GLY 117  13.867  11.855  11.855
  939    H    GLU 118           H        GLU 118  11.561  11.423  11.423
  940    HA   GLU 118           HA       GLU 118   9.365  11.637  11.637
  941   1HB   GLU 118          2HB       GLU 118   9.330  10.670  10.670
  942   2HB   GLU 118          1HB       GLU 118   7.950  11.290  11.290
  943   1HG   GLU 118          2HG       GLU 118   8.684  13.475  13.475
  944   2HG   GLU 118          1HG       GLU 118  10.385  13.011  13.011
  945    H    LEU 119           H        LEU 119   7.499   9.943   9.943
  946    HA   LEU 119           HA       LEU 119   8.568   7.167   7.167
  947   1HB   LEU 119          2HB       LEU 119   8.867   8.150   8.150
  948   2HB   LEU 119          1HB       LEU 119   7.116   8.289   8.289
  949    HG   LEU 119           HG       LEU 119   8.486   5.663   5.663
  950   1HD1  LEU 119          2HD1      LEU 119   8.110   7.122   7.122
  951   2HD1  LEU 119          1HD1      LEU 119   7.903   5.372   5.372
  952   3HD1  LEU 119          3HD1      LEU 119   9.437   6.081   6.081
  953   1HD2  LEU 119          3HD2      LEU 119   5.740   6.605   6.605
  954   2HD2  LEU 119          2HD2      LEU 119   6.218   5.337   5.337
  955   3HD2  LEU 119          1HD2      LEU 119   6.264   5.034   5.034
  956    H    ILE 120           H        ILE 120   7.162   6.111   6.111
  957    HA   ILE 120           HA       ILE 120   4.287   6.901   6.901
  958    HB   ILE 120           HB       ILE 120   5.257   6.842   6.842
  959   1HG1  ILE 120          2HG1      ILE 120   3.547   4.363   4.363
  960   2HG1  ILE 120          1HG1      ILE 120   2.886   5.992   5.992
  961   1HG2  ILE 120          2HG2      ILE 120   6.092   4.075   4.075
  962   2HG2  ILE 120          1HG2      ILE 120   5.926   4.484   4.484
  963   3HG2  ILE 120          3HG2      ILE 120   7.082   5.356   5.356
  964   1HD1  ILE 120          1HD1      ILE 120   4.159   6.366   6.366
  965   2HD1  ILE 120          3HD1      ILE 120   4.010   4.612   4.612
  966   3HD1  ILE 120          2HD1      ILE 120   2.565   5.613   5.613
  967    H    LEU 121           H        LEU 121   2.692   5.309   5.309
  968    HA   LEU 121           HA       LEU 121   3.746   2.753   2.753
  969   1HB   LEU 121          2HB       LEU 121   3.254   4.192   4.192
  970   2HB   LEU 121          1HB       LEU 121   1.745   4.725   4.725
  971    HG   LEU 121           HG       LEU 121   1.680   3.000   3.000
  972   1HD1  LEU 121          1HD1      LEU 121  -0.120   3.703   3.703
  973   2HD1  LEU 121          3HD1      LEU 121   0.088   2.023   2.023
  974   3HD1  LEU 121          2HD1      LEU 121  -0.429   2.400   2.400
  975   1HD2  LEU 121          3HD2      LEU 121   3.369   1.497   1.497
  976   2HD2  LEU 121          2HD2      LEU 121   1.957   0.713   0.713
  977   3HD2  LEU 121          1HD2      LEU 121   2.014   1.029   1.029
  978    H    THR 122           H        THR 122   2.944   1.201   1.201
  979    HA   THR 122           HA       THR 122   0.237   1.633   1.633
  980    HB   THR 122           HB       THR 122   1.566  -0.791  -0.791
  981    HG1  THR 122           HG1      THR 122   3.259   0.361   0.361
  982   1HG2  THR 122          2HG2      THR 122  -0.269   0.450   0.450
  983   2HG2  THR 122          1HG2      THR 122   0.854   1.777   1.777
  984   3HG2  THR 122          3HG2      THR 122   1.136   0.202   0.202
  985    H    MET 123           H        MET 123  -1.063  -0.500  -0.500
  986    HA   MET 123           HA       MET 123  -0.656  -2.304  -2.304
  987   1HB   MET 123          2HB       MET 123  -3.213  -0.710  -0.710
  988   2HB   MET 123          1HB       MET 123  -2.870  -1.880  -1.880
  989   1HG   MET 123          2HG       MET 123  -0.888  -0.419  -0.419
  990   2HG   MET 123          1HG       MET 123  -1.544   0.801   0.801
  991   1HE   MET 123          3HE       MET 123  -1.374  -0.775  -0.775
  992   2HE   MET 123          2HE       MET 123  -2.825  -0.401  -0.401
  993   3HE   MET 123          1HE       MET 123  -2.868  -1.677  -1.677
  994    H    THR 124           H        THR 124  -2.299  -4.070  -4.070
  995    HA   THR 124           HA       THR 124  -3.669  -4.502  -4.502
  996    HB   THR 124           HB       THR 124  -1.820  -6.635  -6.635
  997    HG1  THR 124           HG1      THR 124  -0.219  -5.572  -5.572
  998   1HG2  THR 124          1HG2      THR 124  -3.721  -7.167  -7.167
  999   2HG2  THR 124          3HG2      THR 124  -2.956  -6.118  -6.118
 1000   3HG2  THR 124          2HG2      THR 124  -2.129  -7.572  -7.572
 1001    H    ALA 125           H        ALA 125  -5.263  -6.124  -6.124
 1002    HA   ALA 125           HA       ALA 125  -5.650  -7.590  -7.590
 1003   1HB   ALA 125          1HB       ALA 125  -6.574  -5.329  -5.329
 1004   2HB   ALA 125          3HB       ALA 125  -7.690  -5.514  -5.514
 1005   3HB   ALA 125          2HB       ALA 125  -7.806  -6.590  -6.590
 1006    H    ASP 126           H        ASP 126  -5.737  -9.466  -9.466
 1007    HA   ASP 126           HA       ASP 126  -6.874 -11.198 -11.198
 1008   1HB   ASP 126          2HB       ASP 126  -8.968  -9.397  -9.397
 1009   2HB   ASP 126          1HB       ASP 126  -9.109  -9.760  -9.760
 1010    H    ASP 127           H        ASP 127  -7.945  -8.476  -8.476
 1011    HA   ASP 127           HA       ASP 127  -5.825  -9.079  -9.079
 1012   1HB   ASP 127          2HB       ASP 127  -7.483  -9.326  -9.326
 1013   2HB   ASP 127          1HB       ASP 127  -7.576 -10.635 -10.635
 1014    H    VAL 128           H        VAL 128  -6.825  -6.838  -6.838
 1015    HA   VAL 128           HA       VAL 128  -7.069  -4.778  -4.778
 1016    HB   VAL 128           HB       VAL 128  -8.399  -3.428  -3.428
 1017   1HG1  VAL 128          2HG1      VAL 128  -9.357  -5.509  -5.509
 1018   2HG1  VAL 128          1HG1      VAL 128  -9.648  -6.133  -6.133
 1019   3HG1  VAL 128          3HG1      VAL 128 -10.382  -4.612  -4.612
 1020   1HG2  VAL 128          3HG2      VAL 128  -7.522  -5.518  -5.518
 1021   2HG2  VAL 128          2HG2      VAL 128  -7.738  -3.786  -3.786
 1022   3HG2  VAL 128          1HG2      VAL 128  -9.141  -4.852  -4.852
 1023    H    VAL 129           H        VAL 129  -6.360  -2.544  -2.544
 1024    HA   VAL 129           HA       VAL 129  -4.182  -2.945  -2.945
 1025    HB   VAL 129           HB       VAL 129  -3.737  -2.528  -2.528
 1026   1HG1  VAL 129          2HG1      VAL 129  -2.278  -1.019  -1.019
 1027   2HG1  VAL 129          1HG1      VAL 129  -1.329  -1.692  -1.692
 1028   3HG1  VAL 129          3HG1      VAL 129  -2.625  -0.545  -0.545
 1029   1HG2  VAL 129          1HG2      VAL 129  -2.625  -4.119  -4.119
 1030   2HG2  VAL 129          3HG2      VAL 129  -3.019  -4.616  -4.616
 1031   3HG2  VAL 129          2HG2      VAL 129  -1.532  -3.724  -3.724
 1032    H    CYS 130           H        CYS 130  -4.399  -1.304  -1.304
 1033    HA   CYS 130           HA       CYS 130  -5.517   1.281   1.281
 1034   1HB   CYS 130          2HB       CYS 130  -6.532   0.150   0.150
 1035   2HB   CYS 130          1HB       CYS 130  -5.007   0.438   0.438
 1036    HG   CYS 130           HG       CYS 130  -5.415   3.045   3.045
 1037    H    THR 131           H        THR 131  -4.197   3.080   3.080
 1038    HA   THR 131           HA       THR 131  -1.445   2.795   2.795
 1039    HB   THR 131           HB       THR 131  -2.296   4.342   4.342
 1040    HG1  THR 131           HG1      THR 131  -2.461   2.099   2.099
 1041   1HG2  THR 131          1HG2      THR 131   0.369   3.707   3.707
 1042   2HG2  THR 131          3HG2      THR 131   0.214   4.277   4.277
 1043   3HG2  THR 131          2HG2      THR 131  -0.320   5.298   5.298
 1044    H    ARG 132           H        ARG 132  -0.468   4.753   4.753
 1045    HA   ARG 132           HA       ARG 132  -2.099   7.165   7.165
 1046   1HB   ARG 132          2HB       ARG 132  -0.976   5.647   5.647
 1047   2HB   ARG 132          1HB       ARG 132  -1.813   7.197   7.197
 1048   1HG   ARG 132          2HG       ARG 132  -3.810   6.055   6.055
 1049   2HG   ARG 132          1HG       ARG 132  -2.965   4.523   4.523
 1050   1HD   ARG 132          2HD       ARG 132  -3.206   6.347   6.347
 1051   2HD   ARG 132          1HD       ARG 132  -4.635   5.444   5.444
 1052    HE   ARG 132           HE       ARG 132  -2.111   3.933   3.933
 1053   1HH1  ARG 132          1HH1      ARG 132  -5.423   2.564   2.564
 1054   2HH1  ARG 132          2HH1      ARG 132  -5.186   3.158   3.158
 1055   1HH2  ARG 132          1HH2      ARG 132  -2.452   3.881   3.881
 1056   2HH2  ARG 132          2HH2      ARG 132  -3.875   2.973   2.973
 1057    H    VAL 133           H        VAL 133  -0.452   8.173   8.173
 1058    HA   VAL 133           HA       VAL 133   2.357   7.825   7.825
 1059    HB   VAL 133           HB       VAL 133   0.898  10.175  10.175
 1060   1HG1  VAL 133          2HG1      VAL 133   3.804   9.501   9.501
 1061   2HG1  VAL 133          1HG1      VAL 133   3.278  10.319  10.319
 1062   3HG1  VAL 133          3HG1      VAL 133   3.010  11.072  11.072
 1063   1HG2  VAL 133          2HG2      VAL 133   0.563   7.989   7.989
 1064   2HG2  VAL 133          1HG2      VAL 133   1.498   9.105   9.105
 1065   3HG2  VAL 133          3HG2      VAL 133   2.313   7.808   7.808
 1066    H    TYR 134           H        TYR 134   3.375   8.342   8.342
 1067    HA   TYR 134           HA       TYR 134   2.215  10.475  10.475
 1068   1HB   TYR 134          2HB       TYR 134   4.052   8.157   8.157
 1069   2HB   TYR 134          1HB       TYR 134   3.958   9.505   9.505
 1070    HD1  TYR 134           HD2      TYR 134   1.882  10.005  10.005
 1071    HD2  TYR 134           HD1      TYR 134   2.193   6.650   6.650
 1072    HE1  TYR 134           HE2      TYR 134  -0.177   9.044   9.044
 1073    HE2  TYR 134           HE1      TYR 134   0.150   5.652   5.652
 1074    HH   TYR 134           HH       TYR 134  -1.028   6.131   6.131
 1075    H    VAL 135           H        VAL 135   3.274  12.327  12.327
 1076    HA   VAL 135           HA       VAL 135   6.084  12.539  12.539
 1077    HB   VAL 135           HB       VAL 135   3.829  14.037  14.037
 1078   1HG1  VAL 135          2HG1      VAL 135   4.053  15.359  15.359
 1079   2HG1  VAL 135          1HG1      VAL 135   5.675  15.822  15.822
 1080   3HG1  VAL 135          3HG1      VAL 135   4.273  16.327  16.327
 1081   1HG2  VAL 135          3HG2      VAL 135   5.927  13.545  13.545
 1082   2HG2  VAL 135          2HG2      VAL 135   5.460  15.242  15.242
 1083   3HG2  VAL 135          1HG2      VAL 135   6.759  14.749  14.749
 1084    H    ARG 136           H        ARG 136   7.576  13.325  13.325
 1085    HA   ARG 136           HA       ARG 136   7.078  12.978  12.978
 1086   1HB   ARG 136          2HB       ARG 136   9.197  14.123  14.123
 1087   2HB   ARG 136          1HB       ARG 136   8.938  15.096  15.096
 1088   1HG   ARG 136          2HG       ARG 136   9.446  13.368  13.368
 1089   2HG   ARG 136          1HG       ARG 136   8.973  12.124  12.124
 1090   1HD   ARG 136          2HD       ARG 136  11.478  13.831  13.831
 1091   2HD   ARG 136          1HD       ARG 136  11.397  12.097  12.097
 1092    HE   ARG 136           HE       ARG 136  10.162  12.519  12.519
 1093   1HH1  ARG 136          2HH1      ARG 136  12.721  10.907  10.907
 1094   2HH1  ARG 136          1HH1      ARG 136  13.851  11.583  11.583
 1095   1HH2  ARG 136          1HH2      ARG 136  11.835  14.287  14.287
 1096   2HH2  ARG 136          2HH2      ARG 136  13.350  13.497  13.497
 1097    H    GLU 137           HN       GLU 137   5.929  13.938  13.938
 1098    HA   GLU 137           HA       GLU 137   4.368  15.409  15.409
 1099   1HB   GLU 137          2HB       GLU 137   6.773  16.204  16.204
 1100   2HB   GLU 137          1HB       GLU 137   6.401  17.515  17.515
 1101   1HG   GLU 137          2HG       GLU 137   4.233  17.802  17.802
 1102   2HG   GLU 137          1HG       GLU 137   5.071  16.842  16.842

  Start of MODEL   11
    1   1H    PRO   1          1H        PRO   1 -16.559   7.451   7.451
    2   2H    PRO   1          2H        PRO   1 -15.895   6.885   6.885
    3    HA   PRO   1           HA       PRO   1 -16.066   4.785   4.785
    4   1HB   PRO   1          2HB       PRO   1 -18.777   4.595   4.595
    5   2HB   PRO   1          1HB       PRO   1 -18.108   4.025   4.025
    6   1HG   PRO   1          2HG       PRO   1 -19.821   6.279   6.279
    7   2HG   PRO   1          1HG       PRO   1 -19.167   5.691   5.691
    8   1HD   PRO   1          1HD       PRO   1 -18.411   8.044   8.044
    9   2HD   PRO   1          2HD       PRO   1 -17.734   7.429   7.429
   10    H    ASN   2           H        ASN   2 -15.170   6.640   6.640
   11    HA   ASN   2           HA       ASN   2 -15.812   5.112   5.112
   12   1HB   ASN   2          2HB       ASN   2 -16.639   7.893   7.893
   13   2HB   ASN   2          1HB       ASN   2 -15.762   7.684   7.684
   14   1HD2  ASN   2          2HD2      ASN   2 -18.871   6.740   6.740
   15   2HD2  ASN   2          1HD2      ASN   2 -17.619   7.886   7.886
   16    H    PHE   3           H        PHE   3 -13.962   4.681   4.681
   17    HA   PHE   3           HA       PHE   3 -11.508   6.189   6.189
   18   1HB   PHE   3          2HB       PHE   3 -11.919   3.580   3.580
   19   2HB   PHE   3          1HB       PHE   3 -10.360   4.295   4.295
   20    HD1  PHE   3           HD1      PHE   3 -13.512   3.430   3.430
   21    HD2  PHE   3           HD2      PHE   3  -9.214   3.387   3.387
   22    HE1  PHE   3           HE1      PHE   3 -13.483   2.266   2.266
   23    HE2  PHE   3           HE2      PHE   3  -9.197   2.209   2.209
   24    HZ   PHE   3           HZ       PHE   3 -11.333   1.637   1.637
   25    H    SER   4           H        SER   4 -13.826   5.780   5.780
   26    HA   SER   4           HA       SER   4 -12.251   6.220   6.220
   27   1HB   SER   4          2HB       SER   4 -14.781   5.614   5.614
   28   2HB   SER   4          1HB       SER   4 -15.020   7.357   7.357
   29    HG   SER   4           HG       SER   4 -15.077   6.297   6.297
   30    H    GLY   5           H        GLY   5 -10.944   7.888   7.888
   31   1HA   GLY   5          2HA       GLY   5 -11.670  10.507  10.507
   32   2HA   GLY   5          1HA       GLY   5 -11.247  10.493  10.493
   33    H    ASN   6           H        ASN   6  -9.505  11.998  11.998
   34    HA   ASN   6           HA       ASN   6  -7.241  10.409  10.409
   35   1HB   ASN   6          2HB       ASN   6  -7.886  13.358  13.358
   36   2HB   ASN   6          1HB       ASN   6  -6.211  12.839  12.839
   37   1HD2  ASN   6          2HD2      ASN   6  -7.077  11.177  11.177
   38   2HD2  ASN   6          1HD2      ASN   6  -6.353  10.718  10.718
   39    H    TRP   7           H        TRP   7  -5.044  11.064  11.064
   40    HA   TRP   7           HA       TRP   7  -5.449  11.654  11.654
   41   1HB   TRP   7          2HB       TRP   7  -4.388   9.026   9.026
   42   2HB   TRP   7          1HB       TRP   7  -4.279   9.532   9.532
   43    HD1  TRP   7           HD1      TRP   7  -6.620   8.047   8.047
   44    HE1  TRP   7           HE1      TRP   7  -8.971   7.758   7.758
   45    HE3  TRP   7           HE3      TRP   7  -5.970  10.707  10.707
   46    HZ2  TRP   7           HZ2      TRP   7 -10.385   8.600   8.600
   47    HZ3  TRP   7           HZ3      TRP   7  -7.829  10.994  10.994
   48    HH2  TRP   7           HH2      TRP   7 -10.016   9.937   9.937
   49    H    LYS   8           H        LYS   8  -3.891  12.956  12.956
   50    HA   LYS   8           HA       LYS   8  -1.197  12.732  12.732
   51   1HB   LYS   8          2HB       LYS   8  -2.607  15.165  15.165
   52   2HB   LYS   8          1HB       LYS   8  -0.912  15.145  15.145
   53   1HG   LYS   8          2HG       LYS   8  -1.554  14.554  14.554
   54   2HG   LYS   8          1HG       LYS   8  -3.253  14.509  14.509
   55   1HD   LYS   8          2HD       LYS   8  -2.957  16.658  16.658
   56   2HD   LYS   8          1HD       LYS   8  -2.925  16.940  16.940
   57   1HE   LYS   8          2HE       LYS   8  -1.083  18.157  18.157
   58   2HE   LYS   8          1HE       LYS   8  -0.426  16.822  16.822
   59   1HZ   LYS   8          1HZ       LYS   8  -1.031  16.476  16.476
   60   2HZ   LYS   8          3HZ       LYS   8   0.430  17.184  17.184
   61   3HZ   LYS   8          2HZ       LYS   8   0.050  15.602  15.602
   62    H    ILE   9           H        ILE   9   0.101  11.726  11.726
   63    HA   ILE   9           HA       ILE   9  -0.429  11.211  11.211
   64    HB   ILE   9           HB       ILE   9   1.184   9.945   9.945
   65   1HG1  ILE   9          2HG1      ILE   9   2.581  11.399  11.399
   66   2HG1  ILE   9          1HG1      ILE   9   1.484  10.035  10.035
   67   1HG2  ILE   9          3HG2      ILE   9   2.379  12.633  12.633
   68   2HG2  ILE   9          2HG2      ILE   9   3.527  11.313  11.313
   69   3HG2  ILE   9          1HG2      ILE   9   2.354  11.253  11.253
   70   1HD1  ILE   9          3HD1      ILE   9   3.328   9.163   9.163
   71   2HD1  ILE   9          2HD1      ILE   9   4.301  10.035  10.035
   72   3HD1  ILE   9          1HD1      ILE   9   3.285   8.691   8.691
   73    H    ILE  10           H        ILE  10   0.521  12.000  12.000
   74    HA   ILE  10           HA       ILE  10   1.584  14.784  14.784
   75    HB   ILE  10           HB       ILE  10   0.257  15.325  15.325
   76   1HG1  ILE  10          2HG1      ILE  10  -1.756  13.490  13.490
   77   2HG1  ILE  10          1HG1      ILE  10  -0.398  12.439  12.439
   78   1HG2  ILE  10          2HG2      ILE  10  -0.580  15.378  15.378
   79   2HG2  ILE  10          1HG2      ILE  10  -1.779  14.259  14.259
   80   3HG2  ILE  10          3HG2      ILE  10  -1.620  15.875  15.875
   81   1HD1  ILE  10          3HD1      ILE  10   0.847  13.815  13.815
   82   2HD1  ILE  10          2HD1      ILE  10  -0.788  14.203  14.203
   83   3HD1  ILE  10          1HD1      ILE  10  -0.258  12.522  12.522
   84    H    ARG  11           H        ARG  11   1.446  11.670  11.670
   85    HA   ARG  11           HA       ARG  11   4.040  12.354  12.354
   86   1HB   ARG  11          2HB       ARG  11   1.490  11.540  11.540
   87   2HB   ARG  11          1HB       ARG  11   2.965  10.781  10.781
   88   1HG   ARG  11          2HG       ARG  11   3.948  12.886  12.886
   89   2HG   ARG  11          1HG       ARG  11   2.725  13.772  13.772
   90   1HD   ARG  11          2HD       ARG  11   1.019  13.244  13.244
   91   2HD   ARG  11          1HD       ARG  11   2.039  12.045  12.045
   92    HE   ARG  11           HE       ARG  11   2.475  14.997  14.997
   93   1HH1  ARG  11          2HH1      ARG  11   4.894  14.570  14.570
   94   2HH1  ARG  11          1HH1      ARG  11   4.834  13.797  13.797
   95   1HH2  ARG  11          1HH2      ARG  11   1.535  12.786  12.786
   96   2HH2  ARG  11          2HH2      ARG  11   2.933  12.787  12.787
   97    H    SER  12           H        SER  12   5.129  10.259  10.259
   98    HA   SER  12           HA       SER  12   4.271   7.699   7.699
   99   1HB   SER  12          2HB       SER  12   5.785   7.429   7.429
  100   2HB   SER  12          1HB       SER  12   4.660   8.750   8.750
  101    HG   SER  12           HG       SER  12   7.377   8.773   8.773
  102    H    GLU  13           H        GLU  13   5.822   6.068   6.068
  103    HA   GLU  13           HA       GLU  13   8.430   6.868   6.868
  104   1HB   GLU  13          2HB       GLU  13   7.934   5.605   5.605
  105   2HB   GLU  13          1HB       GLU  13   7.048   7.119   7.119
  106   1HG   GLU  13          2HG       GLU  13   5.691   4.754   4.754
  107   2HG   GLU  13          1HG       GLU  13   5.877   4.723   4.723
  108    H    ASN  14           H        ASN  14   9.668   4.836   4.836
  109    HA   ASN  14           HA       ASN  14  10.541   2.738   2.738
  110   1HB   ASN  14          2HB       ASN  14   7.714   1.990   1.990
  111   2HB   ASN  14          1HB       ASN  14   9.012   0.921   0.921
  112   1HD2  ASN  14          2HD2      ASN  14   6.640   2.453   2.453
  113   2HD2  ASN  14          1HD2      ASN  14   6.260   2.425   2.425
  114    H    PHE  15           H        PHE  15  10.115   4.877   4.877
  115    HA   PHE  15           HA       PHE  15   9.368   3.621   3.621
  116   1HB   PHE  15          2HB       PHE  15   9.725   6.142   6.142
  117   2HB   PHE  15          1HB       PHE  15  11.434   5.815   5.815
  118    HD1  PHE  15           HD2      PHE  15  10.440   3.514   3.514
  119    HD2  PHE  15           HD1      PHE  15   9.998   7.757   7.757
  120    HE1  PHE  15           HE2      PHE  15  10.182   3.771   3.771
  121    HE2  PHE  15           HE1      PHE  15   9.723   7.998   7.998
  122    HZ   PHE  15           HZ       PHE  15   9.823   5.993   5.993
  123    H    GLU  16           H        GLU  16  12.676   4.439   4.439
  124    HA   GLU  16           HA       GLU  16  14.054   2.844   2.844
  125   1HB   GLU  16          2HB       GLU  16  14.707   4.018   4.018
  126   2HB   GLU  16          1HB       GLU  16  15.767   2.740   2.740
  127   1HG   GLU  16          2HG       GLU  16  15.792   4.081   4.081
  128   2HG   GLU  16          1HG       GLU  16  15.165   5.417   5.417
  129    H    GLU  17           H        GLU  17  12.436   1.987   1.987
  130    HA   GLU  17           HA       GLU  17  13.618  -0.556  -0.556
  131   1HB   GLU  17          2HB       GLU  17  10.862   0.506   0.506
  132   2HB   GLU  17          1HB       GLU  17  11.523  -0.996  -0.996
  133   1HG   GLU  17          2HG       GLU  17  13.571   0.609   0.609
  134   2HG   GLU  17          1HG       GLU  17  12.290   1.818   1.818
  135    H    LEU  18           H        LEU  18  10.884   0.467   0.467
  136    HA   LEU  18           HA       LEU  18  10.225  -2.245  -2.245
  137   1HB   LEU  18          2HB       LEU  18   8.839   0.141   0.141
  138   2HB   LEU  18          1HB       LEU  18   9.270  -0.062  -0.062
  139    HG   LEU  18           HG       LEU  18   8.365  -2.386  -2.386
  140   1HD1  LEU  18          1HD1      LEU  18   8.014  -1.597  -1.597
  141   2HD1  LEU  18          3HD1      LEU  18   6.694  -2.518  -2.518
  142   3HD1  LEU  18          2HD1      LEU  18   8.326  -3.185  -3.185
  143   1HD2  LEU  18          2HD2      LEU  18   6.823   0.103   0.103
  144   2HD2  LEU  18          1HD2      LEU  18   6.639  -1.217  -1.217
  145   3HD2  LEU  18          3HD2      LEU  18   5.895  -1.330  -1.330
  146    H    LEU  19           H        LEU  19  12.488   0.146   0.146
  147    HA   LEU  19           HA       LEU  19  12.656  -1.032  -1.032
  148   1HB   LEU  19          2HB       LEU  19  14.478   1.057   1.057
  149   2HB   LEU  19          1HB       LEU  19  14.278   0.695   0.695
  150    HG   LEU  19           HG       LEU  19  12.348   2.111   2.111
  151   1HD1  LEU  19          1HD1      LEU  19  13.704   2.721   2.721
  152   2HD1  LEU  19          3HD1      LEU  19  12.397   3.706   3.706
  153   3HD1  LEU  19          2HD1      LEU  19  13.908   3.528   3.528
  154   1HD2  LEU  19          3HD2      LEU  19  11.723   0.427   0.427
  155   2HD2  LEU  19          2HD2      LEU  19  10.668   0.965   0.965
  156   3HD2  LEU  19          1HD2      LEU  19  11.029   2.047   2.047
  157    H    LYS  20           H        LYS  20  14.056  -1.467  -1.467
  158    HA   LYS  20           HA       LYS  20  16.506  -2.736  -2.736
  159   1HB   LYS  20          2HB       LYS  20  15.500  -2.805  -2.805
  160   2HB   LYS  20          1HB       LYS  20  17.151  -3.036  -3.036
  161   1HG   LYS  20          2HG       LYS  20  16.177  -0.475  -0.475
  162   2HG   LYS  20          1HG       LYS  20  15.920  -0.611  -0.611
  163   1HD   LYS  20          2HD       LYS  20  18.552  -1.132  -1.132
  164   2HD   LYS  20          1HD       LYS  20  18.144   0.346   0.346
  165   1HE   LYS  20          2HE       LYS  20  17.851  -2.271  -2.271
  166   2HE   LYS  20          1HE       LYS  20  19.468  -1.602  -1.602
  167   1HZ   LYS  20          1HZ       LYS  20  18.416   0.547   0.547
  168   2HZ   LYS  20          3HZ       LYS  20  17.168  -0.450  -0.450
  169   3HZ   LYS  20          2HZ       LYS  20  18.759  -0.687  -0.687
  170    H    VAL  21           H        VAL  21  13.323  -3.545  -3.545
  171    HA   VAL  21           HA       VAL  21  13.822  -6.404  -6.404
  172    HB   VAL  21           HB       VAL  21  12.048  -5.201  -5.201
  173   1HG1  VAL  21          3HG1      VAL  21  11.389  -3.661  -3.661
  174   2HG1  VAL  21          2HG1      VAL  21  10.586  -5.010  -5.010
  175   3HG1  VAL  21          1HG1      VAL  21  10.025  -4.445  -4.445
  176   1HG2  VAL  21          1HG2      VAL  21  11.206  -7.390  -7.390
  177   2HG2  VAL  21          3HG2      VAL  21  11.791  -7.577  -7.577
  178   3HG2  VAL  21          2HG2      VAL  21  10.206  -6.862  -6.862
  179    H    LEU  22           H        LEU  22  12.379  -4.195  -4.195
  180    HA   LEU  22           HA       LEU  22  11.515  -6.117  -6.117
  181   1HB   LEU  22          2HB       LEU  22  11.934  -3.189  -3.189
  182   2HB   LEU  22          1HB       LEU  22  12.079  -3.829  -3.829
  183    HG   LEU  22           HG       LEU  22   9.844  -4.738  -4.738
  184   1HD1  LEU  22          2HD1      LEU  22   9.949  -5.398  -5.398
  185   2HD1  LEU  22          1HD1      LEU  22   9.645  -3.712  -3.712
  186   3HD1  LEU  22          3HD1      LEU  22   8.436  -4.635  -4.635
  187   1HD2  LEU  22          3HD2      LEU  22   9.968  -1.944  -1.944
  188   2HD2  LEU  22          2HD2      LEU  22  10.037  -2.353  -2.353
  189   3HD2  LEU  22          1HD2      LEU  22   8.557  -2.638  -2.638
  190    H    GLY  23           H        GLY  23  14.328  -3.994  -3.994
  191   1HA   GLY  23          2HA       GLY  23  15.710  -5.621  -5.621
  192   2HA   GLY  23          1HA       GLY  23  16.157  -3.982  -3.982
  193    H    VAL  24           H        VAL  24  18.295  -4.512  -4.512
  194    HA   VAL  24           HA       VAL  24  18.780  -5.681  -5.681
  195    HB   VAL  24           HB       VAL  24  20.530  -7.258  -7.258
  196   1HG1  VAL  24          2HG1      VAL  24  18.058  -7.824  -7.824
  197   2HG1  VAL  24          1HG1      VAL  24  17.838  -7.955  -7.955
  198   3HG1  VAL  24          3HG1      VAL  24  18.991  -9.004  -9.004
  199   1HG2  VAL  24          2HG2      VAL  24  19.149  -6.590  -6.590
  200   2HG2  VAL  24          1HG2      VAL  24  20.822  -6.217  -6.217
  201   3HG2  VAL  24          3HG2      VAL  24  20.315  -7.895  -7.895
  202    H    ASN  25           H        ASN  25  20.092  -4.182  -4.182
  203    HA   ASN  25           HA       ASN  25  22.685  -3.543  -3.543
  204   1HB   ASN  25          2HB       ASN  25  21.444  -3.274  -3.274
  205   2HB   ASN  25          1HB       ASN  25  21.266  -1.625  -1.625
  206   1HD2  ASN  25          2HD2      ASN  25  24.571  -0.806  -0.806
  207   2HD2  ASN  25          1HD2      ASN  25  22.996  -0.279  -0.279
  208    H    VAL  26           H        VAL  26  22.607  -0.619  -0.619
  209    HA   VAL  26           HA       VAL  26  21.153   0.232   0.232
  210    HB   VAL  26           HB       VAL  26  23.158   1.791   1.791
  211   1HG1  VAL  26          3HG1      VAL  26  22.524  -0.620  -0.620
  212   2HG1  VAL  26          2HG1      VAL  26  24.117  -0.989  -0.989
  213   3HG1  VAL  26          1HG1      VAL  26  23.929   0.312   0.312
  214   1HG2  VAL  26          3HG2      VAL  26  24.339  -0.165  -0.165
  215   2HG2  VAL  26          2HG2      VAL  26  24.376   1.597   1.597
  216   3HG2  VAL  26          1HG2      VAL  26  25.331   0.734   0.734
  217    H    MET  27           H        MET  27  22.866   1.373   1.373
  218    HA   MET  27           HA       MET  27  21.610   3.985   3.985
  219   1HB   MET  27          2HB       MET  27  23.733   3.127   3.127
  220   2HB   MET  27          1HB       MET  27  22.556   2.633   2.633
  221   1HG   MET  27          2HG       MET  27  21.876   4.829   4.829
  222   2HG   MET  27          1HG       MET  27  22.443   5.412   5.412
  223   1HE   MET  27          1HE       MET  27  23.926   3.134   3.134
  224   2HE   MET  27          3HE       MET  27  23.345   4.495   4.495
  225   3HE   MET  27          2HE       MET  27  25.072   4.166   4.166
  226    H    LEU  28           H        LEU  28  20.803   0.828   0.828
  227    HA   LEU  28           HA       LEU  28  18.787   1.296   1.296
  228   1HB   LEU  28          2HB       LEU  28  19.509  -0.799  -0.799
  229   2HB   LEU  28          1HB       LEU  28  17.850  -0.861  -0.861
  230    HG   LEU  28           HG       LEU  28  18.609  -1.024  -1.024
  231   1HD1  LEU  28          3HD1      LEU  28  21.388  -0.621  -0.621
  232   2HD1  LEU  28          2HD1      LEU  28  21.069  -1.109  -1.109
  233   3HD1  LEU  28          1HD1      LEU  28  20.537   0.472   0.472
  234   1HD2  LEU  28          3HD2      LEU  28  19.554  -2.867  -2.867
  235   2HD2  LEU  28          2HD2      LEU  28  18.708  -3.215  -3.215
  236   3HD2  LEU  28          1HD2      LEU  28  20.458  -3.003  -3.003
  237    H    ARG  29           H        ARG  29  18.604   1.479   1.479
  238    HA   ARG  29           HA       ARG  29  15.712   1.813   1.813
  239   1HB   ARG  29          2HB       ARG  29  17.746   2.499   2.499
  240   2HB   ARG  29          1HB       ARG  29  16.020   2.246   2.246
  241   1HG   ARG  29          2HG       ARG  29  16.363   0.030   0.030
  242   2HG   ARG  29          1HG       ARG  29  17.076  -0.058  -0.058
  243   1HD   ARG  29          2HD       ARG  29  18.608  -0.836  -0.836
  244   2HD   ARG  29          1HD       ARG  29  19.265   0.478   0.478
  245    HE   ARG  29           HE       ARG  29  17.843   1.327   1.327
  246   1HH1  ARG  29          1HH2      ARG  29  19.527   3.352   3.352
  247   2HH1  ARG  29          2HH2      ARG  29  21.077   2.948   2.948
  248   1HH2  ARG  29          2HH1      ARG  29  20.399  -0.446  -0.446
  249   2HH2  ARG  29          1HH1      ARG  29  21.570   0.798   0.798
  250    H    LYS  30           H        LYS  30  18.532   3.953   3.953
  251    HA   LYS  30           HA       LYS  30  17.104   6.361   6.361
  252   1HB   LYS  30          2HB       LYS  30  19.669   5.879   5.879
  253   2HB   LYS  30          1HB       LYS  30  19.610   6.318   6.318
  254   1HG   LYS  30          2HG       LYS  30  18.922   8.516   8.516
  255   2HG   LYS  30          1HG       LYS  30  18.340   8.099   8.099
  256   1HD   LYS  30          2HD       LYS  30  20.924   7.441   7.441
  257   2HD   LYS  30          1HD       LYS  30  21.113   8.680   8.680
  258   1HE   LYS  30          2HE       LYS  30  19.429   9.148   9.148
  259   2HE   LYS  30          1HE       LYS  30  21.162   9.474   9.474
  260   1HZ   LYS  30          1HZ       LYS  30  20.606  10.767  10.767
  261   2HZ   LYS  30          3HZ       LYS  30  19.020  10.774  10.774
  262   3HZ   LYS  30          2HZ       LYS  30  20.272  11.481  11.481
  263    H    ILE  31           H        ILE  31  17.511   4.542   4.542
  264    HA   ILE  31           HA       ILE  31  16.798   6.763   6.763
  265    HB   ILE  31           HB       ILE  31  16.755   3.767   3.767
  266   1HG1  ILE  31          2HG1      ILE  31  18.821   5.785   5.785
  267   2HG1  ILE  31          1HG1      ILE  31  18.976   4.916   4.916
  268   1HG2  ILE  31          2HG2      ILE  31  16.216   6.191   6.191
  269   2HG2  ILE  31          1HG2      ILE  31  17.096   4.861   4.861
  270   3HG2  ILE  31          3HG2      ILE  31  15.486   4.588   4.588
  271   1HD1  ILE  31          1HD1      ILE  31  18.533   2.793   2.793
  272   2HD1  ILE  31          3HD1      ILE  31  19.046   3.839   3.839
  273   3HD1  ILE  31          2HD1      ILE  31  20.142   3.515   3.515
  274    H    ALA  32           H        ALA  32  15.089   4.277   4.277
  275    HA   ALA  32           HA       ALA  32  12.548   4.800   4.800
  276   1HB   ALA  32          1HB       ALA  32  13.588   2.783   2.783
  277   2HB   ALA  32          3HB       ALA  32  12.089   3.428   3.428
  278   3HB   ALA  32          2HB       ALA  32  12.108   2.751   2.751
  279    H    VAL  33           H        VAL  33  14.299   5.987   5.987
  280    HA   VAL  33           HA       VAL  33  12.013   7.194   7.194
  281    HB   VAL  33           HB       VAL  33  14.917   8.005   8.005
  282   1HG1  VAL  33          1HG1      VAL  33  12.396   8.290   8.290
  283   2HG1  VAL  33          3HG1      VAL  33  13.945   8.229   8.229
  284   3HG1  VAL  33          2HG1      VAL  33  13.637   9.492   9.492
  285   1HG2  VAL  33          1HG2      VAL  33  13.765   5.422   5.422
  286   2HG2  VAL  33          3HG2      VAL  33  15.406   5.961   5.961
  287   3HG2  VAL  33          2HG2      VAL  33  14.145   6.157   6.157
  288    H    ALA  34           H        ALA  34  14.500   8.161   8.161
  289    HA   ALA  34           HA       ALA  34  13.662  10.939  10.939
  290   1HB   ALA  34          2HB       ALA  34  15.587   9.190   9.190
  291   2HB   ALA  34          1HB       ALA  34  15.040  10.664  10.664
  292   3HB   ALA  34          3HB       ALA  34  15.861  10.758  10.758
  293    H    ALA  35           H        ALA  35  13.027   7.969   7.969
  294    HA   ALA  35           HA       ALA  35  11.566   9.062   9.062
  295   1HB   ALA  35          3HB       ALA  35  11.408   6.373   6.373
  296   2HB   ALA  35          2HB       ALA  35  10.578   6.746   6.746
  297   3HB   ALA  35          1HB       ALA  35  12.341   6.761   6.761
  298    H    ALA  36           H        ALA  36  10.623   8.078   8.078
  299    HA   ALA  36           HA       ALA  36   7.802   8.310   8.310
  300   1HB   ALA  36          2HB       ALA  36   9.726   8.122   8.122
  301   2HB   ALA  36          1HB       ALA  36   8.258   9.014   9.014
  302   3HB   ALA  36          3HB       ALA  36   8.150   7.354   7.354
  303    H    SER  37           H        SER  37   9.895  10.589  10.589
  304    HA   SER  37           HA       SER  37   9.660  12.911  12.911
  305   1HB   SER  37          2HB       SER  37  10.648  13.025  13.025
  306   2HB   SER  37          1HB       SER  37   9.121  12.610  12.610
  307    HG   SER  37           HG       SER  37   9.765  14.966  14.966
  308    H    LYS  38           H        LYS  38   7.446  11.648  11.648
  309    HA   LYS  38           HA       LYS  38   5.206  12.040  12.040
  310   1HB   LYS  38          2HB       LYS  38   5.387  14.587  14.587
  311   2HB   LYS  38          1HB       LYS  38   4.267  14.233  14.233
  312   1HG   LYS  38          2HG       LYS  38   6.492  13.900  13.900
  313   2HG   LYS  38          1HG       LYS  38   7.180  14.928  14.928
  314   1HD   LYS  38          2HD       LYS  38   5.908  16.763  16.763
  315   2HD   LYS  38          1HD       LYS  38   4.596  15.772  15.772
  316   1HE   LYS  38          2HE       LYS  38   6.288  15.055  15.055
  317   2HE   LYS  38          1HE       LYS  38   7.236  16.445  16.445
  318   1HZ   LYS  38          2HZ       LYS  38   5.238  17.826  17.826
  319   2HZ   LYS  38          1HZ       LYS  38   4.444  16.473  16.473
  320   3HZ   LYS  38          3HZ       LYS  38   5.811  17.108  17.108
  321    HA   PRO  39           HA       PRO  39   4.283  10.508  10.508
  322   1HB   PRO  39          2HB       PRO  39   3.475   8.002   8.002
  323   2HB   PRO  39          1HB       PRO  39   5.133   8.422   8.422
  324   1HG   PRO  39          2HG       PRO  39   3.982   7.968   7.968
  325   2HG   PRO  39          1HG       PRO  39   5.644   7.733   7.733
  326   1HD   PRO  39          2HD       PRO  39   4.746   9.919   9.919
  327   2HD   PRO  39          1HD       PRO  39   6.260   9.858   9.858
  328    H    ALA  40           H        ALA  40   2.166  10.143  10.143
  329    HA   ALA  40           HA       ALA  40  -0.037  10.993  10.993
  330   1HB   ALA  40          1HB       ALA  40   0.399  11.021  11.021
  331   2HB   ALA  40          3HB       ALA  40  -1.237  11.121  11.121
  332   3HB   ALA  40          2HB       ALA  40  -0.046  12.352  12.352
  333    H    VAL  41           H        VAL  41  -2.235   9.970   9.970
  334    HA   VAL  41           HA       VAL  41  -2.067   7.161   7.161
  335    HB   VAL  41           HB       VAL  41  -2.683   8.060   8.060
  336   1HG1  VAL  41          2HG1      VAL  41  -3.470   5.422   5.422
  337   2HG1  VAL  41          1HG1      VAL  41  -3.536   5.770   5.770
  338   3HG1  VAL  41          3HG1      VAL  41  -4.579   6.650   6.650
  339   1HG2  VAL  41          1HG2      VAL  41  -0.870   6.028   6.028
  340   2HG2  VAL  41          3HG2      VAL  41  -0.422   7.411   7.411
  341   3HG2  VAL  41          2HG2      VAL  41  -1.212   6.014   6.014
  342    H    GLU  42           H        GLU  42  -4.347   6.241   6.241
  343    HA   GLU  42           HA       GLU  42  -6.550   8.191   8.191
  344   1HB   GLU  42          2HB       GLU  42  -5.460   8.631   8.631
  345   2HB   GLU  42          1HB       GLU  42  -5.609   6.918   6.918
  346   1HG   GLU  42          2HG       GLU  42  -8.201   7.597   7.597
  347   2HG   GLU  42          1HG       GLU  42  -7.627   9.067   9.067
  348    H    ILE  43           H        ILE  43  -8.065   6.986   6.986
  349    HA   ILE  43           HA       ILE  43  -8.200   4.074   4.074
  350    HB   ILE  43           HB       ILE  43  -9.186   5.763   5.763
  351   1HG1  ILE  43          2HG1      ILE  43  -7.880   3.699   3.699
  352   2HG1  ILE  43          1HG1      ILE  43  -7.114   3.676   3.676
  353   1HG2  ILE  43          1HG2      ILE  43 -10.147   3.082   3.082
  354   2HG2  ILE  43          3HG2      ILE  43  -9.850   3.297   3.297
  355   3HG2  ILE  43          2HG2      ILE  43 -11.002   4.340   4.340
  356   1HD1  ILE  43          2HD1      ILE  43  -6.536   6.060   6.060
  357   2HD1  ILE  43          1HD1      ILE  43  -7.298   6.083   6.083
  358   3HD1  ILE  43          3HD1      ILE  43  -5.854   5.108   5.108
  359    H    LYS  44           H        LYS  44 -10.074   3.120   3.120
  360    HA   LYS  44           HA       LYS  44 -12.335   4.907   4.907
  361   1HB   LYS  44          2HB       LYS  44 -12.010   2.468   2.468
  362   2HB   LYS  44          1HB       LYS  44 -12.363   4.114   4.114
  363   1HG   LYS  44          2HG       LYS  44  -9.999   4.705   4.705
  364   2HG   LYS  44          1HG       LYS  44  -9.597   3.151   3.151
  365   1HD   LYS  44          2HD       LYS  44 -10.099   1.972   1.972
  366   2HD   LYS  44          1HD       LYS  44 -10.974   3.343   3.343
  367   1HE   LYS  44          2HE       LYS  44  -8.906   4.618   4.618
  368   2HE   LYS  44          1HE       LYS  44  -8.001   3.328   3.328
  369   1HZ   LYS  44          2HZ       LYS  44  -8.715   1.843   1.843
  370   2HZ   LYS  44          1HZ       LYS  44  -9.395   3.186   3.186
  371   3HZ   LYS  44          3HZ       LYS  44  -7.722   3.121   3.121
  372    H    GLN  45           H        GLN  45 -13.832   4.317   4.317
  373    HA   GLN  45           HA       GLN  45 -13.997   1.454   1.454
  374   1HB   GLN  45          2HB       GLN  45 -13.876   3.138   3.138
  375   2HB   GLN  45          1HB       GLN  45 -15.375   3.861   3.861
  376   1HG   GLN  45          2HG       GLN  45 -16.538   1.694   1.694
  377   2HG   GLN  45          1HG       GLN  45 -15.047   1.016   1.016
  378   1HE2  GLN  45          2HE2      GLN  45 -16.590   2.025   2.025
  379   2HE2  GLN  45          1HE2      GLN  45 -16.454   0.717   0.717
  380    H    GLU  46           H        GLU  46 -15.467   0.179   0.179
  381    HA   GLU  46           HA       GLU  46 -18.045   1.375   1.375
  382   1HB   GLU  46          2HB       GLU  46 -16.285  -0.708  -0.708
  383   2HB   GLU  46          1HB       GLU  46 -18.005  -0.593  -0.593
  384   1HG   GLU  46          2HG       GLU  46 -16.358   1.907   1.907
  385   2HG   GLU  46          1HG       GLU  46 -16.222   0.766   0.766
  386    H    GLY  47           H        GLY  47 -17.936   0.554   0.554
  387   1HA   GLY  47          2HA       GLY  47 -19.498  -0.775  -0.775
  388   2HA   GLY  47          1HA       GLY  47 -19.520  -1.964  -1.964
  389    H    ASP  48           H        ASP  48 -18.641  -3.833  -3.833
  390    HA   ASP  48           HA       ASP  48 -16.598  -3.840  -3.840
  391   1HB   ASP  48          2HB       ASP  48 -16.475  -6.326  -6.326
  392   2HB   ASP  48          1HB       ASP  48 -18.008  -5.755  -5.755
  393    H    THR  49           H        THR  49 -16.383  -3.160  -3.160
  394    HA   THR  49           HA       THR  49 -13.781  -4.515  -4.515
  395    HB   THR  49           HB       THR  49 -15.714  -3.082  -3.082
  396    HG1  THR  49           HG1      THR  49 -16.157  -5.178  -5.178
  397   1HG2  THR  49          1HG2      THR  49 -12.852  -3.854  -3.854
  398   2HG2  THR  49          3HG2      THR  49 -14.068  -3.497  -3.497
  399   3HG2  THR  49          2HG2      THR  49 -13.564  -2.243  -2.243
  400    H    PHE  50           H        PHE  50 -11.946  -3.406  -3.406
  401    HA   PHE  50           HA       PHE  50 -12.103  -0.422  -0.422
  402   1HB   PHE  50          2HB       PHE  50 -10.461  -2.205  -2.205
  403   2HB   PHE  50          1HB       PHE  50 -10.383  -0.440  -0.440
  404    HD1  PHE  50           HD1      PHE  50 -12.560  -3.344  -3.344
  405    HD2  PHE  50           HD2      PHE  50 -12.122   0.910   0.910
  406    HE1  PHE  50           HE1      PHE  50 -14.608  -3.232  -3.232
  407    HE2  PHE  50           HE2      PHE  50 -14.159   1.026   1.026
  408    HZ   PHE  50           HZ       PHE  50 -15.415  -1.050  -1.050
  409    H    TYR  51           H        TYR  51 -10.858   0.450   0.450
  410    HA   TYR  51           HA       TYR  51  -8.632  -1.128  -1.128
  411   1HB   TYR  51          2HB       TYR  51 -10.555  -0.359  -0.359
  412   2HB   TYR  51          1HB       TYR  51 -10.090   1.297   1.297
  413    HD1  TYR  51           HD1      TYR  51  -7.568   1.890   1.890
  414    HD2  TYR  51           HD2      TYR  51  -9.648  -1.432  -1.432
  415    HE1  TYR  51           HE1      TYR  51  -5.919   1.839   1.839
  416    HE2  TYR  51           HE2      TYR  51  -8.005  -1.471  -1.471
  417    HH   TYR  51           HH       TYR  51  -6.054   0.967   0.967
  418    H    ILE  52           H        ILE  52  -6.557  -0.258  -0.258
  419    HA   ILE  52           HA       ILE  52  -6.308   2.432   2.432
  420    HB   ILE  52           HB       ILE  52  -4.023   0.562   0.562
  421   1HG1  ILE  52          2HG1      ILE  52  -6.015  -0.950  -0.950
  422   2HG1  ILE  52          1HG1      ILE  52  -4.967  -0.760  -0.760
  423   1HG2  ILE  52          1HG2      ILE  52  -5.329   2.804   2.804
  424   2HG2  ILE  52          3HG2      ILE  52  -4.606   1.582   1.582
  425   3HG2  ILE  52          2HG2      ILE  52  -3.619   2.408   2.408
  426   1HD1  ILE  52          3HD1      ILE  52  -7.226   1.160   1.160
  427   2HD1  ILE  52          2HD1      ILE  52  -7.651  -0.514  -0.514
  428   3HD1  ILE  52          1HD1      ILE  52  -6.559   0.365   0.365
  429    H    LYS  53           H        LYS  53  -4.878   3.857   3.857
  430    HA   LYS  53           HA       LYS  53  -3.187   2.689   2.689
  431   1HB   LYS  53          2HB       LYS  53  -5.367   3.611   3.611
  432   2HB   LYS  53          1HB       LYS  53  -4.857   5.197   5.197
  433   1HG   LYS  53          2HG       LYS  53  -3.290   5.429   5.429
  434   2HG   LYS  53          1HG       LYS  53  -2.824   3.730   3.730
  435   1HD   LYS  53          2HD       LYS  53  -3.884   3.677   3.677
  436   2HD   LYS  53          1HD       LYS  53  -5.308   3.457   3.457
  437   1HE   LYS  53          2HE       LYS  53  -5.977   5.691   5.691
  438   2HE   LYS  53          1HE       LYS  53  -4.360   6.229   6.229
  439   1HZ   LYS  53          3HZ       LYS  53  -6.025   4.431   4.431
  440   2HZ   LYS  53          2HZ       LYS  53  -5.965   6.117   6.117
  441   3HZ   LYS  53          1HZ       LYS  53  -4.567   5.179   5.179
  442    H    THR  54           H        THR  54  -1.191   3.206   3.206
  443    HA   THR  54           HA       THR  54  -0.838   5.875   5.875
  444    HB   THR  54           HB       THR  54   1.213   3.657   3.657
  445    HG1  THR  54           HG1      THR  54   0.369   3.009   3.009
  446   1HG2  THR  54          1HG2      THR  54   1.362   6.254   6.254
  447   2HG2  THR  54          3HG2      THR  54   0.993   5.348   5.348
  448   3HG2  THR  54          2HG2      THR  54   2.413   4.934   4.934
  449    H    SER  55           H        SER  55   0.723   7.339   7.339
  450    HA   SER  55           HA       SER  55   2.099   6.624   6.624
  451   1HB   SER  55          2HB       SER  55   1.390   9.157   9.157
  452   2HB   SER  55          1HB       SER  55   0.418   7.764   7.764
  453    HG   SER  55           HG       SER  55  -0.642   9.573   9.573
  454    H    THR  56           H        THR  56   4.181   7.019   7.019
  455    HA   THR  56           HA       THR  56   4.980   9.111   9.111
  456    HB   THR  56           HB       THR  56   7.317   7.915   7.915
  457    HG1  THR  56           HG1      THR  56   6.063   6.466   6.466
  458   1HG2  THR  56          2HG2      THR  56   5.358   6.989   6.989
  459   2HG2  THR  56          1HG2      THR  56   7.056   6.516   6.516
  460   3HG2  THR  56          3HG2      THR  56   6.621   8.205   8.205
  461    H    THR  57           H        THR  57   7.434   9.845   9.845
  462    HA   THR  57           HA       THR  57   6.943  11.874  11.874
  463    HB   THR  57           HB       THR  57   8.923  11.843  11.843
  464    HG1  THR  57           HG1      THR  57  10.309  12.603  12.603
  465   1HG2  THR  57          2HG2      THR  57   9.153   9.249   9.249
  466   2HG2  THR  57          1HG2      THR  57  10.218   9.773   9.773
  467   3HG2  THR  57          3HG2      THR  57  10.577  10.222  10.222
  468    H    VAL  58           H        VAL  58   8.226   8.599   8.599
  469    HA   VAL  58           HA       VAL  58   7.623   9.102   9.102
  470    HB   VAL  58           HB       VAL  58   9.965   7.549   7.549
  471   1HG1  VAL  58          2HG1      VAL  58   8.915   8.159   8.159
  472   2HG1  VAL  58          1HG1      VAL  58  10.651   7.964   7.964
  473   3HG1  VAL  58          3HG1      VAL  58   9.554   6.642   6.642
  474   1HG2  VAL  58          1HG2      VAL  58   9.903  10.159  10.159
  475   2HG2  VAL  58          3HG2      VAL  58  11.341   9.400   9.400
  476   3HG2  VAL  58          2HG2      VAL  58  10.153  10.147  10.147
  477    H    ARG  59           H        ARG  59   6.984   7.078   7.078
  478    HA   ARG  59           HA       ARG  59   6.376   4.794   4.794
  479   1HB   ARG  59          2HB       ARG  59   7.851   4.553   4.553
  480   2HB   ARG  59          1HB       ARG  59   6.295   4.545   4.545
  481   1HG   ARG  59          2HG       ARG  59   5.632   2.554   2.554
  482   2HG   ARG  59          1HG       ARG  59   6.578   2.814   2.814
  483   1HD   ARG  59          2HD       ARG  59   8.553   2.047   2.047
  484   2HD   ARG  59          1HD       ARG  59   8.015   2.430   2.430
  485    HE   ARG  59           HE       ARG  59   6.407   0.456   0.456
  486   1HH1  ARG  59          2HH1      ARG  59   6.991  -0.254  -0.254
  487   2HH1  ARG  59          1HH1      ARG  59   8.201  -1.484  -1.484
  488   1HH2  ARG  59          1HH2      ARG  59   8.984  -0.685  -0.685
  489   2HH2  ARG  59          2HH2      ARG  59   9.329  -1.728  -1.728
  490    H    THR  60           H        THR  60   4.383   3.490   3.490
  491    HA   THR  60           HA       THR  60   2.254   4.979   4.979
  492    HB   THR  60           HB       THR  60   1.968   4.380   4.380
  493    HG1  THR  60           HG1      THR  60   3.033   6.158   6.158
  494   1HG2  THR  60          1HG2      THR  60   0.272   5.926   5.926
  495   2HG2  THR  60          3HG2      THR  60  -0.059   5.802   5.802
  496   3HG2  THR  60          2HG2      THR  60  -0.126   4.362   4.362
  497    H    THR  61           H        THR  61   1.813   3.126   3.126
  498    HA   THR  61           HA       THR  61   1.307   0.573   0.573
  499    HB   THR  61           HB       THR  61   1.103  -0.146  -0.146
  500    HG1  THR  61           HG1      THR  61   2.965   1.987   1.987
  501   1HG2  THR  61          3HG2      THR  61   2.711  -0.972  -0.972
  502   2HG2  THR  61          2HG2      THR  61   3.772   0.375   0.375
  503   3HG2  THR  61          1HG2      THR  61   3.408  -0.864  -0.864
  504    H    GLU  62           H        GLU  62  -0.625  -0.713  -0.713
  505    HA   GLU  62           HA       GLU  62  -2.746   0.771   0.771
  506   1HB   GLU  62          2HB       GLU  62  -4.308   0.859   0.859
  507   2HB   GLU  62          1HB       GLU  62  -2.868   1.825   1.825
  508   1HG   GLU  62          2HG       GLU  62  -2.166  -0.689  -0.689
  509   2HG   GLU  62          1HG       GLU  62  -3.868  -0.544  -0.544
  510    H    ILE  63           H        ILE  63  -3.500  -0.848  -0.848
  511    HA   ILE  63           HA       ILE  63  -3.737  -3.599  -3.599
  512    HB   ILE  63           HB       ILE  63  -3.913  -4.387  -4.387
  513   1HG1  ILE  63          2HG1      ILE  63  -3.935  -1.466  -1.466
  514   2HG1  ILE  63          1HG1      ILE  63  -5.339  -2.531  -2.531
  515   1HG2  ILE  63          3HG2      ILE  63  -1.669  -3.625  -3.625
  516   2HG2  ILE  63          2HG2      ILE  63  -1.830  -2.204  -2.204
  517   3HG2  ILE  63          1HG2      ILE  63  -1.749  -3.812  -3.812
  518   1HD1  ILE  63          1HD1      ILE  63  -2.999  -3.673  -3.673
  519   2HD1  ILE  63          3HD1      ILE  63  -3.618  -2.205  -2.205
  520   3HD1  ILE  63          2HD1      ILE  63  -4.681  -3.593  -3.593
  521    H    ASN  64           H        ASN  64  -5.808  -4.795  -4.795
  522    HA   ASN  64           HA       ASN  64  -8.152  -3.134  -3.134
  523   1HB   ASN  64          2HB       ASN  64  -9.303  -3.463  -3.463
  524   2HB   ASN  64          1HB       ASN  64  -7.697  -2.859  -2.859
  525   1HD2  ASN  64          2HD2      ASN  64  -8.713  -6.671  -6.671
  526   2HD2  ASN  64          1HD2      ASN  64  -9.660  -5.808  -5.808
  527    H    PHE  65           H        PHE  65  -9.735  -4.373  -4.373
  528    HA   PHE  65           HA       PHE  65  -9.938  -7.264  -7.264
  529   1HB   PHE  65          2HB       PHE  65  -9.209  -7.969  -7.969
  530   2HB   PHE  65          1HB       PHE  65  -7.924  -7.059  -7.059
  531    HD1  PHE  65           HD2      PHE  65  -7.518  -4.664  -4.664
  532    HD2  PHE  65           HD1      PHE  65 -10.295  -7.140  -7.140
  533    HE1  PHE  65           HE2      PHE  65  -7.583  -3.002  -3.002
  534    HE2  PHE  65           HE1      PHE  65 -10.376  -5.482  -5.482
  535    HZ   PHE  65           HZ       PHE  65  -9.028  -3.406  -3.406
  536    H    LYS  66           H        LYS  66 -11.164  -8.198  -8.198
  537    HA   LYS  66           HA       LYS  66 -13.412  -6.373  -6.373
  538   1HB   LYS  66          2HB       LYS  66 -14.907  -8.436  -8.436
  539   2HB   LYS  66          1HB       LYS  66 -14.382  -7.795  -7.795
  540   1HG   LYS  66          2HG       LYS  66 -12.517  -9.465  -9.465
  541   2HG   LYS  66          1HG       LYS  66 -13.174 -10.149 -10.149
  542   1HD   LYS  66          2HD       LYS  66 -14.350 -11.500 -11.500
  543   2HD   LYS  66          1HD       LYS  66 -15.408 -10.101 -10.101
  544   1HE   LYS  66          2HE       LYS  66 -14.916 -10.632 -10.632
  545   2HE   LYS  66          1HE       LYS  66 -13.730  -9.377  -9.377
  546   1HZ   LYS  66          1HZ       LYS  66 -12.118 -11.108 -11.108
  547   2HZ   LYS  66          3HZ       LYS  66 -13.259 -12.306 -12.306
  548   3HZ   LYS  66          2HZ       LYS  66 -12.693 -11.264 -11.264
  549    H    VAL  67           H        VAL  67 -14.346  -6.913  -6.913
  550    HA   VAL  67           HA       VAL  67 -12.308  -8.083  -8.083
  551    HB   VAL  67           HB       VAL  67 -14.938  -7.431  -7.431
  552   1HG1  VAL  67          3HG1      VAL  67 -12.018  -6.919  -6.919
  553   2HG1  VAL  67          2HG1      VAL  67 -13.254  -6.033  -6.033
  554   3HG1  VAL  67          1HG1      VAL  67 -13.186  -7.792  -7.792
  555   1HG2  VAL  67          3HG2      VAL  67 -13.421  -5.441  -5.441
  556   2HG2  VAL  67          2HG2      VAL  67 -15.155  -5.559  -5.559
  557   3HG2  VAL  67          1HG2      VAL  67 -14.091  -4.911  -4.911
  558    H    GLY  68           H        GLY  68 -12.289 -10.328 -10.328
  559   1HA   GLY  68          2HA       GLY  68 -13.677 -12.126 -12.126
  560   2HA   GLY  68          1HA       GLY  68 -14.857 -11.795 -11.795
  561    H    GLU  69           H        GLU  69 -12.652 -11.402 -11.402
  562    HA   GLU  69           HA       GLU  69 -11.880 -14.286 -14.286
  563   1HB   GLU  69          2HB       GLU  69 -12.733 -12.329 -12.329
  564   2HB   GLU  69          1HB       GLU  69 -12.114 -13.951 -13.951
  565   1HG   GLU  69          2HG       GLU  69 -14.474 -13.487 -13.487
  566   2HG   GLU  69          1HG       GLU  69 -14.677 -13.672 -13.672
  567    H    GLU  70           H        GLU  70  -9.883 -14.660 -14.660
  568    HA   GLU  70           HA       GLU  70  -7.871 -12.597 -12.597
  569   1HB   GLU  70          2HB       GLU  70  -6.287 -14.367 -14.367
  570   2HB   GLU  70          1HB       GLU  70  -7.309 -14.901 -14.901
  571   1HG   GLU  70          2HG       GLU  70  -8.523 -15.381 -15.381
  572   2HG   GLU  70          1HG       GLU  70  -6.984 -16.217 -16.217
  573    H    PHE  71           H        PHE  71  -6.182 -12.227 -12.227
  574    HA   PHE  71           HA       PHE  71  -7.117 -12.422 -12.422
  575   1HB   PHE  71          2HB       PHE  71  -7.174  -9.940  -9.940
  576   2HB   PHE  71          1HB       PHE  71  -8.462 -10.522 -10.522
  577    HD1  PHE  71           HD2      PHE  71  -8.062 -10.450 -10.450
  578    HD2  PHE  71           HD1      PHE  71  -5.630  -8.322  -8.322
  579    HE1  PHE  71           HE2      PHE  71  -7.257  -8.959  -8.959
  580    HE2  PHE  71           HE1      PHE  71  -4.828  -6.829  -6.829
  581    HZ   PHE  71           HZ       PHE  71  -5.637  -7.149  -7.149
  582    H    GLU  72           H        GLU  72  -5.572 -10.667 -10.667
  583    HA   GLU  72           HA       GLU  72  -2.837 -11.182 -11.182
  584   1HB   GLU  72          2HB       GLU  72  -3.378 -10.660 -10.660
  585   2HB   GLU  72          1HB       GLU  72  -1.994 -11.453 -11.453
  586   1HG   GLU  72          2HG       GLU  72  -3.374 -13.374 -13.374
  587   2HG   GLU  72          1HG       GLU  72  -4.803 -12.587 -12.587
  588    H    GLU  73           H        GLU  73  -1.355  -9.444  -9.444
  589    HA   GLU  73           HA       GLU  73  -2.130  -6.881  -6.881
  590   1HB   GLU  73          2HB       GLU  73  -2.056  -5.651  -5.651
  591   2HB   GLU  73          1HB       GLU  73  -3.430  -6.750  -6.750
  592   1HG   GLU  73          2HG       GLU  73  -2.524  -8.267  -8.267
  593   2HG   GLU  73          1HG       GLU  73  -0.868  -7.753  -7.753
  594    H    GLN  74           H        GLN  74  -0.433  -5.159  -5.159
  595    HA   GLN  74           HA       GLN  74   2.235  -6.533  -6.533
  596   1HB   GLN  74          2HB       GLN  74   1.304  -3.750  -3.750
  597   2HB   GLN  74          1HB       GLN  74   3.015  -4.154  -4.154
  598   1HG   GLN  74          2HG       GLN  74   2.279  -6.205  -6.205
  599   2HG   GLN  74          1HG       GLN  74   1.021  -5.066  -5.066
  600   1HE2  GLN  74          2HE2      GLN  74   4.910  -4.344  -4.344
  601   2HE2  GLN  74          1HE2      GLN  74   4.548  -5.559  -5.559
  602    H    THR  75           H        THR  75   3.986  -5.608  -5.608
  603    HA   THR  75           HA       THR  75   2.926  -4.813  -4.813
  604    HB   THR  75           HB       THR  75   4.573  -6.723  -6.723
  605    HG1  THR  75           HG1      THR  75   5.483  -6.272  -6.272
  606   1HG2  THR  75          2HG2      THR  75   6.090  -4.668  -4.668
  607   2HG2  THR  75          1HG2      THR  75   6.978  -5.230  -5.230
  608   3HG2  THR  75          3HG2      THR  75   6.473  -6.377  -6.377
  609    H    VAL  76           H        VAL  76   5.706  -3.514  -3.514
  610    HA   VAL  76           HA       VAL  76   5.080  -0.928  -0.928
  611    HB   VAL  76           HB       VAL  76   6.366  -1.329  -1.329
  612   1HG1  VAL  76          2HG1      VAL  76   5.621   1.026   1.026
  613   2HG1  VAL  76          1HG1      VAL  76   5.451   1.167   1.167
  614   3HG1  VAL  76          3HG1      VAL  76   7.024   0.796   0.796
  615   1HG2  VAL  76          1HG2      VAL  76   3.988  -2.092  -2.092
  616   2HG2  VAL  76          3HG2      VAL  76   4.213  -0.673  -0.673
  617   3HG2  VAL  76          2HG2      VAL  76   3.528  -0.495  -0.495
  618    H    ASP  77           H        ASP  77   7.514  -3.329  -3.329
  619    HA   ASP  77           HA       ASP  77   9.733  -1.512  -1.512
  620   1HB   ASP  77          2HB       ASP  77   9.605  -3.809  -3.809
  621   2HB   ASP  77          1HB       ASP  77  10.185  -4.431  -4.431
  622    H    GLY  78           H        GLY  78   7.789  -3.999  -3.999
  623   1HA   GLY  78          2HA       GLY  78   7.491  -3.510  -3.510
  624   2HA   GLY  78          1HA       GLY  78   9.253  -3.527  -3.527
  625    H    ARG  79           H        ARG  79   6.989  -5.637  -5.637
  626    HA   ARG  79           HA       ARG  79   7.997  -7.944  -7.944
  627   1HB   ARG  79          2HB       ARG  79   8.073  -7.455  -7.455
  628   2HB   ARG  79          1HB       ARG  79   7.636  -9.078  -9.078
  629   1HG   ARG  79          2HG       ARG  79   9.922  -7.993  -7.993
  630   2HG   ARG  79          1HG       ARG  79  10.221  -8.098  -8.098
  631   1HD   ARG  79          2HD       ARG  79   8.951 -10.438 -10.438
  632   2HD   ARG  79          1HD       ARG  79  10.685 -10.182 -10.182
  633    HE   ARG  79           HE       ARG  79   9.529 -10.273 -10.273
  634   1HH1  ARG  79          2HH1      ARG  79  11.983 -10.419 -10.419
  635   2HH1  ARG  79          1HH1      ARG  79  12.668 -11.958 -11.958
  636   1HH2  ARG  79          1HH2      ARG  79  10.226 -12.734 -12.734
  637   2HH2  ARG  79          2HH2      ARG  79  11.673 -13.269 -13.269
  638    HA   PRO  80           HA       PRO  80   3.625  -8.803  -8.803
  639   1HB   PRO  80          2HB       PRO  80   3.728 -11.415 -11.415
  640   2HB   PRO  80          1HB       PRO  80   4.029 -10.034 -10.034
  641   1HG   PRO  80          2HG       PRO  80   5.976 -11.966 -11.966
  642   2HG   PRO  80          1HG       PRO  80   6.094 -11.019 -11.019
  643   1HD   PRO  80          2HD       PRO  80   7.376 -10.422 -10.422
  644   2HD   PRO  80          1HD       PRO  80   7.222  -9.328  -9.328
  645    H    CYS  81           H        CYS  81   2.174  -9.525  -9.525
  646    HA   CYS  81           HA       CYS  81   2.636 -11.944 -11.944
  647   1HB   CYS  81          2HB       CYS  81   2.553 -10.765 -10.765
  648   2HB   CYS  81          1HB       CYS  81   4.035 -10.454 -10.454
  649    HG   CYS  81           HG       CYS  81   2.961  -8.124  -8.124
  650    H    LYS  82           H        LYS  82   0.710 -12.702 -12.702
  651    HA   LYS  82           HA       LYS  82  -1.730 -11.358 -11.358
  652   1HB   LYS  82          2HB       LYS  82  -2.840 -13.337 -13.337
  653   2HB   LYS  82          1HB       LYS  82  -1.590 -13.794 -13.794
  654   1HG   LYS  82          2HG       LYS  82  -0.203 -14.636 -14.636
  655   2HG   LYS  82          1HG       LYS  82  -0.778 -13.503 -13.503
  656   1HD   LYS  82          2HD       LYS  82  -2.494 -15.744 -15.744
  657   2HD   LYS  82          1HD       LYS  82  -1.484 -15.923 -15.923
  658   1HE   LYS  82          2HE       LYS  82  -2.669 -13.779 -13.779
  659   2HE   LYS  82          1HE       LYS  82  -3.861 -14.113 -14.113
  660   1HZ   LYS  82          1HZ       LYS  82  -4.101 -16.361 -16.361
  661   2HZ   LYS  82          3HZ       LYS  82  -3.065 -15.919 -15.919
  662   3HZ   LYS  82          2HZ       LYS  82  -4.560 -15.134 -15.134
  663    H    SER  83           H        SER  83  -3.466 -10.934 -10.934
  664    HA   SER  83           HA       SER  83  -2.512 -10.433 -10.433
  665   1HB   SER  83          2HB       SER  83  -2.153  -8.318  -8.318
  666   2HB   SER  83          1HB       SER  83  -3.580  -8.435  -8.435
  667    HG   SER  83           HG       SER  83  -3.786  -7.055  -7.055
  668    H    LEU  84           H        LEU  84  -4.389 -10.048 -10.048
  669    HA   LEU  84           HA       LEU  84  -7.039 -10.827 -10.827
  670   1HB   LEU  84          2HB       LEU  84  -6.052 -12.957 -12.957
  671   2HB   LEU  84          1HB       LEU  84  -5.691 -12.231 -12.231
  672    HG   LEU  84           HG       LEU  84  -8.093 -11.908 -11.908
  673   1HD1  LEU  84          1HD1      LEU  84  -8.725 -11.672 -11.672
  674   2HD1  LEU  84          3HD1      LEU  84  -8.572 -13.421 -13.421
  675   3HD1  LEU  84          2HD1      LEU  84  -9.785 -12.720 -12.720
  676   1HD2  LEU  84          2HD2      LEU  84  -7.072 -14.631 -14.631
  677   2HD2  LEU  84          1HD2      LEU  84  -7.387 -13.967 -13.967
  678   3HD2  LEU  84          3HD2      LEU  84  -8.732 -14.441 -14.441
  679    H    VAL  85           H        VAL  85  -8.787 -10.090 -10.090
  680    HA   VAL  85           HA       VAL  85  -7.792  -8.376  -8.376
  681    HB   VAL  85           HB       VAL  85  -9.670  -7.328  -7.328
  682   1HG1  VAL  85          1HG1      VAL  85  -8.729  -6.392  -6.392
  683   2HG1  VAL  85          3HG1      VAL  85  -8.476  -5.210  -5.210
  684   3HG1  VAL  85          2HG1      VAL  85 -10.091  -5.841  -5.841
  685   1HG2  VAL  85          3HG2      VAL  85  -6.683  -7.130  -7.130
  686   2HG2  VAL  85          2HG2      VAL  85  -7.604  -7.485  -7.485
  687   3HG2  VAL  85          1HG2      VAL  85  -7.577  -5.848  -5.848
  688    H    LYS  86           H        LYS  86  -9.025  -8.500  -8.500
  689    HA   LYS  86           HA       LYS  86 -11.888  -9.285  -9.285
  690   1HB   LYS  86          2HB       LYS  86 -11.398 -10.147 -10.147
  691   2HB   LYS  86          1HB       LYS  86 -11.155 -11.191 -11.191
  692   1HG   LYS  86          2HG       LYS  86  -8.739 -10.462 -10.462
  693   2HG   LYS  86          1HG       LYS  86  -9.043  -9.603  -9.603
  694   1HD   LYS  86          2HD       LYS  86  -9.280 -11.549 -11.549
  695   2HD   LYS  86          1HD       LYS  86  -9.859 -12.474 -12.474
  696   1HE   LYS  86          2HE       LYS  86  -7.687 -13.319 -13.319
  697   2HE   LYS  86          1HE       LYS  86  -7.463 -12.133 -12.133
  698   1HZ   LYS  86          3HZ       LYS  86  -6.885 -10.500 -10.500
  699   2HZ   LYS  86          2HZ       LYS  86  -6.938 -11.752 -11.752
  700   3HZ   LYS  86          1HZ       LYS  86  -5.791 -11.792 -11.792
  701    H    TRP  87           H        TRP  87 -13.224  -8.351  -8.351
  702    HA   TRP  87           HA       TRP  87 -12.319  -5.619  -5.619
  703   1HB   TRP  87          2HB       TRP  87 -14.856  -7.158  -7.158
  704   2HB   TRP  87          1HB       TRP  87 -14.599  -5.566  -5.566
  705    HD1  TRP  87           HD1      TRP  87 -15.681  -7.283  -7.283
  706    HE1  TRP  87           HE1      TRP  87 -16.052  -5.599  -5.599
  707    HE3  TRP  87           HE3      TRP  87 -13.460  -3.182  -3.182
  708    HZ2  TRP  87           HZ2      TRP  87 -15.481  -2.858  -2.858
  709    HZ3  TRP  87           HZ3      TRP  87 -13.358  -1.049  -1.049
  710    HH2  TRP  87           HH2      TRP  87 -14.366  -0.887  -0.887
  711    H    GLU  88           H        GLU  88 -12.787  -4.784  -4.784
  712    HA   GLU  88           HA       GLU  88 -12.025  -6.716  -6.716
  713   1HB   GLU  88          2HB       GLU  88 -10.083  -5.259  -5.259
  714   2HB   GLU  88          1HB       GLU  88 -10.877  -3.934  -3.934
  715   1HG   GLU  88          2HG       GLU  88  -9.363  -4.730  -4.730
  716   2HG   GLU  88          1HG       GLU  88 -10.876  -5.515  -5.515
  717    H    SER  89           H        SER  89 -13.091  -3.463  -3.463
  718    HA   SER  89           HA       SER  89 -15.064  -3.542  -3.542
  719   1HB   SER  89          2HB       SER  89 -14.582  -1.236  -1.236
  720   2HB   SER  89          1HB       SER  89 -13.043  -2.092  -2.092
  721    HG   SER  89           HG       SER  89 -13.337   0.016   0.016
  722    H    GLU  90           H        GLU  90 -16.049  -0.874  -0.874
  723    HA   GLU  90           HA       GLU  90 -17.687  -1.754  -1.754
  724   1HB   GLU  90          2HB       GLU  90 -18.672   0.553   0.553
  725   2HB   GLU  90          1HB       GLU  90 -18.717  -0.357  -0.357
  726   1HG   GLU  90          2HG       GLU  90 -16.208   1.065   1.065
  727   2HG   GLU  90          1HG       GLU  90 -17.541   2.187   2.187
  728    H    ASN  91           H        ASN  91 -14.805   0.202   0.202
  729    HA   ASN  91           HA       ASN  91 -14.715   0.453   0.453
  730   1HB   ASN  91          2HB       ASN  91 -14.098   2.782   2.782
  731   2HB   ASN  91          1HB       ASN  91 -14.168   2.787   2.787
  732   1HD2  ASN  91          2HD2      ASN  91 -17.467   3.751   3.751
  733   2HD2  ASN  91          1HD2      ASN  91 -15.881   3.949   3.949
  734    H    LYS  92           H        LYS  92 -13.184  -1.166  -1.166
  735    HA   LYS  92           HA       LYS  92 -10.491  -0.183  -0.183
  736   1HB   LYS  92          2HB       LYS  92 -10.865   0.401   0.401
  737   2HB   LYS  92          1HB       LYS  92 -11.252  -1.281  -1.281
  738   1HG   LYS  92          2HG       LYS  92  -8.862  -1.645  -1.645
  739   2HG   LYS  92          1HG       LYS  92  -8.618  -0.018  -0.018
  740   1HD   LYS  92          2HD       LYS  92  -9.374  -0.834  -0.834
  741   2HD   LYS  92          1HD       LYS  92  -9.416  -2.470  -2.470
  742   1HE   LYS  92          2HE       LYS  92  -6.938  -1.801  -1.801
  743   2HE   LYS  92          1HE       LYS  92  -7.069  -0.741  -0.741
  744   1HZ   LYS  92          3HZ       LYS  92  -7.770  -2.705  -2.705
  745   2HZ   LYS  92          2HZ       LYS  92  -7.454  -3.683  -3.683
  746   3HZ   LYS  92          1HZ       LYS  92  -6.190  -2.832  -2.832
  747    H    MET  93           H        MET  93  -9.824  -1.736  -1.736
  748    HA   MET  93           HA       MET  93 -10.440  -4.582  -4.582
  749   1HB   MET  93          2HB       MET  93  -9.957  -4.905  -4.905
  750   2HB   MET  93          1HB       MET  93 -11.539  -4.355  -4.355
  751   1HG   MET  93          2HG       MET  93 -11.142  -2.146  -2.146
  752   2HG   MET  93          1HG       MET  93  -9.394  -2.356  -2.356
  753   1HE   MET  93          1HE       MET  93 -12.597  -3.678  -3.678
  754   2HE   MET  93          3HE       MET  93 -12.516  -2.262  -2.262
  755   3HE   MET  93          2HE       MET  93 -12.398  -3.882  -3.882
  756    H    VAL  94           H        VAL  94  -8.824  -6.128  -6.128
  757    HA   VAL  94           HA       VAL  94  -6.054  -5.042  -5.042
  758    HB   VAL  94           HB       VAL  94  -6.835  -7.873  -7.873
  759   1HG1  VAL  94          1HG1      VAL  94  -4.555  -6.018  -6.018
  760   2HG1  VAL  94          3HG1      VAL  94  -4.870  -7.351  -7.351
  761   3HG1  VAL  94          2HG1      VAL  94  -4.519  -7.676  -7.676
  762   1HG2  VAL  94          3HG2      VAL  94  -7.197  -5.393  -5.393
  763   2HG2  VAL  94          2HG2      VAL  94  -8.273  -6.780  -6.780
  764   3HG2  VAL  94          1HG2      VAL  94  -6.791  -6.923  -6.923
  765    H    CYS  95           H        CYS  95  -4.400  -6.650  -6.650
  766    HA   CYS  95           HA       CYS  95  -5.612  -8.022  -8.022
  767   1HB   CYS  95          2HB       CYS  95  -5.192  -5.678  -5.678
  768   2HB   CYS  95          1HB       CYS  95  -3.495  -5.876  -5.876
  769    HG   CYS  95           HG       CYS  95  -3.130  -7.328  -7.328
  770    H    GLU  96           H        GLU  96  -4.423  -9.676  -9.676
  771    HA   GLU  96           HA       GLU  96  -1.807 -10.263 -10.263
  772   1HB   GLU  96          2HB       GLU  96  -3.647 -12.189 -12.189
  773   2HB   GLU  96          1HB       GLU  96  -2.227 -12.604 -12.604
  774   1HG   GLU  96          2HG       GLU  96  -4.341 -11.017 -11.017
  775   2HG   GLU  96          1HG       GLU  96  -4.721 -12.701 -12.701
  776    H    GLN  97           H        GLN  97  -0.194 -11.355 -11.355
  777    HA   GLN  97           HA       GLN  97  -0.690 -10.923 -10.923
  778   1HB   GLN  97          2HB       GLN  97   0.017  -8.681  -8.681
  779   2HB   GLN  97          1HB       GLN  97   1.613  -9.330  -9.330
  780   1HG   GLN  97          2HG       GLN  97   0.702  -9.658  -9.658
  781   2HG   GLN  97          1HG       GLN  97  -0.569  -8.540  -8.540
  782   1HE2  GLN  97          2HE2      GLN  97   1.520  -5.692  -5.692
  783   2HE2  GLN  97          1HE2      GLN  97  -0.024  -6.306  -6.306
  784    H    LYS  98           H        LYS  98   0.521 -12.337 -12.337
  785    HA   LYS  98           HA       LYS  98   3.127 -13.236 -13.236
  786   1HB   LYS  98          2HB       LYS  98   1.714 -14.977 -14.977
  787   2HB   LYS  98          1HB       LYS  98   0.752 -14.943 -14.943
  788   1HG   LYS  98          2HG       LYS  98   2.460 -16.039 -16.039
  789   2HG   LYS  98          1HG       LYS  98   3.672 -15.737 -15.737
  790   1HD   LYS  98          2HD       LYS  98   2.887 -17.429 -17.429
  791   2HD   LYS  98          1HD       LYS  98   1.243 -17.318 -17.318
  792   1HE   LYS  98          2HE       LYS  98   1.886 -19.256 -19.256
  793   2HE   LYS  98          1HE       LYS  98   2.476 -18.095 -18.095
  794   1HZ   LYS  98          3HZ       LYS  98   4.622 -18.128 -18.128
  795   2HZ   LYS  98          2HZ       LYS  98   4.018 -19.479 -19.479
  796   3HZ   LYS  98          1HZ       LYS  98   4.251 -19.551 -19.551
  797    H    LEU  99           H        LEU  99   4.561 -14.064 -14.064
  798    HA   LEU  99           HA       LEU  99   4.342 -12.550 -12.550
  799   1HB   LEU  99          2HB       LEU  99   5.982 -14.985 -14.985
  800   2HB   LEU  99          1HB       LEU  99   6.155 -14.107 -14.107
  801    HG   LEU  99           HG       LEU  99   6.221 -12.483 -12.483
  802   1HD1  LEU  99          3HD1      LEU  99   8.334 -14.479 -14.479
  803   2HD1  LEU  99          2HD1      LEU  99   8.739 -13.031 -13.031
  804   3HD1  LEU  99          1HD1      LEU  99   7.630 -14.227 -14.227
  805   1HD2  LEU  99          2HD2      LEU  99   6.481 -11.689 -11.689
  806   2HD2  LEU  99          1HD2      LEU  99   7.719 -11.151 -11.151
  807   3HD2  LEU  99          3HD2      LEU  99   8.056 -12.481 -12.481
  808    H    LEU 100           H        LEU 100   4.416 -13.582 -13.582
  809    HA   LEU 100           HA       LEU 100   2.259 -15.609 -15.609
  810   1HB   LEU 100          2HB       LEU 100   3.353 -13.535 -13.535
  811   2HB   LEU 100          1HB       LEU 100   2.291 -14.838 -14.838
  812    HG   LEU 100           HG       LEU 100   1.577 -12.976 -12.976
  813   1HD1  LEU 100          3HD1      LEU 100   1.341 -12.649 -12.649
  814   2HD1  LEU 100          2HD1      LEU 100  -0.040 -12.157 -12.157
  815   3HD1  LEU 100          1HD1      LEU 100   1.541 -11.424 -11.424
  816   1HD2  LEU 100          1HD2      LEU 100   0.246 -15.173 -15.173
  817   2HD2  LEU 100          3HD2      LEU 100   0.142 -14.782 -14.782
  818   3HD2  LEU 100          2HD2      LEU 100  -0.753 -13.823 -13.823
  819    H    LYS 101           H        LYS 101   5.611 -15.427 -15.427
  820    HA   LYS 101           HA       LYS 101   5.849 -18.046 -18.046
  821   1HB   LYS 101          2HB       LYS 101   6.090 -16.150 -16.150
  822   2HB   LYS 101          1HB       LYS 101   7.656 -15.866 -15.866
  823   1HG   LYS 101          2HG       LYS 101   8.364 -17.461 -17.461
  824   2HG   LYS 101          1HG       LYS 101   7.734 -18.571 -18.571
  825   1HD   LYS 101          2HD       LYS 101   6.564 -19.375 -19.375
  826   2HD   LYS 101          1HD       LYS 101   5.454 -18.083 -18.083
  827   1HE   LYS 101          2HE       LYS 101   5.783 -17.734 -17.734
  828   2HE   LYS 101          1HE       LYS 101   6.881 -16.580 -16.580
  829   1HZ   LYS 101          2HZ       LYS 101   8.612 -18.381 -18.381
  830   2HZ   LYS 101          1HZ       LYS 101   7.537 -19.204 -19.204
  831   3HZ   LYS 101          3HZ       LYS 101   8.124 -17.675 -17.675
  832    H    GLY 102           H        GLY 102   7.442 -19.199 -19.199
  833   1HA   GLY 102          2HA       GLY 102   9.204 -19.660 -19.660
  834   2HA   GLY 102          1HA       GLY 102   9.841 -18.063 -18.063
  835    H    GLU 103           H        GLU 103  10.371 -17.770 -17.770
  836    HA   GLU 103           HA       GLU 103   8.366 -16.346 -16.346
  837   1HB   GLU 103          2HB       GLU 103   7.524 -18.679 -18.679
  838   2HB   GLU 103          1HB       GLU 103   9.048 -19.065 -19.065
  839   1HG   GLU 103          2HG       GLU 103   8.633 -17.539 -17.539
  840   2HG   GLU 103          1HG       GLU 103   7.330 -16.749 -16.749
  841    H    GLY 104           H        GLY 104   9.316 -15.144 -15.144
  842   1HA   GLY 104          2HA       GLY 104  11.927 -15.915 -15.915
  843   2HA   GLY 104          1HA       GLY 104  11.904 -14.427 -14.427
  844    HA   PRO 105           HA       PRO 105  10.385 -12.450 -12.450
  845   1HB   PRO 105          2HB       PRO 105   9.433 -10.128 -10.128
  846   2HB   PRO 105          1HB       PRO 105  11.159 -10.463 -10.463
  847   1HG   PRO 105          2HG       PRO 105   9.559 -10.437 -10.437
  848   2HG   PRO 105          1HG       PRO 105  11.306 -10.244 -10.244
  849   1HD   PRO 105          2HD       PRO 105   9.930 -12.611 -12.611
  850   2HD   PRO 105          1HD       PRO 105  11.659 -12.457 -12.457
  851    H    LYS 106           H        LYS 106   8.220 -11.081 -11.081
  852    HA   LYS 106           HA       LYS 106   5.875 -12.372 -12.372
  853   1HB   LYS 106          2HB       LYS 106   6.403 -13.551 -13.551
  854   2HB   LYS 106          1HB       LYS 106   6.329 -12.013 -12.013
  855   1HG   LYS 106          2HG       LYS 106   4.011 -11.767 -11.767
  856   2HG   LYS 106          1HG       LYS 106   4.020 -13.026 -13.026
  857   1HD   LYS 106          2HD       LYS 106   3.084 -14.085 -14.085
  858   2HD   LYS 106          1HD       LYS 106   4.766 -14.619 -14.619
  859   1HE   LYS 106          2HE       LYS 106   4.030 -13.884 -13.884
  860   2HE   LYS 106          1HE       LYS 106   5.364 -12.913 -12.913
  861   1HZ   LYS 106          2HZ       LYS 106   2.586 -12.071 -12.071
  862   2HZ   LYS 106          1HZ       LYS 106   3.311 -11.751 -11.751
  863   3HZ   LYS 106          3HZ       LYS 106   3.997 -11.127 -11.127
  864    H    THR 107           H        THR 107   4.150 -10.919 -10.919
  865    HA   THR 107           HA       THR 107   4.529  -8.203  -8.203
  866    HB   THR 107           HB       THR 107   3.099  -7.722  -7.722
  867    HG1  THR 107           HG1      THR 107   3.395  -9.410  -9.410
  868   1HG2  THR 107          1HG2      THR 107   5.315  -6.765  -6.765
  869   2HG2  THR 107          3HG2      THR 107   6.081  -7.751  -7.751
  870   3HG2  THR 107          2HG2      THR 107   4.945  -6.481  -6.481
  871    H    SER 108           H        SER 108   2.748  -7.132  -7.132
  872    HA   SER 108           HA       SER 108   0.022  -8.048  -8.048
  873   1HB   SER 108          2HB       SER 108   0.988  -8.170  -8.170
  874   2HB   SER 108          1HB       SER 108  -0.504  -8.815  -8.815
  875    HG   SER 108           HG       SER 108   1.973  -9.930  -9.930
  876    H    TRP 109           H        TRP 109  -1.377  -6.253  -6.253
  877    HA   TRP 109           HA       TRP 109  -0.231  -4.049  -4.049
  878   1HB   TRP 109          2HB       TRP 109  -0.914  -2.376  -2.376
  879   2HB   TRP 109          1HB       TRP 109   0.460  -3.383  -3.383
  880    HD1  TRP 109           HD1      TRP 109   0.205  -4.997  -4.997
  881    HE1  TRP 109           HE1      TRP 109  -1.647  -5.378  -5.378
  882    HE3  TRP 109           HE3      TRP 109  -3.606  -2.345  -2.345
  883    HZ2  TRP 109           HZ2      TRP 109  -4.373  -4.656  -4.656
  884    HZ3  TRP 109           HZ3      TRP 109  -5.810  -2.215  -2.215
  885    HH2  TRP 109           HH2      TRP 109  -6.206  -3.364  -3.364
  886    H    THR 110           H        THR 110  -1.953  -2.210  -2.210
  887    HA   THR 110           HA       THR 110  -4.697  -3.360  -3.360
  888    HB   THR 110           HB       THR 110  -5.078  -2.737  -2.737
  889    HG1  THR 110           HG1      THR 110  -4.161  -0.857  -0.857
  890   1HG2  THR 110          3HG2      THR 110  -3.287  -4.665  -4.665
  891   2HG2  THR 110          2HG2      THR 110  -2.267  -3.613  -3.613
  892   3HG2  THR 110          1HG2      THR 110  -3.759  -4.269  -4.269
  893    H    MET 111           H        MET 111  -6.299  -1.556  -1.556
  894    HA   MET 111           HA       MET 111  -5.455   1.182   1.182
  895   1HB   MET 111          2HB       MET 111  -7.072   1.363   1.363
  896   2HB   MET 111          1HB       MET 111  -5.765   0.233   0.233
  897   1HG   MET 111          2HG       MET 111  -7.141  -1.642  -1.642
  898   2HG   MET 111          1HG       MET 111  -8.319  -0.755  -0.755
  899   1HE   MET 111          2HE       MET 111  -6.307  -0.455  -0.455
  900   2HE   MET 111          1HE       MET 111  -7.381  -0.799  -0.799
  901   3HE   MET 111          3HE       MET 111  -7.146   0.867   0.867
  902    H    GLU 112           H        GLU 112  -6.888   2.660   2.660
  903    HA   GLU 112           HA       GLU 112  -9.440   1.587   1.587
  904   1HB   GLU 112          2HB       GLU 112  -7.632   1.590   1.590
  905   2HB   GLU 112          1HB       GLU 112  -7.520   3.339   3.339
  906   1HG   GLU 112          2HG       GLU 112  -9.546   3.725   3.725
  907   2HG   GLU 112          1HG       GLU 112 -10.238   2.208   2.208
  908    H    LEU 113           H        LEU 113 -11.075   3.171   3.171
  909    HA   LEU 113           HA       LEU 113 -10.484   5.758   5.758
  910   1HB   LEU 113          2HB       LEU 113 -12.333   3.798   3.798
  911   2HB   LEU 113          1HB       LEU 113 -13.303   4.902   4.902
  912    HG   LEU 113           HG       LEU 113 -13.314   5.326   5.326
  913   1HD1  LEU 113          2HD1      LEU 113 -13.912   7.061   7.061
  914   2HD1  LEU 113          1HD1      LEU 113 -12.233   7.590   7.590
  915   3HD1  LEU 113          3HD1      LEU 113 -13.186   7.738   7.738
  916   1HD2  LEU 113          1HD2      LEU 113 -10.780   4.868   4.868
  917   2HD2  LEU 113          3HD2      LEU 113 -11.429   6.208   6.208
  918   3HD2  LEU 113          2HD2      LEU 113 -10.583   6.524   6.524
  919    H    THR 114           H        THR 114 -11.164   7.661   7.661
  920    HA   THR 114           HA       THR 114 -11.831   7.223   7.223
  921    HB   THR 114           HB       THR 114 -11.182   9.486   9.486
  922    HG1  THR 114           HG1      THR 114 -11.565  10.934  10.934
  923   1HG2  THR 114          1HG2      THR 114  -9.370   7.799   7.799
  924   2HG2  THR 114          3HG2      THR 114  -9.349   8.633   8.633
  925   3HG2  THR 114          2HG2      THR 114  -8.937   9.507   9.507
  926    H    ASN 115           H        ASN 115 -13.540   8.557   8.557
  927    HA   ASN 115           HA       ASN 115 -16.048   8.277   8.277
  928   1HB   ASN 115          2HB       ASN 115 -15.472   8.591   8.591
  929   2HB   ASN 115          1HB       ASN 115 -15.614  10.312  10.312
  930   1HD2  ASN 115          1HD2      ASN 115 -17.703  11.144  11.144
  931   2HD2  ASN 115          2HD2      ASN 115 -19.125  10.222  10.222
  932    H    ASP 116           H        ASP 116 -13.679  10.820  10.820
  933    HA   ASP 116           HA       ASP 116 -15.585  12.808  12.808
  934   1HB   ASP 116          2HB       ASP 116 -13.311  13.161  13.161
  935   2HB   ASP 116          1HB       ASP 116 -12.619  13.106  13.106
  936    H    GLY 117           H        GLY 117 -13.329  10.429  10.429
  937   1HA   GLY 117          2HA       GLY 117 -14.020   9.649   9.649
  938   2HA   GLY 117          1HA       GLY 117 -13.959  11.351  11.351
  939    H    GLU 118           H        GLU 118 -11.489  11.228  11.228
  940    HA   GLU 118           HA       GLU 118  -9.424  11.377  11.377
  941   1HB   GLU 118          2HB       GLU 118  -9.225  10.596  10.596
  942   2HB   GLU 118          1HB       GLU 118  -7.876  11.112  11.112
  943   1HG   GLU 118          2HG       GLU 118  -8.865  13.300  13.300
  944   2HG   GLU 118          1HG       GLU 118 -10.341  12.797  12.797
  945    H    LEU 119           H        LEU 119  -7.486   9.756   9.756
  946    HA   LEU 119           HA       LEU 119  -8.399   6.951   6.951
  947   1HB   LEU 119          2HB       LEU 119  -9.020   7.682   7.682
  948   2HB   LEU 119          1HB       LEU 119  -7.323   8.014   8.014
  949    HG   LEU 119           HG       LEU 119  -8.255   5.288   5.288
  950   1HD1  LEU 119          2HD1      LEU 119  -8.380   6.570   6.570
  951   2HD1  LEU 119          1HD1      LEU 119  -8.045   4.844   4.844
  952   3HD1  LEU 119          3HD1      LEU 119  -9.546   5.503   5.503
  953   1HD2  LEU 119          1HD2      LEU 119  -5.795   6.499   6.499
  954   2HD2  LEU 119          3HD2      LEU 119  -5.921   5.311   5.311
  955   3HD2  LEU 119          2HD2      LEU 119  -6.184   4.820   4.820
  956    H    ILE 120           H        ILE 120  -6.836   6.177   6.177
  957    HA   ILE 120           HA       ILE 120  -4.004   6.959   6.959
  958    HB   ILE 120           HB       ILE 120  -4.697   7.338   7.338
  959   1HG1  ILE 120          2HG1      ILE 120  -2.948   4.862   4.862
  960   2HG1  ILE 120          1HG1      ILE 120  -2.378   6.497   6.497
  961   1HG2  ILE 120          3HG2      ILE 120  -5.546   4.445   4.445
  962   2HG2  ILE 120          2HG2      ILE 120  -5.235   5.218   5.218
  963   3HG2  ILE 120          1HG2      ILE 120  -6.506   5.837   5.837
  964   1HD1  ILE 120          1HD1      ILE 120  -3.841   6.054   6.054
  965   2HD1  ILE 120          3HD1      ILE 120  -2.197   5.426   5.426
  966   3HD1  ILE 120          2HD1      ILE 120  -2.502   7.146   7.146
  967    H    LEU 121           H        LEU 121  -2.415   5.218   5.218
  968    HA   LEU 121           HA       LEU 121  -3.594   2.528   2.528
  969   1HB   LEU 121          2HB       LEU 121  -3.361   3.705   3.705
  970   2HB   LEU 121          1HB       LEU 121  -1.654   3.973   3.973
  971    HG   LEU 121           HG       LEU 121  -2.198   1.176   1.176
  972   1HD1  LEU 121          1HD1      LEU 121  -4.126   1.962   1.962
  973   2HD1  LEU 121          3HD1      LEU 121  -2.837   1.967   1.967
  974   3HD1  LEU 121          2HD1      LEU 121  -3.232   0.480   0.480
  975   1HD2  LEU 121          2HD2      LEU 121  -0.123   2.607   2.607
  976   2HD2  LEU 121          1HD2      LEU 121  -0.328   0.936   0.936
  977   3HD2  LEU 121          3HD2      LEU 121  -0.794   2.261   2.261
  978    H    THR 122           H        THR 122  -2.363   0.925   0.925
  979    HA   THR 122           HA       THR 122   0.385   1.669   1.669
  980    HB   THR 122           HB       THR 122  -0.503  -0.720  -0.720
  981    HG1  THR 122           HG1      THR 122  -2.351   0.070   0.070
  982   1HG2  THR 122          2HG2      THR 122   0.245   2.079   2.079
  983   2HG2  THR 122          1HG2      THR 122  -0.505   1.067   1.067
  984   3HG2  THR 122          3HG2      THR 122   1.000   0.556   0.556
  985    H    MET 123           H        MET 123   1.869  -0.315  -0.315
  986    HA   MET 123           HA       MET 123   1.136  -2.309  -2.309
  987   1HB   MET 123          2HB       MET 123   3.627  -0.589  -0.589
  988   2HB   MET 123          1HB       MET 123   3.163  -1.873  -1.873
  989   1HG   MET 123          2HG       MET 123   0.964  -0.516  -0.516
  990   2HG   MET 123          1HG       MET 123   1.879   0.822   0.822
  991   1HE   MET 123          1HE       MET 123   1.422  -1.804  -1.804
  992   2HE   MET 123          3HE       MET 123   0.920  -0.523  -0.523
  993   3HE   MET 123          2HE       MET 123   2.382  -1.452  -1.452
  994    H    THR 124           H        THR 124   2.807  -4.030  -4.030
  995    HA   THR 124           HA       THR 124   4.618  -4.228  -4.228
  996    HB   THR 124           HB       THR 124   2.709  -6.474  -6.474
  997    HG1  THR 124           HG1      THR 124   1.441  -5.685  -5.685
  998   1HG2  THR 124          2HG2      THR 124   4.844  -6.916  -6.916
  999   2HG2  THR 124          1HG2      THR 124   4.360  -5.737  -5.737
 1000   3HG2  THR 124          3HG2      THR 124   3.423  -7.215  -7.215
 1001    H    ALA 125           H        ALA 125   6.232  -5.815  -5.815
 1002    HA   ALA 125           HA       ALA 125   6.275  -7.443  -7.443
 1003   1HB   ALA 125          1HB       ALA 125   6.988  -5.129  -5.129
 1004   2HB   ALA 125          3HB       ALA 125   8.383  -5.295  -5.295
 1005   3HB   ALA 125          2HB       ALA 125   8.180  -6.395  -6.395
 1006    H    ASP 126           H        ASP 126   6.665  -9.215  -9.215
 1007    HA   ASP 126           HA       ASP 126   8.046 -10.800 -10.800
 1008   1HB   ASP 126          2HB       ASP 126   9.923  -8.986  -8.986
 1009   2HB   ASP 126          1HB       ASP 126  10.409  -9.233  -9.233
 1010    H    ASP 127           H        ASP 127   9.386  -7.873  -7.873
 1011    HA   ASP 127           HA       ASP 127   7.674  -8.294  -8.294
 1012   1HB   ASP 127          2HB       ASP 127  10.673  -8.636  -8.636
 1013   2HB   ASP 127          1HB       ASP 127   9.811  -8.141  -8.141
 1014    H    VAL 128           H        VAL 128   8.235  -6.254  -6.254
 1015    HA   VAL 128           HA       VAL 128   8.853  -3.957  -3.957
 1016    HB   VAL 128           HB       VAL 128   9.670  -2.750  -2.750
 1017   1HG1  VAL 128          1HG1      VAL 128  10.806  -5.500  -5.500
 1018   2HG1  VAL 128          3HG1      VAL 128  11.565  -4.392  -4.392
 1019   3HG1  VAL 128          2HG1      VAL 128  11.417  -3.941  -3.941
 1020   1HG2  VAL 128          3HG2      VAL 128   8.406  -5.036  -5.036
 1021   2HG2  VAL 128          2HG2      VAL 128   8.646  -3.379  -3.379
 1022   3HG2  VAL 128          1HG2      VAL 128   9.966  -4.542  -4.542
 1023    H    VAL 129           H        VAL 129   7.788  -1.900  -1.900
 1024    HA   VAL 129           HA       VAL 129   5.244  -2.540  -2.540
 1025    HB   VAL 129           HB       VAL 129   5.461  -1.854  -1.854
 1026   1HG1  VAL 129          1HG1      VAL 129   3.430  -0.644  -0.644
 1027   2HG1  VAL 129          3HG1      VAL 129   2.920  -1.145  -1.145
 1028   3HG1  VAL 129          2HG1      VAL 129   4.193   0.061   0.061
 1029   1HG2  VAL 129          3HG2      VAL 129   3.922  -3.675  -3.675
 1030   2HG2  VAL 129          2HG2      VAL 129   4.730  -4.014  -4.014
 1031   3HG2  VAL 129          1HG2      VAL 129   3.169  -3.193  -3.193
 1032    H    CYS 130           H        CYS 130   5.084  -1.039  -1.039
 1033    HA   CYS 130           HA       CYS 130   6.303   1.643   1.643
 1034   1HB   CYS 130          2HB       CYS 130   6.748   0.184   0.184
 1035   2HB   CYS 130          1HB       CYS 130   5.120   0.640   0.640
 1036    HG   CYS 130           HG       CYS 130   6.450   2.562   2.562
 1037    H    THR 131           H        THR 131   4.923   3.126   3.126
 1038    HA   THR 131           HA       THR 131   2.036   2.951   2.951
 1039    HB   THR 131           HB       THR 131   3.382   4.298   4.298
 1040    HG1  THR 131           HG1      THR 131   2.968   2.508   2.508
 1041   1HG2  THR 131          2HG2      THR 131   0.528   4.223   4.223
 1042   2HG2  THR 131          1HG2      THR 131   0.896   4.405   4.405
 1043   3HG2  THR 131          3HG2      THR 131   1.469   5.607   5.607
 1044    H    ARG 132           H        ARG 132   1.001   4.820   4.820
 1045    HA   ARG 132           HA       ARG 132   2.480   7.334   7.334
 1046   1HB   ARG 132          2HB       ARG 132   1.477   5.648   5.648
 1047   2HB   ARG 132          1HB       ARG 132   1.796   7.375   7.375
 1048   1HG   ARG 132          2HG       ARG 132   3.901   6.711   6.711
 1049   2HG   ARG 132          1HG       ARG 132   4.104   6.526   6.526
 1050   1HD   ARG 132          2HD       ARG 132   4.609   4.364   4.364
 1051   2HD   ARG 132          1HD       ARG 132   2.888   4.142   4.142
 1052    HE   ARG 132           HE       ARG 132   4.761   4.917   4.917
 1053   1HH1  ARG 132          2HH1      ARG 132   1.649   3.938   3.938
 1054   2HH1  ARG 132          1HH1      ARG 132   1.632   2.614   2.614
 1055   1HH2  ARG 132          1HH2      ARG 132   5.032   2.780   2.780
 1056   2HH2  ARG 132          2HH2      ARG 132   3.547   1.959   1.959
 1057    H    VAL 133           H        VAL 133   0.943   8.834   8.834
 1058    HA   VAL 133           HA       VAL 133  -1.899   8.108   8.108
 1059    HB   VAL 133           HB       VAL 133  -0.560  10.738  10.738
 1060   1HG1  VAL 133          3HG1      VAL 133  -3.349   9.654   9.654
 1061   2HG1  VAL 133          2HG1      VAL 133  -2.709  10.998  10.998
 1062   3HG1  VAL 133          1HG1      VAL 133  -2.879  11.153  11.153
 1063   1HG2  VAL 133          2HG2      VAL 133   0.007   8.542   8.542
 1064   2HG2  VAL 133          1HG2      VAL 133  -0.386  10.008  10.008
 1065   3HG2  VAL 133          3HG2      VAL 133  -1.607   8.755   8.755
 1066    H    TYR 134           H        TYR 134  -3.433   8.798   8.798
 1067    HA   TYR 134           HA       TYR 134  -2.427  10.637  10.637
 1068   1HB   TYR 134          2HB       TYR 134  -3.928   8.050   8.050
 1069   2HB   TYR 134          1HB       TYR 134  -4.174   9.298   9.298
 1070    HD1  TYR 134           HD2      TYR 134  -2.331  10.064  10.064
 1071    HD2  TYR 134           HD1      TYR 134  -1.789   6.892   6.892
 1072    HE1  TYR 134           HE2      TYR 134  -0.228   9.399   9.399
 1073    HE2  TYR 134           HE1      TYR 134   0.310   6.228   6.228
 1074    HH   TYR 134           HH       TYR 134   1.995   7.187   7.187
 1075    H    VAL 135           H        VAL 135  -3.589  12.444  12.444
 1076    HA   VAL 135           HA       VAL 135  -6.397  12.362  12.362
 1077    HB   VAL 135           HB       VAL 135  -4.311  14.137  14.137
 1078   1HG1  VAL 135          3HG1      VAL 135  -4.649  15.279  15.279
 1079   2HG1  VAL 135          2HG1      VAL 135  -6.322  15.596  15.596
 1080   3HG1  VAL 135          1HG1      VAL 135  -5.005  16.328  16.328
 1081   1HG2  VAL 135          3HG2      VAL 135  -6.659  13.488  13.488
 1082   2HG2  VAL 135          2HG2      VAL 135  -5.843  14.986  14.986
 1083   3HG2  VAL 135          1HG2      VAL 135  -7.146  15.014  15.014
 1084    H    ARG 136           H        ARG 136  -8.067  12.976  12.976
 1085    HA   ARG 136           HA       ARG 136  -7.742  12.462  12.462
 1086   1HB   ARG 136          2HB       ARG 136  -9.822  13.510  13.510
 1087   2HB   ARG 136          1HB       ARG 136  -9.776  14.414  14.414
 1088   1HG   ARG 136          2HG       ARG 136 -10.237  12.563  12.563
 1089   2HG   ARG 136          1HG       ARG 136  -9.560  11.438  11.438
 1090   1HD   ARG 136          2HD       ARG 136 -12.210  12.898  12.898
 1091   2HD   ARG 136          1HD       ARG 136 -11.961  11.160  11.160
 1092    HE   ARG 136           HE       ARG 136 -10.618  11.863  11.863
 1093   1HH1  ARG 136          1HH1      ARG 136 -14.272  10.997  10.997
 1094   2HH1  ARG 136          2HH1      ARG 136 -13.238  10.205  10.205
 1095   1HH2  ARG 136          1HH2      ARG 136 -12.190  13.745  13.745
 1096   2HH2  ARG 136          2HH2      ARG 136 -13.679  13.004  13.004
 1097    H    GLU 137           HN       GLU 137  -6.833  13.452  13.452
 1098    HA   GLU 137           HA       GLU 137  -5.528  15.012  15.012
 1099   1HB   GLU 137          2HB       GLU 137  -8.036  15.588  15.588
 1100   2HB   GLU 137          1HB       GLU 137  -7.648  16.967  16.967
 1101   1HG   GLU 137          2HG       GLU 137  -5.807  17.561  17.561
 1102   2HG   GLU 137          1HG       GLU 137  -6.383  16.275  16.275

  Start of MODEL   12
    1   1H    PRO   1          1H        PRO   1  16.780   6.709   6.709
    2   2H    PRO   1          2H        PRO   1  16.317   5.842   5.842
    3    HA   PRO   1           HA       PRO   1  16.541   3.919   3.919
    4   1HB   PRO   1          2HB       PRO   1  19.156   4.104   4.104
    5   2HB   PRO   1          1HB       PRO   1  18.671   3.222   3.222
    6   1HG   PRO   1          2HG       PRO   1  20.203   5.634   5.634
    7   2HG   PRO   1          1HG       PRO   1  19.714   4.748   4.748
    8   1HD   PRO   1          1HD       PRO   1  18.703   7.253   7.253
    9   2HD   PRO   1          2HD       PRO   1  18.219   6.362   6.362
   10    H    ASN   2           H        ASN   2  15.329   5.983   5.983
   11    HA   ASN   2           HA       ASN   2  15.745   4.947   4.947
   12   1HB   ASN   2          2HB       ASN   2  16.216   7.852   7.852
   13   2HB   ASN   2          1HB       ASN   2  15.950   7.293   7.293
   14   1HD2  ASN   2          2HD2      ASN   2  19.114   5.538   5.538
   15   2HD2  ASN   2          1HD2      ASN   2  17.510   5.425   5.425
   16    H    PHE   3           H        PHE   3  13.776   4.683   4.683
   17    HA   PHE   3           HA       PHE   3  11.465   6.140   6.140
   18   1HB   PHE   3          2HB       PHE   3  11.643   3.739   3.739
   19   2HB   PHE   3          1HB       PHE   3  10.145   4.443   4.443
   20    HD1  PHE   3           HD1      PHE   3  13.419   3.339   3.339
   21    HD2  PHE   3           HD2      PHE   3   9.126   3.271   3.271
   22    HE1  PHE   3           HE1      PHE   3  13.526   1.931   1.931
   23    HE2  PHE   3           HE2      PHE   3   9.245   1.852   1.852
   24    HZ   PHE   3           HZ       PHE   3  11.445   1.173   1.173
   25    H    SER   4           H        SER   4  13.582   6.296   6.296
   26    HA   SER   4           HA       SER   4  11.793   6.926   6.926
   27   1HB   SER   4          2HB       SER   4  14.183   6.293   6.293
   28   2HB   SER   4          1HB       SER   4  14.648   7.859   7.859
   29    HG   SER   4           HG       SER   4  13.768   7.195   7.195
   30    H    GLY   5           H        GLY   5  10.447   8.604   8.604
   31   1HA   GLY   5          2HA       GLY   5  11.110  11.284  11.284
   32   2HA   GLY   5          1HA       GLY   5  10.784  11.008  11.008
   33    H    ASN   6           H        ASN   6   8.978  12.629  12.629
   34    HA   ASN   6           HA       ASN   6   6.668  11.173  11.173
   35   1HB   ASN   6          2HB       ASN   6   7.309  14.079  14.079
   36   2HB   ASN   6          1HB       ASN   6   5.628  13.573  13.573
   37   1HD2  ASN   6          2HD2      ASN   6   6.322  12.343  12.343
   38   2HD2  ASN   6          1HD2      ASN   6   5.680  11.694  11.694
   39    H    TRP   7           H        TRP   7   4.536  11.630  11.630
   40    HA   TRP   7           HA       TRP   7   5.069  11.842  11.842
   41   1HB   TRP   7          2HB       TRP   7   4.012   9.342   9.342
   42   2HB   TRP   7          1HB       TRP   7   3.998   9.616   9.616
   43    HD1  TRP   7           HD1      TRP   7   6.226   8.539   8.539
   44    HE1  TRP   7           HE1      TRP   7   8.628   8.146   8.146
   45    HE3  TRP   7           HE3      TRP   7   5.752  10.552  10.552
   46    HZ2  TRP   7           HZ2      TRP   7  10.142   8.667   8.667
   47    HZ3  TRP   7           HZ3      TRP   7   7.675  10.640  10.640
   48    HH2  TRP   7           HH2      TRP   7   9.854   9.689   9.689
   49    H    LYS   8           H        LYS   8   3.434  12.759  12.759
   50    HA   LYS   8           HA       LYS   8   0.703  12.664  12.664
   51   1HB   LYS   8          2HB       LYS   8   2.298  14.962  14.962
   52   2HB   LYS   8          1HB       LYS   8   0.610  14.920  14.920
   53   1HG   LYS   8          2HG       LYS   8   1.094  14.312  14.312
   54   2HG   LYS   8          1HG       LYS   8   1.433  15.971  15.971
   55   1HD   LYS   8          2HD       LYS   8  -1.135  14.615  14.615
   56   2HD   LYS   8          1HD       LYS   8  -0.983  15.404  15.404
   57   1HE   LYS   8          2HE       LYS   8  -0.411  17.518  17.518
   58   2HE   LYS   8          1HE       LYS   8  -0.406  16.752  16.752
   59   1HZ   LYS   8          2HZ       LYS   8  -2.754  16.214  16.214
   60   2HZ   LYS   8          1HZ       LYS   8  -2.746  17.017  17.017
   61   3HZ   LYS   8          3HZ       LYS   8  -2.484  17.890  17.890
   62    H    ILE   9           H        ILE   9  -0.527  11.465  11.465
   63    HA   ILE   9           HA       ILE   9   0.200  10.537  10.537
   64    HB   ILE   9           HB       ILE   9  -1.435   9.422   9.422
   65   1HG1  ILE   9          2HG1      ILE   9  -2.684  10.423  10.423
   66   2HG1  ILE   9          1HG1      ILE   9  -1.574   9.060   9.060
   67   1HG2  ILE   9          3HG2      ILE   9  -3.061  11.934  11.934
   68   2HG2  ILE   9          2HG2      ILE   9  -3.761  10.440  10.440
   69   3HG2  ILE   9          1HG2      ILE   9  -2.515  11.282  11.282
   70   1HD1  ILE   9          2HD1      ILE   9  -3.187   7.908   7.908
   71   2HD1  ILE   9          1HD1      ILE   9  -4.303   9.263   9.263
   72   3HD1  ILE   9          3HD1      ILE   9  -3.903   8.264   8.264
   73    H    ILE  10           H        ILE  10  -0.367  11.169  11.169
   74    HA   ILE  10           HA       ILE  10  -1.635  13.859  13.859
   75    HB   ILE  10           HB       ILE  10  -0.148  14.271  14.271
   76   1HG1  ILE  10          2HG1      ILE  10   1.915  12.441  12.441
   77   2HG1  ILE  10          1HG1      ILE  10   0.493  11.425  11.425
   78   1HG2  ILE  10          2HG2      ILE  10   0.902  13.693  13.693
   79   2HG2  ILE  10          1HG2      ILE  10   2.078  14.042  14.042
   80   3HG2  ILE  10          3HG2      ILE  10   0.827  15.222  15.222
   81   1HD1  ILE  10          3HD1      ILE  10  -0.486  12.402  12.402
   82   2HD1  ILE  10          2HD1      ILE  10   1.017  13.290  13.290
   83   3HD1  ILE  10          1HD1      ILE  10   1.017  11.527  11.527
   84    H    ARG  11           H        ARG  11  -1.467  10.557  10.557
   85    HA   ARG  11           HA       ARG  11  -3.883  11.075  11.075
   86   1HB   ARG  11          2HB       ARG  11  -1.210  10.473  10.473
   87   2HB   ARG  11          1HB       ARG  11  -2.530   9.502   9.502
   88   1HG   ARG  11          2HG       ARG  11  -3.710  11.930  11.930
   89   2HG   ARG  11          1HG       ARG  11  -2.028  12.423  12.423
   90   1HD   ARG  11          2HD       ARG  11  -1.813  10.790  10.790
   91   2HD   ARG  11          1HD       ARG  11  -3.531  10.424  10.424
   92    HE   ARG  11           HE       ARG  11  -2.869  13.266  13.266
   93   1HH1  ARG  11          2HH1      ARG  11  -5.127  10.995  10.995
   94   2HH1  ARG  11          1HH1      ARG  11  -5.241  11.316  11.316
   95   1HH2  ARG  11          1HH2      ARG  11  -2.441  13.361  13.361
   96   2HH2  ARG  11          2HH2      ARG  11  -3.722  12.656  12.656
   97    H    SER  12           H        SER  12  -4.775   8.979   8.979
   98    HA   SER  12           HA       SER  12  -4.010   6.398   6.398
   99   1HB   SER  12          2HB       SER  12  -5.526   6.031   6.031
  100   2HB   SER  12          1HB       SER  12  -4.527   7.426   7.426
  101    HG   SER  12           HG       SER  12  -7.235   7.258   7.258
  102    H    GLU  13           H        GLU  13  -6.053   4.869   4.869
  103    HA   GLU  13           HA       GLU  13  -8.311   6.053   6.053
  104   1HB   GLU  13          2HB       GLU  13  -7.834   4.889   4.889
  105   2HB   GLU  13          1HB       GLU  13  -6.590   6.074   6.074
  106   1HG   GLU  13          2HG       GLU  13  -5.820   3.606   3.606
  107   2HG   GLU  13          1HG       GLU  13  -6.291   3.251   3.251
  108    H    ASN  14           H        ASN  14  -7.865   4.166   4.166
  109    HA   ASN  14           HA       ASN  14  -9.858   2.168   2.168
  110   1HB   ASN  14          2HB       ASN  14  -7.694   0.611   0.611
  111   2HB   ASN  14          1HB       ASN  14  -8.547   0.372   0.372
  112   1HD2  ASN  14          2HD2      ASN  14  -5.610   1.178   1.178
  113   2HD2  ASN  14          1HD2      ASN  14  -6.970   0.189   0.189
  114    H    PHE  15           H        PHE  15  -9.581   4.287   4.287
  115    HA   PHE  15           HA       PHE  15  -8.976   3.204   3.204
  116   1HB   PHE  15          2HB       PHE  15  -9.314   5.679   5.679
  117   2HB   PHE  15          1HB       PHE  15 -11.034   5.352   5.352
  118    HD1  PHE  15           HD2      PHE  15 -10.125   3.208   3.208
  119    HD2  PHE  15           HD1      PHE  15  -9.798   7.422   7.422
  120    HE1  PHE  15           HE2      PHE  15 -10.038   3.632   3.632
  121    HE2  PHE  15           HE1      PHE  15  -9.700   7.833   7.833
  122    HZ   PHE  15           HZ       PHE  15  -9.823   5.920   5.920
  123    H    GLU  16           H        GLU  16 -12.220   3.956   3.956
  124    HA   GLU  16           HA       GLU  16 -13.684   2.431   2.431
  125   1HB   GLU  16          2HB       GLU  16 -14.464   4.100   4.100
  126   2HB   GLU  16          1HB       GLU  16 -14.626   2.617   2.617
  127   1HG   GLU  16          2HG       GLU  16 -16.091   1.658   1.658
  128   2HG   GLU  16          1HG       GLU  16 -15.901   3.107   3.107
  129    H    GLU  17           H        GLU  17 -11.910   1.467   1.467
  130    HA   GLU  17           HA       GLU  17 -13.088  -1.083  -1.083
  131   1HB   GLU  17          2HB       GLU  17 -10.282  -0.069  -0.069
  132   2HB   GLU  17          1HB       GLU  17 -10.943  -1.561  -1.561
  133   1HG   GLU  17          2HG       GLU  17 -12.913   0.061   0.061
  134   2HG   GLU  17          1HG       GLU  17 -11.627   1.263   1.263
  135    H    LEU  18           H        LEU  18 -10.440  -0.016  -0.016
  136    HA   LEU  18           HA       LEU  18  -9.872  -2.702  -2.702
  137   1HB   LEU  18          2HB       LEU  18  -8.513  -0.241  -0.241
  138   2HB   LEU  18          1HB       LEU  18  -8.872  -0.578  -0.578
  139    HG   LEU  18           HG       LEU  18  -7.877  -2.826  -2.826
  140   1HD1  LEU  18          3HD1      LEU  18  -8.205  -2.331  -2.331
  141   2HD1  LEU  18          2HD1      LEU  18  -6.467  -2.428  -2.428
  142   3HD1  LEU  18          1HD1      LEU  18  -7.512  -3.763  -3.763
  143   1HD2  LEU  18          3HD2      LEU  18  -6.406  -0.300  -0.300
  144   2HD2  LEU  18          2HD2      LEU  18  -6.139  -1.577  -1.577
  145   3HD2  LEU  18          1HD2      LEU  18  -5.498  -1.745  -1.745
  146    H    LEU  19           H        LEU  19 -12.162  -0.263  -0.263
  147    HA   LEU  19           HA       LEU  19 -12.441  -1.277  -1.277
  148   1HB   LEU  19          2HB       LEU  19 -14.191   0.748   0.748
  149   2HB   LEU  19          1HB       LEU  19 -14.110   0.455   0.455
  150    HG   LEU  19           HG       LEU  19 -12.070   1.818   1.818
  151   1HD1  LEU  19          1HD1      LEU  19 -13.501   2.482   2.482
  152   2HD1  LEU  19          3HD1      LEU  19 -12.251   3.492   3.492
  153   3HD1  LEU  19          2HD1      LEU  19 -13.764   3.196   3.196
  154   1HD2  LEU  19          1HD2      LEU  19 -10.902   0.086   0.086
  155   2HD2  LEU  19          3HD2      LEU  19 -10.438   1.751   1.751
  156   3HD2  LEU  19          2HD2      LEU  19 -11.564   0.929   0.929
  157    H    LYS  20           H        LYS  20 -13.735  -1.841  -1.841
  158    HA   LYS  20           HA       LYS  20 -16.224  -3.060  -3.060
  159   1HB   LYS  20          2HB       LYS  20 -15.060  -3.305  -3.305
  160   2HB   LYS  20          1HB       LYS  20 -16.742  -3.498  -3.498
  161   1HG   LYS  20          2HG       LYS  20 -15.806  -0.891  -0.891
  162   2HG   LYS  20          1HG       LYS  20 -15.454  -1.128  -1.128
  163   1HD   LYS  20          2HD       LYS  20 -18.158  -1.572  -1.572
  164   2HD   LYS  20          1HD       LYS  20 -17.699  -0.134  -0.134
  165   1HE   LYS  20          2HE       LYS  20 -17.005  -2.188  -2.188
  166   2HE   LYS  20          1HE       LYS  20 -18.487  -2.788  -2.788
  167   1HZ   LYS  20          2HZ       LYS  20 -19.383  -0.460  -0.460
  168   2HZ   LYS  20          1HZ       LYS  20 -18.073  -0.312  -0.312
  169   3HZ   LYS  20          3HZ       LYS  20 -19.225  -1.533  -1.533
  170    H    VAL  21           H        VAL  21 -12.983  -3.954  -3.954
  171    HA   VAL  21           HA       VAL  21 -13.500  -6.823  -6.823
  172    HB   VAL  21           HB       VAL  21 -11.664  -5.704  -5.704
  173   1HG1  VAL  21          1HG1      VAL  21 -11.060  -4.069  -4.069
  174   2HG1  VAL  21          3HG1      VAL  21 -10.307  -5.378  -5.378
  175   3HG1  VAL  21          2HG1      VAL  21  -9.675  -4.912  -4.912
  176   1HG2  VAL  21          3HG2      VAL  21 -11.251  -7.947  -7.947
  177   2HG2  VAL  21          2HG2      VAL  21 -11.163  -7.946  -7.946
  178   3HG2  VAL  21          1HG2      VAL  21  -9.816  -7.321  -7.321
  179    H    LEU  22           H        LEU  22 -12.129  -4.485  -4.485
  180    HA   LEU  22           HA       LEU  22 -11.343  -6.282  -6.282
  181   1HB   LEU  22          2HB       LEU  22 -11.748  -3.376  -3.376
  182   2HB   LEU  22          1HB       LEU  22 -11.961  -3.912  -3.912
  183    HG   LEU  22           HG       LEU  22  -9.727  -4.819  -4.819
  184   1HD1  LEU  22          3HD1      LEU  22  -9.733  -5.655  -5.655
  185   2HD1  LEU  22          2HD1      LEU  22  -9.416  -4.002  -4.002
  186   3HD1  LEU  22          1HD1      LEU  22  -8.241  -4.852  -4.852
  187   1HD2  LEU  22          2HD2      LEU  22 -10.206  -2.253  -2.253
  188   2HD2  LEU  22          1HD2      LEU  22  -8.533  -2.794  -2.794
  189   3HD2  LEU  22          3HD2      LEU  22  -9.396  -2.230  -2.230
  190    H    GLY  23           H        GLY  23 -14.165  -4.210  -4.210
  191   1HA   GLY  23          2HA       GLY  23 -15.595  -5.699  -5.699
  192   2HA   GLY  23          1HA       GLY  23 -16.046  -4.107  -4.107
  193    H    VAL  24           H        VAL  24 -18.158  -4.680  -4.680
  194    HA   VAL  24           HA       VAL  24 -18.567  -6.066  -6.066
  195    HB   VAL  24           HB       VAL  24 -20.326  -7.573  -7.573
  196   1HG1  VAL  24          3HG1      VAL  24 -17.858  -8.203  -8.203
  197   2HG1  VAL  24          2HG1      VAL  24 -17.663  -8.094  -8.094
  198   3HG1  VAL  24          1HG1      VAL  24 -18.791  -9.261  -9.261
  199   1HG2  VAL  24          3HG2      VAL  24 -19.150  -6.478  -6.478
  200   2HG2  VAL  24          2HG2      VAL  24 -20.841  -6.478  -6.478
  201   3HG2  VAL  24          1HG2      VAL  24 -20.052  -7.993  -7.993
  202    H    ASN  25           H        ASN  25 -20.023  -4.456  -4.456
  203    HA   ASN  25           HA       ASN  25 -22.539  -3.808  -3.808
  204   1HB   ASN  25          2HB       ASN  25 -21.382  -3.460  -3.460
  205   2HB   ASN  25          1HB       ASN  25 -21.265  -1.827  -1.827
  206   1HD2  ASN  25          2HD2      ASN  25 -24.634  -1.143  -1.143
  207   2HD2  ASN  25          1HD2      ASN  25 -23.069  -0.560  -0.560
  208    H    VAL  26           H        VAL  26 -22.623  -0.950  -0.950
  209    HA   VAL  26           HA       VAL  26 -20.973  -0.133  -0.133
  210    HB   VAL  26           HB       VAL  26 -23.646   1.087   1.087
  211   1HG1  VAL  26          3HG1      VAL  26 -21.810   1.892   1.892
  212   2HG1  VAL  26          2HG1      VAL  26 -22.492   0.612   0.612
  213   3HG1  VAL  26          1HG1      VAL  26 -23.517   1.931   1.931
  214   1HG2  VAL  26          2HG2      VAL  26 -23.107  -1.479  -1.479
  215   2HG2  VAL  26          1HG2      VAL  26 -24.224  -1.232  -1.232
  216   3HG2  VAL  26          3HG2      VAL  26 -24.572  -0.525  -0.525
  217    H    MET  27           H        MET  27 -22.789   1.103   1.103
  218    HA   MET  27           HA       MET  27 -21.509   3.685   3.685
  219   1HB   MET  27          2HB       MET  27 -23.673   3.065   3.065
  220   2HB   MET  27          1HB       MET  27 -22.680   2.248   2.248
  221   1HG   MET  27          2HG       MET  27 -21.681   4.256   4.256
  222   2HG   MET  27          1HG       MET  27 -22.132   5.112   5.112
  223   1HE   MET  27          3HE       MET  27 -22.198   6.369   6.369
  224   2HE   MET  27          2HE       MET  27 -23.654   7.290   7.290
  225   3HE   MET  27          1HE       MET  27 -23.555   6.378   6.378
  226    H    LEU  28           H        LEU  28 -20.704   0.550   0.550
  227    HA   LEU  28           HA       LEU  28 -18.748   1.213   1.213
  228   1HB   LEU  28          2HB       LEU  28 -19.557  -1.096  -1.096
  229   2HB   LEU  28          1HB       LEU  28 -17.838  -1.102  -1.102
  230    HG   LEU  28           HG       LEU  28 -19.117  -2.276  -2.276
  231   1HD1  LEU  28          3HD1      LEU  28 -17.140  -0.495  -0.495
  232   2HD1  LEU  28          2HD1      LEU  28 -18.412   0.249   0.249
  233   3HD1  LEU  28          1HD1      LEU  28 -17.902  -1.406  -1.406
  234   1HD2  LEU  28          3HD2      LEU  28 -20.554   0.382   0.382
  235   2HD2  LEU  28          2HD2      LEU  28 -21.260  -1.170  -1.170
  236   3HD2  LEU  28          1HD2      LEU  28 -20.677  -0.910  -0.910
  237    H    ARG  29           H        ARG  29 -18.589   1.338   1.338
  238    HA   ARG  29           HA       ARG  29 -15.650   1.543   1.543
  239   1HB   ARG  29          2HB       ARG  29 -17.627   1.982   1.982
  240   2HB   ARG  29          1HB       ARG  29 -15.887   1.757   1.757
  241   1HG   ARG  29          2HG       ARG  29 -16.157  -0.476  -0.476
  242   2HG   ARG  29          1HG       ARG  29 -16.930  -0.434  -0.434
  243   1HD   ARG  29          2HD       ARG  29 -18.382  -1.437  -1.437
  244   2HD   ARG  29          1HD       ARG  29 -19.098  -0.016  -0.016
  245    HE   ARG  29           HE       ARG  29 -17.591   0.706   0.706
  246   1HH1  ARG  29          2HH1      ARG  29 -19.902  -1.616  -1.616
  247   2HH1  ARG  29          1HH1      ARG  29 -21.104  -0.721  -0.721
  248   1HH2  ARG  29          1HH2      ARG  29 -19.417   2.299   2.299
  249   2HH2  ARG  29          2HH2      ARG  29 -20.832   1.497   1.497
  250    H    LYS  30           H        LYS  30 -18.469   3.626   3.626
  251    HA   LYS  30           HA       LYS  30 -17.034   5.986   5.986
  252   1HB   LYS  30          2HB       LYS  30 -19.655   5.341   5.341
  253   2HB   LYS  30          1HB       LYS  30 -19.568   6.290   6.290
  254   1HG   LYS  30          2HG       LYS  30 -19.973   7.962   7.962
  255   2HG   LYS  30          1HG       LYS  30 -18.210   7.972   7.972
  256   1HD   LYS  30          2HD       LYS  30 -18.006   6.876   6.876
  257   2HD   LYS  30          1HD       LYS  30 -19.611   6.152   6.152
  258   1HE   LYS  30          2HE       LYS  30 -19.474   9.127   9.127
  259   2HE   LYS  30          1HE       LYS  30 -19.109   8.263   8.263
  260   1HZ   LYS  30          1HZ       LYS  30 -21.245   6.955   6.955
  261   2HZ   LYS  30          3HZ       LYS  30 -21.605   8.319   8.319
  262   3HZ   LYS  30          2HZ       LYS  30 -21.374   8.481   8.481
  263    H    ILE  31           H        ILE  31 -17.546   4.449   4.449
  264    HA   ILE  31           HA       ILE  31 -17.017   6.855   6.855
  265    HB   ILE  31           HB       ILE  31 -16.904   3.919   3.919
  266   1HG1  ILE  31          2HG1      ILE  31 -19.049   5.932   5.932
  267   2HG1  ILE  31          1HG1      ILE  31 -19.122   4.992   4.992
  268   1HG2  ILE  31          2HG2      ILE  31 -16.566   6.501   6.501
  269   2HG2  ILE  31          1HG2      ILE  31 -17.330   5.134   5.134
  270   3HG2  ILE  31          3HG2      ILE  31 -15.688   4.983   4.983
  271   1HD1  ILE  31          2HD1      ILE  31 -18.782   3.735   3.735
  272   2HD1  ILE  31          1HD1      ILE  31 -20.353   3.964   3.964
  273   3HD1  ILE  31          3HD1      ILE  31 -19.148   2.916   2.916
  274    H    ALA  32           H        ALA  32 -15.126   4.285   4.285
  275    HA   ALA  32           HA       ALA  32 -12.671   5.035   5.035
  276   1HB   ALA  32          1HB       ALA  32 -13.566   2.824   2.824
  277   2HB   ALA  32          3HB       ALA  32 -12.066   3.463   3.463
  278   3HB   ALA  32          2HB       ALA  32 -12.124   2.937   2.937
  279    H    VAL  33           H        VAL  33 -14.334   5.864   5.864
  280    HA   VAL  33           HA       VAL  33 -12.025   7.040   7.040
  281    HB   VAL  33           HB       VAL  33 -14.933   7.669   7.669
  282   1HG1  VAL  33          3HG1      VAL  33 -12.380   7.685   7.685
  283   2HG1  VAL  33          2HG1      VAL  33 -13.983   7.856   7.856
  284   3HG1  VAL  33          1HG1      VAL  33 -13.392   9.066   9.066
  285   1HG2  VAL  33          3HG2      VAL  33 -13.534   5.118   5.118
  286   2HG2  VAL  33          2HG2      VAL  33 -15.243   5.473   5.473
  287   3HG2  VAL  33          1HG2      VAL  33 -14.115   5.681   5.681
  288    H    ALA  34           H        ALA  34 -14.655   8.101   8.101
  289    HA   ALA  34           HA       ALA  34 -13.977  10.924  10.924
  290   1HB   ALA  34          2HB       ALA  34 -16.263   9.799   9.799
  291   2HB   ALA  34          1HB       ALA  34 -15.549   9.726   9.726
  292   3HB   ALA  34          3HB       ALA  34 -15.771  11.284  11.284
  293    H    ALA  35           H        ALA  35 -13.321   8.226   8.226
  294    HA   ALA  35           HA       ALA  35 -12.028   9.685   9.685
  295   1HB   ALA  35          1HB       ALA  35 -12.070   6.828   6.828
  296   2HB   ALA  35          3HB       ALA  35 -10.890   7.321   7.321
  297   3HB   ALA  35          2HB       ALA  35 -12.614   7.502   7.502
  298    H    ALA  36           H        ALA  36 -10.924   8.286   8.286
  299    HA   ALA  36           HA       ALA  36  -8.114   8.680   8.680
  300   1HB   ALA  36          1HB       ALA  36  -9.848   7.863   7.863
  301   2HB   ALA  36          3HB       ALA  36  -8.351   8.665   8.665
  302   3HB   ALA  36          2HB       ALA  36  -8.296   7.206   7.206
  303    H    SER  37           H        SER  37 -10.227  10.306  10.306
  304    HA   SER  37           HA       SER  37 -10.104  12.478  12.478
  305   1HB   SER  37          2HB       SER  37  -9.545  12.998  12.998
  306   2HB   SER  37          1HB       SER  37  -9.856  14.274  14.274
  307    HG   SER  37           HG       SER  37 -11.681  13.245  13.245
  308    H    LYS  38           H        LYS  38  -7.852  11.128  11.128
  309    HA   LYS  38           HA       LYS  38  -5.620  11.436  11.436
  310   1HB   LYS  38          2HB       LYS  38  -5.870  14.286  14.286
  311   2HB   LYS  38          1HB       LYS  38  -4.739  13.671  13.671
  312   1HG   LYS  38          2HG       LYS  38  -7.085  12.956  12.956
  313   2HG   LYS  38          1HG       LYS  38  -7.598  14.407  14.407
  314   1HD   LYS  38          2HD       LYS  38  -6.345  15.793  15.793
  315   2HD   LYS  38          1HD       LYS  38  -5.022  14.635  14.635
  316   1HE   LYS  38          2HE       LYS  38  -6.168  13.386  13.386
  317   2HE   LYS  38          1HE       LYS  38  -7.674  14.258  14.258
  318   1HZ   LYS  38          3HZ       LYS  38  -5.203  15.635  15.635
  319   2HZ   LYS  38          2HZ       LYS  38  -6.297  14.970  14.970
  320   3HZ   LYS  38          1HZ       LYS  38  -6.800  16.203  16.203
  321    HA   PRO  39           HA       PRO  39  -4.722  10.927  10.927
  322   1HB   PRO  39          2HB       PRO  39  -3.814   8.335   8.335
  323   2HB   PRO  39          1HB       PRO  39  -5.496   8.779   8.779
  324   1HG   PRO  39          2HG       PRO  39  -4.270   7.778   7.778
  325   2HG   PRO  39          1HG       PRO  39  -5.939   7.628   7.628
  326   1HD   PRO  39          2HD       PRO  39  -5.047   9.450   9.450
  327   2HD   PRO  39          1HD       PRO  39  -6.589   9.543   9.543
  328    H    ALA  40           H        ALA  40  -2.641  10.824  10.824
  329    HA   ALA  40           HA       ALA  40  -0.395  11.333  11.333
  330   1HB   ALA  40          1HB       ALA  40  -1.064  12.876  12.876
  331   2HB   ALA  40          3HB       ALA  40  -0.276  11.656  11.656
  332   3HB   ALA  40          2HB       ALA  40   0.644  12.509  12.509
  333    H    VAL  41           H        VAL  41   1.786  10.526  10.526
  334    HA   VAL  41           HA       VAL  41   1.596   7.950   7.950
  335    HB   VAL  41           HB       VAL  41   2.422   8.228   8.228
  336   1HG1  VAL  41          1HG1      VAL  41   2.960   5.925   5.925
  337   2HG1  VAL  41          3HG1      VAL  41   3.150   5.844   5.844
  338   3HG1  VAL  41          2HG1      VAL  41   4.170   6.925   6.925
  339   1HG2  VAL  41          2HG2      VAL  41   0.411   6.554   6.554
  340   2HG2  VAL  41          1HG2      VAL  41   0.097   7.746   7.746
  341   3HG2  VAL  41          3HG2      VAL  41   0.874   6.215   6.215
  342    H    GLU  42           H        GLU  42   3.843   7.126   7.126
  343    HA   GLU  42           HA       GLU  42   6.037   9.063   9.063
  344   1HB   GLU  42          2HB       GLU  42   4.904   9.836   9.836
  345   2HB   GLU  42          1HB       GLU  42   5.114   8.235   8.235
  346   1HG   GLU  42          2HG       GLU  42   7.637   8.579   8.579
  347   2HG   GLU  42          1HG       GLU  42   7.223  10.282  10.282
  348    H    ILE  43           H        ILE  43   7.558   7.695   7.695
  349    HA   ILE  43           HA       ILE  43   7.646   4.916   4.916
  350    HB   ILE  43           HB       ILE  43   8.748   6.272   6.272
  351   1HG1  ILE  43          2HG1      ILE  43   7.509   4.028   4.028
  352   2HG1  ILE  43          1HG1      ILE  43   6.644   4.283   4.283
  353   1HG2  ILE  43          2HG2      ILE  43   9.605   3.667   3.667
  354   2HG2  ILE  43          1HG2      ILE  43   9.537   3.816   3.816
  355   3HG2  ILE  43          3HG2      ILE  43  10.583   4.885   4.885
  356   1HD1  ILE  43          1HD1      ILE  43   6.990   6.355   6.355
  357   2HD1  ILE  43          3HD1      ILE  43   5.522   5.425   5.425
  358   3HD1  ILE  43          2HD1      ILE  43   6.097   6.576   6.576
  359    H    LYS  44           H        LYS  44   9.316   4.153   4.153
  360    HA   LYS  44           HA       LYS  44  11.607   5.996   5.996
  361   1HB   LYS  44          2HB       LYS  44  11.269   3.863   3.863
  362   2HB   LYS  44          1HB       LYS  44  11.432   5.594   5.594
  363   1HG   LYS  44          2HG       LYS  44   9.056   5.940   5.940
  364   2HG   LYS  44          1HG       LYS  44   8.822   4.314   4.314
  365   1HD   LYS  44          2HD       LYS  44   9.294   3.327   3.327
  366   2HD   LYS  44          1HD       LYS  44   9.941   4.838   4.838
  367   1HE   LYS  44          2HE       LYS  44   7.141   4.917   4.917
  368   2HE   LYS  44          1HE       LYS  44   7.419   4.022   4.022
  369   1HZ   LYS  44          1HZ       LYS  44   8.704   6.051   6.051
  370   2HZ   LYS  44          3HZ       LYS  44   8.001   6.866   6.866
  371   3HZ   LYS  44          2HZ       LYS  44   7.015   6.214   6.214
  372    H    GLN  45           H        GLN  45  13.242   5.202   5.202
  373    HA   GLN  45           HA       GLN  45  13.407   2.264   2.264
  374   1HB   GLN  45          2HB       GLN  45  13.491   3.709   3.709
  375   2HB   GLN  45          1HB       GLN  45  14.939   4.496   4.496
  376   1HG   GLN  45          2HG       GLN  45  16.110   2.310   2.310
  377   2HG   GLN  45          1HG       GLN  45  14.673   1.548   1.548
  378   1HE2  GLN  45          2HE2      GLN  45  16.285   2.160   2.160
  379   2HE2  GLN  45          1HE2      GLN  45  15.921   0.978   0.978
  380    H    GLU  46           H        GLU  46  14.804   1.058   1.058
  381    HA   GLU  46           HA       GLU  46  17.285   2.348   2.348
  382   1HB   GLU  46          2HB       GLU  46  15.256   0.621   0.621
  383   2HB   GLU  46          1HB       GLU  46  16.948   0.315   0.315
  384   1HG   GLU  46          2HG       GLU  46  17.275   2.597   2.597
  385   2HG   GLU  46          1HG       GLU  46  15.687   3.067   3.067
  386    H    GLY  47           H        GLY  47  17.466   1.317   1.317
  387   1HA   GLY  47          2HA       GLY  47  19.092  -0.123  -0.123
  388   2HA   GLY  47          1HA       GLY  47  19.056  -1.156  -1.156
  389    H    ASP  48           H        ASP  48  18.240  -3.127  -3.127
  390    HA   ASP  48           HA       ASP  48  16.373  -3.442  -3.442
  391   1HB   ASP  48          2HB       ASP  48  16.232  -5.833  -5.833
  392   2HB   ASP  48          1HB       ASP  48  17.804  -5.311  -5.311
  393    H    THR  49           H        THR  49  15.878  -2.324  -2.324
  394    HA   THR  49           HA       THR  49  13.290  -3.707  -3.707
  395    HB   THR  49           HB       THR  49  15.006  -1.948  -1.948
  396    HG1  THR  49           HG1      THR  49  15.105  -3.769  -3.769
  397   1HG2  THR  49          2HG2      THR  49  12.087  -2.573  -2.573
  398   2HG2  THR  49          1HG2      THR  49  13.086  -2.507  -2.507
  399   3HG2  THR  49          3HG2      THR  49  12.956  -1.093  -1.093
  400    H    PHE  50           H        PHE  50  11.356  -2.615  -2.615
  401    HA   PHE  50           HA       PHE  50  11.505   0.297   0.297
  402   1HB   PHE  50          2HB       PHE  50  10.050  -1.790  -1.790
  403   2HB   PHE  50          1HB       PHE  50   9.880  -0.047  -0.047
  404    HD1  PHE  50           HD1      PHE  50  12.174  -2.917  -2.917
  405    HD2  PHE  50           HD2      PHE  50  11.671   1.279   1.279
  406    HE1  PHE  50           HE1      PHE  50  14.274  -2.897  -2.897
  407    HE2  PHE  50           HE2      PHE  50  13.763   1.300   1.300
  408    HZ   PHE  50           HZ       PHE  50  15.077  -0.789  -0.789
  409    H    TYR  51           H        TYR  51  10.222   1.282   1.282
  410    HA   TYR  51           HA       TYR  51   7.857  -0.121  -0.121
  411   1HB   TYR  51          2HB       TYR  51   9.612   0.850   0.850
  412   2HB   TYR  51          1HB       TYR  51   9.230   2.439   2.439
  413    HD1  TYR  51           HD1      TYR  51   6.643   3.068   3.068
  414    HD2  TYR  51           HD2      TYR  51   8.506   0.109   0.109
  415    HE1  TYR  51           HE1      TYR  51   4.794   3.267   3.267
  416    HE2  TYR  51           HE2      TYR  51   6.678   0.333   0.333
  417    HH   TYR  51           HH       TYR  51   5.003   2.143   2.143
  418    H    ILE  52           H        ILE  52   5.780   0.949   0.949
  419    HA   ILE  52           HA       ILE  52   5.769   3.400   3.400
  420    HB   ILE  52           HB       ILE  52   3.887   1.155   1.155
  421   1HG1  ILE  52          2HG1      ILE  52   6.756   1.460   1.460
  422   2HG1  ILE  52          1HG1      ILE  52   6.111   0.114   0.114
  423   1HG2  ILE  52          1HG2      ILE  52   4.030   3.697   3.697
  424   2HG2  ILE  52          3HG2      ILE  52   5.192   2.975   2.975
  425   3HG2  ILE  52          2HG2      ILE  52   3.534   2.379   2.379
  426   1HD1  ILE  52          1HD1      ILE  52   4.400   0.089   0.089
  427   2HD1  ILE  52          3HD1      ILE  52   5.854   0.705   0.705
  428   3HD1  ILE  52          2HD1      ILE  52   5.894  -0.847  -0.847
  429    H    LYS  53           H        LYS  53   4.810   4.736   4.736
  430    HA   LYS  53           HA       LYS  53   2.368   3.795   3.795
  431   1HB   LYS  53          2HB       LYS  53   4.395   5.048   5.048
  432   2HB   LYS  53          1HB       LYS  53   3.669   6.482   6.482
  433   1HG   LYS  53          2HG       LYS  53   2.120   6.568   6.568
  434   2HG   LYS  53          1HG       LYS  53   1.608   4.919   4.919
  435   1HD   LYS  53          2HD       LYS  53   2.333   4.824   4.824
  436   2HD   LYS  53          1HD       LYS  53   3.708   4.199   4.199
  437   1HE   LYS  53          2HE       LYS  53   4.979   6.108   6.108
  438   2HE   LYS  53          1HE       LYS  53   3.563   7.145   7.145
  439   1HZ   LYS  53          2HZ       LYS  53   4.201   5.044   5.044
  440   2HZ   LYS  53          1HZ       LYS  53   4.878   6.598   6.598
  441   3HZ   LYS  53          3HZ       LYS  53   3.195   6.401   6.401
  442    H    THR  54           H        THR  54   0.489   4.233   4.233
  443    HA   THR  54           HA       THR  54   0.331   6.675   6.675
  444    HB   THR  54           HB       THR  54  -1.706   4.439   4.439
  445    HG1  THR  54           HG1      THR  54  -0.466   3.276   3.276
  446   1HG2  THR  54          2HG2      THR  54  -1.799   6.927   6.927
  447   2HG2  THR  54          1HG2      THR  54  -1.412   5.799   5.799
  448   3HG2  THR  54          3HG2      THR  54  -2.857   5.555   5.555
  449    H    SER  55           H        SER  55  -1.244   8.275   8.275
  450    HA   SER  55           HA       SER  55  -2.837   7.872   7.872
  451   1HB   SER  55          2HB       SER  55  -2.256  10.417  10.417
  452   2HB   SER  55          1HB       SER  55  -1.125   9.171   9.171
  453    HG   SER  55           HG       SER  55  -0.501  11.094  11.094
  454    H    THR  56           H        THR  56  -4.821   8.889   8.889
  455    HA   THR  56           HA       THR  56  -5.598  10.383  10.383
  456    HB   THR  56           HB       THR  56  -7.954   9.391   9.391
  457    HG1  THR  56           HG1      THR  56  -7.900   7.836   7.836
  458   1HG2  THR  56          3HG2      THR  56  -5.738   7.764   7.764
  459   2HG2  THR  56          2HG2      THR  56  -7.456   7.380   7.380
  460   3HG2  THR  56          1HG2      THR  56  -6.833   8.875   8.875
  461    H    THR  57           H        THR  57  -6.849   9.649   9.649
  462    HA   THR  57           HA       THR  57  -6.678  12.241  12.241
  463    HB   THR  57           HB       THR  57  -8.249  12.981  12.981
  464    HG1  THR  57           HG1      THR  57  -9.594  13.895  13.895
  465   1HG2  THR  57          2HG2      THR  57  -9.100  10.672  10.672
  466   2HG2  THR  57          1HG2      THR  57 -10.093  10.777  10.777
  467   3HG2  THR  57          3HG2      THR  57 -10.368  11.893  11.893
  468    H    VAL  58           H        VAL  58  -8.667   9.355   9.355
  469    HA   VAL  58           HA       VAL  58  -8.800   9.147   9.147
  470    HB   VAL  58           HB       VAL  58 -10.881   8.172   8.172
  471   1HG1  VAL  58          2HG1      VAL  58 -10.496   8.051   8.051
  472   2HG1  VAL  58          1HG1      VAL  58 -12.136   8.343   8.343
  473   3HG1  VAL  58          3HG1      VAL  58 -11.269   6.891   6.891
  474   1HG2  VAL  58          2HG2      VAL  58 -10.409  10.824  10.824
  475   2HG2  VAL  58          1HG2      VAL  58 -11.527  10.341  10.341
  476   3HG2  VAL  58          3HG2      VAL  58 -12.002  10.195  10.195
  477    H    ARG  59           H        ARG  59  -7.672   7.656   7.656
  478    HA   ARG  59           HA       ARG  59  -7.850   4.946   4.946
  479   1HB   ARG  59          2HB       ARG  59  -8.486   5.011   5.011
  480   2HB   ARG  59          1HB       ARG  59  -7.005   5.864   5.864
  481   1HG   ARG  59          2HG       ARG  59  -5.725   3.968   3.968
  482   2HG   ARG  59          1HG       ARG  59  -6.631   3.294   3.294
  483   1HD   ARG  59          2HD       ARG  59  -8.476   3.330   3.330
  484   2HD   ARG  59          1HD       ARG  59  -6.964   2.812   2.812
  485    HE   ARG  59           HE       ARG  59  -7.080   0.809   0.809
  486   1HH1  ARG  59          1HH2      ARG  59  -7.451   1.828   1.828
  487   2HH1  ARG  59          2HH2      ARG  59  -9.074   1.363   1.363
  488   1HH2  ARG  59          1HH1      ARG  59 -10.504   0.773   0.773
  489   2HH2  ARG  59          2HH1      ARG  59  -9.979   0.789   0.789
  490    H    THR  60           H        THR  60  -5.211   6.226   6.226
  491    HA   THR  60           HA       THR  60  -2.919   6.432   6.432
  492    HB   THR  60           HB       THR  60  -3.398   6.027   6.027
  493    HG1  THR  60           HG1      THR  60  -3.930   8.256   8.256
  494   1HG2  THR  60          1HG2      THR  60  -1.472   7.517   7.517
  495   2HG2  THR  60          3HG2      THR  60  -1.677   7.994   7.994
  496   3HG2  THR  60          2HG2      THR  60  -1.124   6.367   6.367
  497    H    THR  61           H        THR  61  -2.688   4.354   4.354
  498    HA   THR  61           HA       THR  61  -2.344   2.040   2.040
  499    HB   THR  61           HB       THR  61  -2.078   0.897   0.897
  500    HG1  THR  61           HG1      THR  61  -3.015   2.007   2.007
  501   1HG2  THR  61          2HG2      THR  61  -3.877   0.601   0.601
  502   2HG2  THR  61          1HG2      THR  61  -4.820   1.785   1.785
  503   3HG2  THR  61          3HG2      THR  61  -4.362   0.259   0.259
  504    H    GLU  62           H        GLU  62  -0.464   0.538   0.538
  505    HA   GLU  62           HA       GLU  62   1.787   1.845   1.845
  506   1HB   GLU  62          2HB       GLU  62   3.268   1.873   1.873
  507   2HB   GLU  62          1HB       GLU  62   1.963   3.049   3.049
  508   1HG   GLU  62          2HG       GLU  62   1.578   0.312   0.312
  509   2HG   GLU  62          1HG       GLU  62   2.473   1.538   1.538
  510    H    ILE  63           H        ILE  63   3.388   0.359   0.359
  511    HA   ILE  63           HA       ILE  63   3.074  -2.421  -2.421
  512    HB   ILE  63           HB       ILE  63   3.662  -3.250  -3.250
  513   1HG1  ILE  63          2HG1      ILE  63   3.199  -0.365  -0.365
  514   2HG1  ILE  63          1HG1      ILE  63   4.786  -1.130  -1.130
  515   1HG2  ILE  63          1HG2      ILE  63   1.239  -2.598  -2.598
  516   2HG2  ILE  63          3HG2      ILE  63   1.283  -1.503  -1.503
  517   3HG2  ILE  63          2HG2      ILE  63   1.461  -3.241  -3.241
  518   1HD1  ILE  63          3HD1      ILE  63   3.287  -2.933  -2.933
  519   2HD1  ILE  63          2HD1      ILE  63   2.732  -1.359  -1.359
  520   3HD1  ILE  63          1HD1      ILE  63   4.445  -1.767  -1.767
  521    H    ASN  64           H        ASN  64   5.218  -3.698  -3.698
  522    HA   ASN  64           HA       ASN  64   7.620  -2.081  -2.081
  523   1HB   ASN  64          2HB       ASN  64   8.614  -2.650  -2.650
  524   2HB   ASN  64          1HB       ASN  64   7.265  -1.527  -1.527
  525   1HD2  ASN  64          2HD2      ASN  64   5.021  -3.916  -3.916
  526   2HD2  ASN  64          1HD2      ASN  64   5.063  -2.612  -2.612
  527    H    PHE  65           H        PHE  65   9.208  -3.439  -3.439
  528    HA   PHE  65           HA       PHE  65   9.354  -6.255  -6.255
  529   1HB   PHE  65          2HB       PHE  65   8.786  -7.206  -7.206
  530   2HB   PHE  65          1HB       PHE  65   7.441  -6.251  -6.251
  531    HD1  PHE  65           HD2      PHE  65   7.017  -3.941  -3.941
  532    HD2  PHE  65           HD1      PHE  65   9.981  -6.569  -6.569
  533    HE1  PHE  65           HE2      PHE  65   7.155  -2.511  -2.511
  534    HE2  PHE  65           HE1      PHE  65  10.130  -5.141  -5.141
  535    HZ   PHE  65           HZ       PHE  65   8.723  -3.109  -3.109
  536    H    LYS  66           H        LYS  66  10.716  -7.434  -7.434
  537    HA   LYS  66           HA       LYS  66  13.033  -5.701  -5.701
  538   1HB   LYS  66          2HB       LYS  66  14.465  -7.774  -7.774
  539   2HB   LYS  66          1HB       LYS  66  13.846  -6.979  -6.979
  540   1HG   LYS  66          2HG       LYS  66  11.906  -8.607  -8.607
  541   2HG   LYS  66          1HG       LYS  66  12.755  -9.473  -9.473
  542   1HD   LYS  66          2HD       LYS  66  13.983  -8.874  -8.874
  543   2HD   LYS  66          1HD       LYS  66  13.158 -10.386 -10.386
  544   1HE   LYS  66          2HE       LYS  66  14.881 -11.153 -11.153
  545   2HE   LYS  66          1HE       LYS  66  15.198  -9.566  -9.566
  546   1HZ   LYS  66          3HZ       LYS  66  15.842 -10.138 -10.138
  547   2HZ   LYS  66          2HZ       LYS  66  16.924 -10.554 -10.554
  548   3HZ   LYS  66          1HZ       LYS  66  16.475  -8.932  -8.932
  549    H    VAL  67           H        VAL  67  14.088  -6.442  -6.442
  550    HA   VAL  67           HA       VAL  67  12.157  -7.776  -7.776
  551    HB   VAL  67           HB       VAL  67  14.862  -7.241  -7.241
  552   1HG1  VAL  67          3HG1      VAL  67  11.983  -6.781  -6.781
  553   2HG1  VAL  67          2HG1      VAL  67  13.296  -6.046  -6.046
  554   3HG1  VAL  67          1HG1      VAL  67  13.184  -7.801  -7.801
  555   1HG2  VAL  67          2HG2      VAL  67  13.232  -5.115  -5.115
  556   2HG2  VAL  67          1HG2      VAL  67  14.982  -5.243  -5.243
  557   3HG2  VAL  67          3HG2      VAL  67  13.999  -4.733  -4.733
  558    H    GLY  68           H        GLY  68  12.082  -9.974  -9.974
  559   1HA   GLY  68          2HA       GLY  68  13.519 -11.907 -11.907
  560   2HA   GLY  68          1HA       GLY  68  14.650 -11.459 -11.459
  561    H    GLU  69           H        GLU  69  12.588 -10.897 -10.897
  562    HA   GLU  69           HA       GLU  69  11.735 -13.720 -13.720
  563   1HB   GLU  69          2HB       GLU  69  12.614 -11.486 -11.486
  564   2HB   GLU  69          1HB       GLU  69  11.684 -12.854 -12.854
  565   1HG   GLU  69          2HG       GLU  69  13.456 -14.319 -14.319
  566   2HG   GLU  69          1HG       GLU  69  14.435 -12.851 -12.851
  567    H    GLU  70           H        GLU  70   9.666 -13.998 -13.998
  568    HA   GLU  70           HA       GLU  70   7.651 -12.080 -12.080
  569   1HB   GLU  70          2HB       GLU  70   7.223 -14.588 -14.588
  570   2HB   GLU  70          1HB       GLU  70   6.024 -13.734 -13.734
  571   1HG   GLU  70          2HG       GLU  70   7.146 -14.335 -14.335
  572   2HG   GLU  70          1HG       GLU  70   8.522 -14.991 -14.991
  573    H    PHE  71           H        PHE  71   5.857 -11.481 -11.481
  574    HA   PHE  71           HA       PHE  71   6.612 -11.291 -11.291
  575   1HB   PHE  71          2HB       PHE  71   6.641  -8.801  -8.801
  576   2HB   PHE  71          1HB       PHE  71   7.978  -9.477  -9.477
  577    HD1  PHE  71           HD2      PHE  71   7.710  -9.676  -9.676
  578    HD2  PHE  71           HD1      PHE  71   5.080  -7.336  -7.336
  579    HE1  PHE  71           HE2      PHE  71   6.966  -8.409  -8.409
  580    HE2  PHE  71           HE1      PHE  71   4.334  -6.070  -6.070
  581    HZ   PHE  71           HZ       PHE  71   5.274  -6.604  -6.604
  582    H    GLU  72           H        GLU  72   4.973  -9.419  -9.419
  583    HA   GLU  72           HA       GLU  72   2.318 -10.124 -10.124
  584   1HB   GLU  72          2HB       GLU  72   2.681  -9.242  -9.242
  585   2HB   GLU  72          1HB       GLU  72   1.344 -10.133 -10.133
  586   1HG   GLU  72          2HG       GLU  72   2.789 -12.095 -12.095
  587   2HG   GLU  72          1HG       GLU  72   4.151 -11.215 -11.215
  588    H    GLU  73           H        GLU  73   0.794  -8.413  -8.413
  589    HA   GLU  73           HA       GLU  73   1.485  -5.706  -5.706
  590   1HB   GLU  73          2HB       GLU  73   1.482  -4.766  -4.766
  591   2HB   GLU  73          1HB       GLU  73   2.865  -5.816  -5.816
  592   1HG   GLU  73          2HG       GLU  73   2.031  -7.536  -7.536
  593   2HG   GLU  73          1HG       GLU  73   0.361  -6.998  -6.998
  594    H    GLN  74           H        GLN  74  -0.202  -4.148  -4.148
  595    HA   GLN  74           HA       GLN  74  -2.848  -5.590  -5.590
  596   1HB   GLN  74          2HB       GLN  74  -1.926  -2.886  -2.886
  597   2HB   GLN  74          1HB       GLN  74  -3.605  -3.071  -3.071
  598   1HG   GLN  74          2HG       GLN  74  -3.835  -4.993  -4.993
  599   2HG   GLN  74          1HG       GLN  74  -2.186  -4.702  -4.702
  600   1HE2  GLN  74          2HE2      GLN  74  -4.991  -1.808  -1.808
  601   2HE2  GLN  74          1HE2      GLN  74  -5.121  -2.665  -2.665
  602    H    THR  75           H        THR  75  -4.375  -5.186  -5.186
  603    HA   THR  75           HA       THR  75  -3.310  -4.159  -4.159
  604    HB   THR  75           HB       THR  75  -4.741  -6.147  -6.147
  605    HG1  THR  75           HG1      THR  75  -6.343  -4.168  -4.168
  606   1HG2  THR  75          1HG2      THR  75  -6.443  -4.404  -4.404
  607   2HG2  THR  75          3HG2      THR  75  -7.320  -5.305  -5.305
  608   3HG2  THR  75          2HG2      THR  75  -6.349  -6.164  -6.164
  609    H    VAL  76           H        VAL  76  -5.031  -2.717  -2.717
  610    HA   VAL  76           HA       VAL  76  -5.277  -0.264  -0.264
  611    HB   VAL  76           HB       VAL  76  -4.417  -0.213  -0.213
  612   1HG1  VAL  76          2HG1      VAL  76  -6.360  -2.030  -2.030
  613   2HG1  VAL  76          1HG1      VAL  76  -7.115  -0.555  -0.555
  614   3HG1  VAL  76          3HG1      VAL  76  -5.542  -1.057  -1.057
  615   1HG2  VAL  76          3HG2      VAL  76  -5.992   1.619   1.619
  616   2HG2  VAL  76          2HG2      VAL  76  -5.376   1.828   1.828
  617   3HG2  VAL  76          1HG2      VAL  76  -7.017   1.235   1.235
  618    H    ASP  77           H        ASP  77  -7.332  -2.886  -2.886
  619    HA   ASP  77           HA       ASP  77  -9.797  -1.256  -1.256
  620   1HB   ASP  77          2HB       ASP  77  -9.309  -3.647  -3.647
  621   2HB   ASP  77          1HB       ASP  77  -9.896  -4.185  -4.185
  622    H    GLY  78           H        GLY  78  -8.154  -3.504  -3.504
  623   1HA   GLY  78          2HA       GLY  78  -8.216  -2.573  -2.573
  624   2HA   GLY  78          1HA       GLY  78  -9.964  -2.642  -2.642
  625    H    ARG  79           H        ARG  79  -7.445  -4.921  -4.921
  626    HA   ARG  79           HA       ARG  79  -8.570  -6.981  -6.981
  627   1HB   ARG  79          2HB       ARG  79  -8.355  -7.006  -7.006
  628   2HB   ARG  79          1HB       ARG  79  -8.208  -8.511  -8.511
  629   1HG   ARG  79          2HG       ARG  79 -10.471  -6.739  -6.739
  630   2HG   ARG  79          1HG       ARG  79 -10.583  -7.537  -7.537
  631   1HD   ARG  79          2HD       ARG  79  -9.741  -9.194  -9.194
  632   2HD   ARG  79          1HD       ARG  79 -11.440  -8.733  -8.733
  633    HE   ARG  79           HE       ARG  79 -10.320  -9.865  -9.865
  634   1HH1  ARG  79          2HH1      ARG  79 -13.138  -9.851  -9.851
  635   2HH1  ARG  79          1HH1      ARG  79 -13.349 -11.562 -11.562
  636   1HH2  ARG  79          1HH2      ARG  79 -10.065 -12.314 -12.314
  637   2HH2  ARG  79          2HH2      ARG  79 -11.609 -12.957 -12.957
  638    HA   PRO  80           HA       PRO  80  -4.210  -7.775  -7.775
  639   1HB   PRO  80          2HB       PRO  80  -4.323 -10.279 -10.279
  640   2HB   PRO  80          1HB       PRO  80  -4.696  -8.794  -8.794
  641   1HG   PRO  80          2HG       PRO  80  -6.555 -10.881 -10.881
  642   2HG   PRO  80          1HG       PRO  80  -6.762  -9.775  -9.775
  643   1HD   PRO  80          2HD       PRO  80  -7.924  -9.480  -9.480
  644   2HD   PRO  80          1HD       PRO  80  -7.859  -8.237  -8.237
  645    H    CYS  81           H        CYS  81  -2.697  -8.614  -8.614
  646    HA   CYS  81           HA       CYS  81  -3.041 -11.210 -11.210
  647   1HB   CYS  81          2HB       CYS  81  -2.885 -10.283 -10.283
  648   2HB   CYS  81          1HB       CYS  81  -4.416  -9.926  -9.926
  649    HG   CYS  81           HG       CYS  81  -3.269  -7.512  -7.512
  650    H    LYS  82           H        LYS  82  -1.071 -12.007 -12.007
  651    HA   LYS  82           HA       LYS  82   1.298 -10.526 -10.526
  652   1HB   LYS  82          2HB       LYS  82   2.485 -12.584 -12.584
  653   2HB   LYS  82          1HB       LYS  82   1.185 -12.929 -12.929
  654   1HG   LYS  82          2HG       LYS  82  -0.216 -13.802 -13.802
  655   2HG   LYS  82          1HG       LYS  82   0.710 -13.036 -13.036
  656   1HD   LYS  82          2HD       LYS  82   1.986 -15.094 -15.094
  657   2HD   LYS  82          1HD       LYS  82   1.035 -15.585 -15.585
  658   1HE   LYS  82          2HE       LYS  82   3.086 -13.457 -13.457
  659   2HE   LYS  82          1HE       LYS  82   3.662 -15.109 -15.109
  660   1HZ   LYS  82          1HZ       LYS  82   2.110 -15.801 -15.801
  661   2HZ   LYS  82          3HZ       LYS  82   1.711 -14.174 -14.174
  662   3HZ   LYS  82          2HZ       LYS  82   3.296 -14.716 -14.716
  663    H    SER  83           H        SER  83   3.125 -10.309 -10.309
  664    HA   SER  83           HA       SER  83   2.342 -10.130 -10.130
  665   1HB   SER  83          2HB       SER  83   1.870  -7.929  -7.929
  666   2HB   SER  83          1HB       SER  83   3.232  -7.884  -7.884
  667    HG   SER  83           HG       SER  83   3.525  -6.724  -6.724
  668    H    LEU  84           H        LEU  84   4.310  -9.872  -9.872
  669    HA   LEU  84           HA       LEU  84   6.895 -10.412 -10.412
  670   1HB   LEU  84          2HB       LEU  84   6.049 -12.661 -12.661
  671   2HB   LEU  84          1HB       LEU  84   5.758 -12.151 -12.151
  672    HG   LEU  84           HG       LEU  84   8.167 -11.768 -11.768
  673   1HD1  LEU  84          3HD1      LEU  84   8.627 -11.211 -11.211
  674   2HD1  LEU  84          2HD1      LEU  84   8.556 -12.936 -12.936
  675   3HD1  LEU  84          1HD1      LEU  84   9.795 -12.296 -12.296
  676   1HD2  LEU  84          2HD2      LEU  84   6.938 -14.143 -14.143
  677   2HD2  LEU  84          1HD2      LEU  84   8.666 -13.989 -13.989
  678   3HD2  LEU  84          3HD2      LEU  84   8.104 -14.469 -14.469
  679    H    VAL  85           H        VAL  85   8.715  -9.785  -9.785
  680    HA   VAL  85           HA       VAL  85   7.849  -8.407  -8.407
  681    HB   VAL  85           HB       VAL  85   9.549  -7.012  -7.012
  682   1HG1  VAL  85          3HG1      VAL  85   9.768  -6.242  -6.242
  683   2HG1  VAL  85          2HG1      VAL  85   8.018  -6.039  -6.039
  684   3HG1  VAL  85          1HG1      VAL  85   8.962  -5.030  -5.030
  685   1HG2  VAL  85          2HG2      VAL  85   6.564  -7.036  -7.036
  686   2HG2  VAL  85          1HG2      VAL  85   7.469  -7.164  -7.164
  687   3HG2  VAL  85          3HG2      VAL  85   7.364  -5.619  -5.619
  688    H    LYS  86           H        LYS  86   9.222  -8.829  -8.829
  689    HA   LYS  86           HA       LYS  86  12.078  -9.418  -9.418
  690   1HB   LYS  86          2HB       LYS  86  11.868 -10.631 -10.631
  691   2HB   LYS  86          1HB       LYS  86  11.471 -11.481 -11.481
  692   1HG   LYS  86          2HG       LYS  86   9.079 -10.913 -10.913
  693   2HG   LYS  86          1HG       LYS  86   9.497 -10.085 -10.085
  694   1HD   LYS  86          2HD       LYS  86  10.133 -13.000 -13.000
  695   2HD   LYS  86          1HD       LYS  86   8.673 -12.459 -12.459
  696   1HE   LYS  86          2HE       LYS  86  10.482 -11.073 -11.073
  697   2HE   LYS  86          1HE       LYS  86  11.504 -12.424 -12.424
  698   1HZ   LYS  86          1HZ       LYS  86   9.661 -13.902 -13.902
  699   2HZ   LYS  86          3HZ       LYS  86   8.954 -12.529 -12.529
  700   3HZ   LYS  86          2HZ       LYS  86  10.489 -13.048 -13.048
  701    H    TRP  87           H        TRP  87  13.553  -8.749  -8.749
  702    HA   TRP  87           HA       TRP  87  12.657  -6.139  -6.139
  703   1HB   TRP  87          2HB       TRP  87  15.277  -7.630  -7.630
  704   2HB   TRP  87          1HB       TRP  87  15.042  -6.138  -6.138
  705    HD1  TRP  87           HD1      TRP  87  15.836  -7.448  -7.448
  706    HE1  TRP  87           HE1      TRP  87  15.955  -5.544  -5.544
  707    HE3  TRP  87           HE3      TRP  87  13.760  -3.690  -3.690
  708    HZ2  TRP  87           HZ2      TRP  87  15.256  -2.777  -2.777
  709    HZ3  TRP  87           HZ3      TRP  87  13.475  -1.426  -1.426
  710    HH2  TRP  87           HH2      TRP  87  14.218  -0.975  -0.975
  711    H    GLU  88           H        GLU  88  13.224  -5.595  -5.595
  712    HA   GLU  88           HA       GLU  88  12.738  -7.856  -7.856
  713   1HB   GLU  88          2HB       GLU  88  10.696  -6.315  -6.315
  714   2HB   GLU  88          1HB       GLU  88  11.562  -5.115  -5.115
  715   1HG   GLU  88          2HG       GLU  88  10.144  -6.231  -6.231
  716   2HG   GLU  88          1HG       GLU  88  11.759  -6.883  -6.883
  717    H    SER  89           H        SER  89  13.693  -4.494  -4.494
  718    HA   SER  89           HA       SER  89  15.879  -4.863  -4.863
  719   1HB   SER  89          2HB       SER  89  15.440  -2.678  -2.678
  720   2HB   SER  89          1HB       SER  89  13.919  -3.565  -3.565
  721    HG   SER  89           HG       SER  89  14.464  -1.255  -1.255
  722    H    GLU  90           H        GLU  90  16.751  -2.078  -2.078
  723    HA   GLU  90           HA       GLU  90  18.164  -2.567  -2.567
  724   1HB   GLU  90          2HB       GLU  90  18.121   0.020   0.020
  725   2HB   GLU  90          1HB       GLU  90  19.376  -0.550  -0.550
  726   1HG   GLU  90          2HG       GLU  90  19.303  -2.626  -2.626
  727   2HG   GLU  90          1HG       GLU  90  18.844  -1.304  -1.304
  728    H    ASN  91           H        ASN  91  15.304  -0.785  -0.785
  729    HA   ASN  91           HA       ASN  91  14.941  -0.048  -0.048
  730   1HB   ASN  91          2HB       ASN  91  14.470   1.936   1.936
  731   2HB   ASN  91          1HB       ASN  91  14.386   2.233   2.233
  732   1HD2  ASN  91          2HD2      ASN  91  17.841   2.907   2.907
  733   2HD2  ASN  91          1HD2      ASN  91  16.316   2.949   2.949
  734    H    LYS  92           H        LYS  92  13.626  -2.010  -2.010
  735    HA   LYS  92           HA       LYS  92  10.856  -0.983  -0.983
  736   1HB   LYS  92          2HB       LYS  92  11.418  -0.740  -0.740
  737   2HB   LYS  92          1HB       LYS  92  11.897  -2.434  -2.434
  738   1HG   LYS  92          2HG       LYS  92   9.447  -2.831  -2.831
  739   2HG   LYS  92          1HG       LYS  92   9.158  -1.246  -1.246
  740   1HD   LYS  92          2HD       LYS  92  10.382  -2.277  -2.277
  741   2HD   LYS  92          1HD       LYS  92   9.922  -3.813  -3.813
  742   1HE   LYS  92          2HE       LYS  92   7.681  -3.475  -3.475
  743   2HE   LYS  92          1HE       LYS  92   7.805  -1.728  -1.728
  744   1HZ   LYS  92          3HZ       LYS  92   8.969  -1.660  -1.660
  745   2HZ   LYS  92          2HZ       LYS  92   8.626  -3.311  -3.311
  746   3HZ   LYS  92          1HZ       LYS  92   7.359  -2.183  -2.183
  747    H    MET  93           H        MET  93  10.127  -2.321  -2.321
  748    HA   MET  93           HA       MET  93  10.821  -5.227  -5.227
  749   1HB   MET  93          2HB       MET  93  10.079  -5.122  -5.122
  750   2HB   MET  93          1HB       MET  93  11.725  -4.759  -4.759
  751   1HG   MET  93          2HG       MET  93  11.449  -2.463  -2.463
  752   2HG   MET  93          1HG       MET  93   9.704  -2.553  -2.553
  753   1HE   MET  93          1HE       MET  93  12.417  -4.239  -4.239
  754   2HE   MET  93          3HE       MET  93  12.616  -3.143  -3.143
  755   3HE   MET  93          2HE       MET  93  11.836  -4.703  -4.703
  756    H    VAL  94           H        VAL  94   9.213  -6.761  -6.761
  757    HA   VAL  94           HA       VAL  94   6.433  -5.780  -5.780
  758    HB   VAL  94           HB       VAL  94   7.341  -8.646  -8.646
  759   1HG1  VAL  94          2HG1      VAL  94   5.052  -6.986  -6.986
  760   2HG1  VAL  94          1HG1      VAL  94   5.495  -8.447  -8.447
  761   3HG1  VAL  94          3HG1      VAL  94   5.024  -8.545  -8.545
  762   1HG2  VAL  94          1HG2      VAL  94   7.790  -6.408  -6.408
  763   2HG2  VAL  94          3HG2      VAL  94   8.849  -7.759  -7.759
  764   3HG2  VAL  94          2HG2      VAL  94   7.431  -8.023  -8.023
  765    H    CYS  95           H        CYS  95   4.739  -7.279  -7.279
  766    HA   CYS  95           HA       CYS  95   5.762  -8.293  -8.293
  767   1HB   CYS  95          2HB       CYS  95   5.276  -5.877  -5.877
  768   2HB   CYS  95          1HB       CYS  95   3.622  -6.152  -6.152
  769    HG   CYS  95           HG       CYS  95   4.601  -6.649  -6.649
  770    H    GLU  96           H        GLU  96   4.532  -9.883  -9.883
  771    HA   GLU  96           HA       GLU  96   2.011 -10.638 -10.638
  772   1HB   GLU  96          2HB       GLU  96   3.744 -12.369 -12.369
  773   2HB   GLU  96          1HB       GLU  96   2.398 -12.903 -12.903
  774   1HG   GLU  96          2HG       GLU  96   4.510 -11.452 -11.452
  775   2HG   GLU  96          1HG       GLU  96   5.035 -12.981 -12.981
  776    H    GLN  97           H        GLN  97   0.305 -11.568 -11.568
  777    HA   GLN  97           HA       GLN  97   0.614 -10.787 -10.787
  778   1HB   GLN  97          2HB       GLN  97  -0.023  -8.727  -8.727
  779   2HB   GLN  97          1HB       GLN  97  -1.636  -9.361  -9.361
  780   1HG   GLN  97          2HG       GLN  97  -0.897  -9.409  -9.409
  781   2HG   GLN  97          1HG       GLN  97   0.378  -8.310  -8.310
  782   1HE2  GLN  97          2HE2      GLN  97  -1.803  -5.545  -5.545
  783   2HE2  GLN  97          1HE2      GLN  97  -0.235  -6.150  -6.150
  784    H    LYS  98           H        LYS  98  -0.693 -12.015 -12.015
  785    HA   LYS  98           HA       LYS  98  -3.198 -13.111 -13.111
  786   1HB   LYS  98          2HB       LYS  98  -1.738 -14.915 -14.915
  787   2HB   LYS  98          1HB       LYS  98  -0.851 -14.677 -14.677
  788   1HG   LYS  98          2HG       LYS  98  -2.612 -15.625 -15.625
  789   2HG   LYS  98          1HG       LYS  98  -3.758 -15.518 -15.518
  790   1HD   LYS  98          2HD       LYS  98  -2.371 -17.159 -17.159
  791   2HD   LYS  98          1HD       LYS  98  -1.326 -17.323 -17.323
  792   1HE   LYS  98          2HE       LYS  98  -4.285 -17.968 -17.968
  793   2HE   LYS  98          1HE       LYS  98  -2.964 -19.127 -19.127
  794   1HZ   LYS  98          2HZ       LYS  98  -2.371 -17.731 -17.731
  795   2HZ   LYS  98          1HZ       LYS  98  -3.989 -17.217 -17.217
  796   3HZ   LYS  98          3HZ       LYS  98  -3.632 -18.865 -18.865
  797    H    LEU  99           H        LEU  99  -4.746 -13.695 -13.695
  798    HA   LEU  99           HA       LEU  99  -4.662 -11.919 -11.919
  799   1HB   LEU  99          2HB       LEU  99  -6.273 -14.417 -14.417
  800   2HB   LEU  99          1HB       LEU  99  -6.528 -13.383 -13.383
  801    HG   LEU  99           HG       LEU  99  -6.444 -12.034 -12.034
  802   1HD1  LEU  99          1HD1      LEU  99  -8.771 -13.735 -13.735
  803   2HD1  LEU  99          3HD1      LEU  99  -8.820 -12.612 -12.612
  804   3HD1  LEU  99          2HD1      LEU  99  -7.783 -14.038 -14.038
  805   1HD2  LEU  99          1HD2      LEU  99  -6.811 -10.835 -10.835
  806   2HD2  LEU  99          3HD2      LEU  99  -8.204 -10.689 -10.689
  807   3HD2  LEU  99          2HD2      LEU  99  -8.249 -11.815 -11.815
  808    H    LEU 100           H        LEU 100  -4.878 -12.704 -12.704
  809    HA   LEU 100           HA       LEU 100  -2.703 -14.625 -14.625
  810   1HB   LEU 100          2HB       LEU 100  -4.084 -12.474 -12.474
  811   2HB   LEU 100          1HB       LEU 100  -3.053 -13.688 -13.688
  812    HG   LEU 100           HG       LEU 100  -2.101 -12.044 -12.044
  813   1HD1  LEU 100          1HD1      LEU 100  -2.316 -11.324 -11.324
  814   2HD1  LEU 100          3HD1      LEU 100  -0.854 -10.845 -10.845
  815   3HD1  LEU 100          2HD1      LEU 100  -2.431 -10.290 -10.290
  816   1HD2  LEU 100          1HD2      LEU 100  -0.871 -14.118 -14.118
  817   2HD2  LEU 100          3HD2      LEU 100   0.104 -12.674 -12.674
  818   3HD2  LEU 100          2HD2      LEU 100  -0.659 -13.491 -13.491
  819    H    LYS 101           H        LYS 101  -6.083 -14.529 -14.529
  820    HA   LYS 101           HA       LYS 101  -6.339 -17.147 -17.147
  821   1HB   LYS 101          2HB       LYS 101  -8.167 -16.424 -16.424
  822   2HB   LYS 101          1HB       LYS 101  -6.605 -15.733 -15.733
  823   1HG   LYS 101          2HG       LYS 101  -7.269 -13.608 -13.608
  824   2HG   LYS 101          1HG       LYS 101  -8.163 -14.105 -14.105
  825   1HD   LYS 101          2HD       LYS 101  -9.980 -13.600 -13.600
  826   2HD   LYS 101          1HD       LYS 101  -9.712 -15.225 -15.225
  827   1HE   LYS 101          2HE       LYS 101  -9.881 -13.819 -13.819
  828   2HE   LYS 101          1HE       LYS 101  -8.158 -14.143 -14.143
  829   1HZ   LYS 101          2HZ       LYS 101  -8.125 -12.017 -12.017
  830   2HZ   LYS 101          1HZ       LYS 101  -9.655 -11.690 -11.690
  831   3HZ   LYS 101          3HZ       LYS 101  -8.309 -11.851 -11.851
  832    H    GLY 102           H        GLY 102  -8.452 -18.107 -18.107
  833   1HA   GLY 102          2HA       GLY 102 -10.211 -18.531 -18.531
  834   2HA   GLY 102          1HA       GLY 102 -10.504 -16.791 -16.791
  835    H    GLU 103           H        GLU 103 -10.977 -16.978 -16.978
  836    HA   GLU 103           HA       GLU 103  -8.763 -16.235 -16.235
  837   1HB   GLU 103          2HB       GLU 103  -8.258 -18.677 -18.677
  838   2HB   GLU 103          1HB       GLU 103  -9.813 -19.025 -19.025
  839   1HG   GLU 103          2HG       GLU 103  -9.165 -18.067 -18.067
  840   2HG   GLU 103          1HG       GLU 103  -7.814 -17.203 -17.203
  841    H    GLY 104           H        GLY 104  -9.519 -15.282 -15.282
  842   1HA   GLY 104          2HA       GLY 104 -12.071 -15.987 -15.987
  843   2HA   GLY 104          1HA       GLY 104 -12.116 -14.442 -14.442
  844    HA   PRO 105           HA       PRO 105 -10.231 -12.702 -12.702
  845   1HB   PRO 105          2HB       PRO 105  -9.326 -10.339 -10.339
  846   2HB   PRO 105          1HB       PRO 105 -11.036 -10.662 -10.662
  847   1HG   PRO 105          2HG       PRO 105  -9.639 -10.517 -10.517
  848   2HG   PRO 105          1HG       PRO 105 -11.363 -10.327 -10.327
  849   1HD   PRO 105          2HD       PRO 105 -10.067 -12.656 -12.656
  850   2HD   PRO 105          1HD       PRO 105 -11.767 -12.504 -12.504
  851    H    LYS 106           H        LYS 106  -8.018 -11.387 -11.387
  852    HA   LYS 106           HA       LYS 106  -5.772 -12.531 -12.531
  853   1HB   LYS 106          2HB       LYS 106  -6.143 -14.030 -14.030
  854   2HB   LYS 106          1HB       LYS 106  -6.081 -12.648 -12.648
  855   1HG   LYS 106          2HG       LYS 106  -3.786 -12.249 -12.249
  856   2HG   LYS 106          1HG       LYS 106  -3.809 -13.335 -13.335
  857   1HD   LYS 106          2HD       LYS 106  -3.607 -15.212 -15.212
  858   2HD   LYS 106          1HD       LYS 106  -4.601 -14.547 -14.547
  859   1HE   LYS 106          2HE       LYS 106  -2.188 -14.843 -14.843
  860   2HE   LYS 106          1HE       LYS 106  -2.761 -13.182 -13.182
  861   1HZ   LYS 106          3HZ       LYS 106  -1.344 -14.233 -14.233
  862   2HZ   LYS 106          2HZ       LYS 106  -0.579 -13.398 -13.398
  863   3HZ   LYS 106          1HZ       LYS 106  -1.752 -12.617 -12.617
  864    H    THR 107           H        THR 107  -4.007 -11.068 -11.068
  865    HA   THR 107           HA       THR 107  -4.341  -8.546  -8.546
  866    HB   THR 107           HB       THR 107  -2.999  -7.730  -7.730
  867    HG1  THR 107           HG1      THR 107  -3.533  -9.892  -9.892
  868   1HG2  THR 107          1HG2      THR 107  -4.911  -6.630  -6.630
  869   2HG2  THR 107          3HG2      THR 107  -5.998  -7.821  -7.821
  870   3HG2  THR 107          2HG2      THR 107  -5.122  -6.692  -6.692
  871    H    SER 108           H        SER 108  -2.524  -7.574  -7.574
  872    HA   SER 108           HA       SER 108   0.175  -8.425  -8.425
  873   1HB   SER 108          2HB       SER 108  -1.137  -9.328  -9.328
  874   2HB   SER 108          1HB       SER 108   0.598  -9.032  -9.032
  875    HG   SER 108           HG       SER 108   0.032 -11.212 -11.212
  876    H    TRP 109           H        TRP 109   1.571  -6.675  -6.675
  877    HA   TRP 109           HA       TRP 109   0.548  -4.741  -4.741
  878   1HB   TRP 109          2HB       TRP 109   1.082  -2.831  -2.831
  879   2HB   TRP 109          1HB       TRP 109  -0.325  -3.784  -3.784
  880    HD1  TRP 109           HD1      TRP 109  -0.223  -5.162  -5.162
  881    HE1  TRP 109           HE1      TRP 109   1.456  -5.248  -5.248
  882    HE3  TRP 109           HE3      TRP 109   3.703  -2.646  -2.646
  883    HZ2  TRP 109           HZ2      TRP 109   4.107  -4.368  -4.368
  884    HZ3  TRP 109           HZ3      TRP 109   5.787  -2.282  -2.282
  885    HH2  TRP 109           HH2      TRP 109   5.995  -3.137  -3.137
  886    H    THR 110           H        THR 110   2.251  -2.916  -2.916
  887    HA   THR 110           HA       THR 110   5.006  -3.998  -3.998
  888    HB   THR 110           HB       THR 110   5.580  -3.720  -3.720
  889    HG1  THR 110           HG1      THR 110   4.649  -2.268  -2.268
  890   1HG2  THR 110          3HG2      THR 110   3.728  -5.558  -5.558
  891   2HG2  THR 110          2HG2      THR 110   2.819  -4.673  -4.673
  892   3HG2  THR 110          1HG2      THR 110   4.366  -5.412  -5.412
  893    H    MET 111           H        MET 111   6.602  -2.229  -2.229
  894    HA   MET 111           HA       MET 111   5.675   0.542   0.542
  895   1HB   MET 111          2HB       MET 111   7.113   1.058   1.058
  896   2HB   MET 111          1HB       MET 111   5.787  -0.031  -0.031
  897   1HG   MET 111          2HG       MET 111   7.192  -1.885  -1.885
  898   2HG   MET 111          1HG       MET 111   8.439  -1.161  -1.161
  899   1HE   MET 111          2HE       MET 111   6.228  -0.124  -0.124
  900   2HE   MET 111          1HE       MET 111   7.007  -1.432  -1.432
  901   3HE   MET 111          3HE       MET 111   7.278   0.250   0.250
  902    H    GLU 112           H        GLU 112   7.164   1.918   1.918
  903    HA   GLU 112           HA       GLU 112   9.815   0.773   0.773
  904   1HB   GLU 112          2HB       GLU 112   8.226   0.497   0.497
  905   2HB   GLU 112          1HB       GLU 112   7.956   2.239   2.239
  906   1HG   GLU 112          2HG       GLU 112  10.148   2.711   2.711
  907   2HG   GLU 112          1HG       GLU 112  10.748   1.128   1.128
  908    H    LEU 113           H        LEU 113  11.441   2.363   2.363
  909    HA   LEU 113           HA       LEU 113  10.698   5.078   5.078
  910   1HB   LEU 113          2HB       LEU 113  12.514   3.272   3.272
  911   2HB   LEU 113          1HB       LEU 113  13.546   4.256   4.256
  912    HG   LEU 113           HG       LEU 113  13.377   5.041   5.041
  913   1HD1  LEU 113          3HD1      LEU 113  13.100   6.599   6.599
  914   2HD1  LEU 113          2HD1      LEU 113  12.359   7.435   7.435
  915   3HD1  LEU 113          1HD1      LEU 113  14.047   6.937   6.937
  916   1HD2  LEU 113          1HD2      LEU 113  10.611   4.694   4.694
  917   2HD2  LEU 113          3HD2      LEU 113  11.385   5.321   5.321
  918   3HD2  LEU 113          2HD2      LEU 113  10.862   6.428   6.428
  919    H    THR 114           H        THR 114  11.458   6.856   6.856
  920    HA   THR 114           HA       THR 114  12.328   6.096   6.096
  921    HB   THR 114           HB       THR 114  11.773   8.376   8.376
  922    HG1  THR 114           HG1      THR 114  11.765   9.893   9.893
  923   1HG2  THR 114          2HG2      THR 114   9.814   6.881   6.881
  924   2HG2  THR 114          1HG2      THR 114   9.358   8.422   8.422
  925   3HG2  THR 114          3HG2      THR 114   9.832   7.071   7.071
  926    H    ASN 115           H        ASN 115  14.097   7.320   7.320
  927    HA   ASN 115           HA       ASN 115  16.502   7.240   7.240
  928   1HB   ASN 115          2HB       ASN 115  15.723   8.385   8.385
  929   2HB   ASN 115          1HB       ASN 115  17.312   8.763   8.763
  930   1HD2  ASN 115          2HD2      ASN 115  17.189   5.434   5.434
  931   2HD2  ASN 115          1HD2      ASN 115  16.429   6.911   6.911
  932    H    ASP 116           H        ASP 116  14.102   9.741   9.741
  933    HA   ASP 116           HA       ASP 116  15.917  11.868  11.868
  934   1HB   ASP 116          2HB       ASP 116  13.978  12.315  12.315
  935   2HB   ASP 116          1HB       ASP 116  12.891  11.887  11.887
  936    H    GLY 117           H        GLY 117  13.590   9.620   9.620
  937   1HA   GLY 117          2HA       GLY 117  14.156   9.104   9.104
  938   2HA   GLY 117          1HA       GLY 117  14.041  10.842  10.842
  939    H    GLU 118           H        GLU 118  11.716  10.462  10.462
  940    HA   GLU 118           HA       GLU 118   9.530  10.764  10.764
  941   1HB   GLU 118          2HB       GLU 118   9.526   9.705   9.705
  942   2HB   GLU 118          1HB       GLU 118   8.112  10.299  10.299
  943   1HG   GLU 118          2HG       GLU 118   8.929  12.518  12.518
  944   2HG   GLU 118          1HG       GLU 118  10.572  12.011  12.011
  945    H    LEU 119           H        LEU 119   7.597   9.131   9.131
  946    HA   LEU 119           HA       LEU 119   8.540   6.313   6.313
  947   1HB   LEU 119          2HB       LEU 119   8.900   7.341   7.341
  948   2HB   LEU 119          1HB       LEU 119   7.169   7.638   7.638
  949    HG   LEU 119           HG       LEU 119   8.287   4.870   4.870
  950   1HD1  LEU 119          3HD1      LEU 119   7.999   6.444   6.444
  951   2HD1  LEU 119          2HD1      LEU 119   7.776   4.695   4.695
  952   3HD1  LEU 119          1HD1      LEU 119   9.313   5.383   5.383
  953   1HD2  LEU 119          1HD2      LEU 119   5.651   6.102   6.102
  954   2HD2  LEU 119          3HD2      LEU 119   5.993   4.730   4.730
  955   3HD2  LEU 119          2HD2      LEU 119   6.033   4.528   4.528
  956    H    ILE 120           H        ILE 120   7.096   5.421   5.421
  957    HA   ILE 120           HA       ILE 120   4.214   6.202   6.202
  958    HB   ILE 120           HB       ILE 120   5.065   6.439   6.439
  959   1HG1  ILE 120          2HG1      ILE 120   3.428   3.889   3.889
  960   2HG1  ILE 120          1HG1      ILE 120   2.751   5.506   5.506
  961   1HG2  ILE 120          1HG2      ILE 120   6.198   3.744   3.744
  962   2HG2  ILE 120          3HG2      ILE 120   5.696   4.062   4.062
  963   3HG2  ILE 120          2HG2      ILE 120   6.909   5.088   5.088
  964   1HD1  ILE 120          2HD1      ILE 120   4.063   5.920   5.920
  965   2HD1  ILE 120          1HD1      ILE 120   3.832   4.179   4.179
  966   3HD1  ILE 120          3HD1      ILE 120   2.435   5.241   5.241
  967    H    LEU 121           H        LEU 121   2.650   4.500   4.500
  968    HA   LEU 121           HA       LEU 121   3.874   1.870   1.870
  969   1HB   LEU 121          2HB       LEU 121   3.413   3.209   3.209
  970   2HB   LEU 121          1HB       LEU 121   1.740   3.406   3.406
  971    HG   LEU 121           HG       LEU 121   2.541   0.588   0.588
  972   1HD1  LEU 121          1HD1      LEU 121   3.881   1.842   1.842
  973   2HD1  LEU 121          3HD1      LEU 121   2.320   1.753   1.753
  974   3HD1  LEU 121          2HD1      LEU 121   3.124   0.275   0.275
  975   1HD2  LEU 121          1HD2      LEU 121   0.388   2.225   2.225
  976   2HD2  LEU 121          3HD2      LEU 121   0.217   1.280   1.280
  977   3HD2  LEU 121          2HD2      LEU 121   0.480   0.464   0.464
  978    H    THR 122           H        THR 122   2.566   0.081   0.081
  979    HA   THR 122           HA       THR 122   0.007   0.615   0.615
  980    HB   THR 122           HB       THR 122   1.080  -1.923  -1.923
  981    HG1  THR 122           HG1      THR 122   2.989  -1.188  -1.188
  982   1HG2  THR 122          2HG2      THR 122   0.495   0.715   0.715
  983   2HG2  THR 122          1HG2      THR 122   1.145  -0.647  -0.647
  984   3HG2  THR 122          3HG2      THR 122  -0.413  -0.793  -0.793
  985    H    MET 123           H        MET 123  -1.482  -1.342  -1.342
  986    HA   MET 123           HA       MET 123  -0.866  -2.997  -2.997
  987   1HB   MET 123          2HB       MET 123  -3.352  -1.273  -1.273
  988   2HB   MET 123          1HB       MET 123  -2.958  -2.380  -2.380
  989   1HG   MET 123          2HG       MET 123  -0.784  -1.014  -1.014
  990   2HG   MET 123          1HG       MET 123  -1.584   0.202   0.202
  991   1HE   MET 123          3HE       MET 123  -1.645  -2.068  -2.068
  992   2HE   MET 123          2HE       MET 123  -0.934  -0.665  -0.665
  993   3HE   MET 123          1HE       MET 123  -2.518  -1.246  -1.246
  994    H    THR 124           H        THR 124  -2.533  -4.691  -4.691
  995    HA   THR 124           HA       THR 124  -4.217  -5.253  -5.253
  996    HB   THR 124           HB       THR 124  -2.352  -7.371  -7.371
  997    HG1  THR 124           HG1      THR 124  -0.858  -6.334  -6.334
  998   1HG2  THR 124          2HG2      THR 124  -4.421  -8.063  -8.063
  999   2HG2  THR 124          1HG2      THR 124  -3.933  -7.090  -7.090
 1000   3HG2  THR 124          3HG2      THR 124  -2.971  -8.488  -8.488
 1001    H    ALA 125           H        ALA 125  -5.849  -6.791  -6.791
 1002    HA   ALA 125           HA       ALA 125  -6.065  -8.017  -8.017
 1003   1HB   ALA 125          1HB       ALA 125  -7.901  -5.727  -5.727
 1004   2HB   ALA 125          3HB       ALA 125  -8.153  -6.804  -6.804
 1005   3HB   ALA 125          2HB       ALA 125  -6.744  -5.745  -5.745
 1006    H    ASP 126           H        ASP 126  -6.505  -9.963  -9.963
 1007    HA   ASP 126           HA       ASP 126  -7.896 -11.632 -11.632
 1008   1HB   ASP 126          2HB       ASP 126  -9.738  -9.567  -9.567
 1009   2HB   ASP 126          1HB       ASP 126 -10.139 -10.107 -10.107
 1010    H    ASP 127           H        ASP 127  -9.010  -8.956  -8.956
 1011    HA   ASP 127           HA       ASP 127  -7.150  -9.795  -9.795
 1012   1HB   ASP 127          2HB       ASP 127  -9.562 -11.030 -11.030
 1013   2HB   ASP 127          1HB       ASP 127  -9.969  -9.576  -9.576
 1014    H    VAL 128           H        VAL 128  -7.811  -7.413  -7.413
 1015    HA   VAL 128           HA       VAL 128  -8.231  -5.451  -5.451
 1016    HB   VAL 128           HB       VAL 128  -9.148  -3.910  -3.910
 1017   1HG1  VAL 128          2HG1      VAL 128 -10.379  -6.677  -6.677
 1018   2HG1  VAL 128          1HG1      VAL 128 -11.193  -5.251  -5.251
 1019   3HG1  VAL 128          3HG1      VAL 128 -10.776  -5.331  -5.331
 1020   1HG2  VAL 128          2HG2      VAL 128  -7.834  -5.665  -5.665
 1021   2HG2  VAL 128          1HG2      VAL 128  -8.683  -4.163  -4.163
 1022   3HG2  VAL 128          3HG2      VAL 128  -9.553  -5.695  -5.695
 1023    H    VAL 129           H        VAL 129  -7.192  -3.232  -3.232
 1024    HA   VAL 129           HA       VAL 129  -4.782  -3.705  -3.705
 1025    HB   VAL 129           HB       VAL 129  -4.746  -3.535  -3.535
 1026   1HG1  VAL 129          3HG1      VAL 129  -2.818  -2.057  -2.057
 1027   2HG1  VAL 129          2HG1      VAL 129  -2.222  -2.825  -2.825
 1028   3HG1  VAL 129          1HG1      VAL 129  -3.473  -1.586  -1.586
 1029   1HG2  VAL 129          1HG2      VAL 129  -3.383  -5.028  -5.028
 1030   2HG2  VAL 129          3HG2      VAL 129  -4.105  -5.629  -5.629
 1031   3HG2  VAL 129          2HG2      VAL 129  -2.526  -4.844  -4.844
 1032    H    CYS 130           H        CYS 130  -4.731  -1.939  -1.939
 1033    HA   CYS 130           HA       CYS 130  -5.791   0.631   0.631
 1034   1HB   CYS 130          2HB       CYS 130  -6.501  -0.437  -0.437
 1035   2HB   CYS 130          1HB       CYS 130  -4.966   0.205   0.205
 1036    HG   CYS 130           HG       CYS 130  -6.322   2.435   2.435
 1037    H    THR 131           H        THR 131  -4.271   1.946   1.946
 1038    HA   THR 131           HA       THR 131  -1.503   1.860   1.860
 1039    HB   THR 131           HB       THR 131  -2.621   2.957   2.957
 1040    HG1  THR 131           HG1      THR 131  -2.521   0.841   0.841
 1041   1HG2  THR 131          1HG2      THR 131   0.008   3.243   3.243
 1042   2HG2  THR 131          3HG2      THR 131   0.067   2.776   2.776
 1043   3HG2  THR 131          2HG2      THR 131  -0.756   4.261   4.261
 1044    H    ARG 132           H        ARG 132  -0.837   3.554   3.554
 1045    HA   ARG 132           HA       ARG 132  -2.271   6.156   6.156
 1046   1HB   ARG 132          2HB       ARG 132  -1.231   4.857   4.857
 1047   2HB   ARG 132          1HB       ARG 132  -1.943   6.468   6.468
 1048   1HG   ARG 132          2HG       ARG 132  -3.924   5.118   5.118
 1049   2HG   ARG 132          1HG       ARG 132  -3.261   3.795   3.795
 1050   1HD   ARG 132          2HD       ARG 132  -3.282   5.756   5.756
 1051   2HD   ARG 132          1HD       ARG 132  -4.655   6.261   6.261
 1052    HE   ARG 132           HE       ARG 132  -4.980   3.500   3.500
 1053   1HH1  ARG 132          1HH2      ARG 132  -3.905   3.912   3.912
 1054   2HH1  ARG 132          2HH2      ARG 132  -5.274   4.464   4.464
 1055   1HH2  ARG 132          2HH1      ARG 132  -7.129   5.302   5.302
 1056   2HH2  ARG 132          1HH1      ARG 132  -7.099   5.250   5.250
 1057    H    VAL 133           H        VAL 133  -0.716   7.264   7.264
 1058    HA   VAL 133           HA       VAL 133   2.128   6.894   6.894
 1059    HB   VAL 133           HB       VAL 133   0.648   9.263   9.263
 1060   1HG1  VAL 133          2HG1      VAL 133   3.520   8.459   8.459
 1061   2HG1  VAL 133          1HG1      VAL 133   2.958   9.209   9.209
 1062   3HG1  VAL 133          3HG1      VAL 133   2.806  10.071  10.071
 1063   1HG2  VAL 133          2HG2      VAL 133   0.295   6.863   6.863
 1064   2HG2  VAL 133          1HG2      VAL 133   0.691   8.169   8.169
 1065   3HG2  VAL 133          3HG2      VAL 133   1.945   7.042   7.042
 1066    H    TYR 134           H        TYR 134   3.518   7.910   7.910
 1067    HA   TYR 134           HA       TYR 134   2.305  10.013  10.013
 1068   1HB   TYR 134          2HB       TYR 134   3.958   7.613   7.613
 1069   2HB   TYR 134          1HB       TYR 134   4.021   9.057   9.057
 1070    HD1  TYR 134           HD2      TYR 134   2.011   9.895   9.895
 1071    HD2  TYR 134           HD1      TYR 134   1.950   6.257   6.257
 1072    HE1  TYR 134           HE2      TYR 134  -0.131   9.260   9.260
 1073    HE2  TYR 134           HE1      TYR 134  -0.193   5.618   5.618
 1074    HH   TYR 134           HH       TYR 134  -1.429   7.254   7.254
 1075    H    VAL 135           H        VAL 135   3.410  11.864  11.864
 1076    HA   VAL 135           HA       VAL 135   6.251  11.806  11.806
 1077    HB   VAL 135           HB       VAL 135   4.080  13.355  13.355
 1078   1HG1  VAL 135          2HG1      VAL 135   6.028  15.106  15.106
 1079   2HG1  VAL 135          1HG1      VAL 135   4.793  15.684  15.684
 1080   3HG1  VAL 135          3HG1      VAL 135   4.321  14.889  14.889
 1081   1HG2  VAL 135          2HG2      VAL 135   7.067  13.421  13.421
 1082   2HG2  VAL 135          1HG2      VAL 135   5.837  12.829  12.829
 1083   3HG2  VAL 135          3HG2      VAL 135   6.039  14.563  14.563
 1084    H    ARG 136           H        ARG 136   7.805  12.630  12.630
 1085    HA   ARG 136           HA       ARG 136   7.310  12.606  12.606
 1086   1HB   ARG 136          2HB       ARG 136   9.494  13.395  13.395
 1087   2HB   ARG 136          1HB       ARG 136   9.357  14.512  14.512
 1088   1HG   ARG 136          2HG       ARG 136   9.721  12.876  12.876
 1089   2HG   ARG 136          1HG       ARG 136   9.129  11.585  11.585
 1090   1HD   ARG 136          2HD       ARG 136  11.792  13.018  13.018
 1091   2HD   ARG 136          1HD       ARG 136  11.515  11.310  11.310
 1092    HE   ARG 136           HE       ARG 136  10.379  11.698  11.698
 1093   1HH1  ARG 136          2HH1      ARG 136  13.181  10.512  10.512
 1094   2HH1  ARG 136          1HH1      ARG 136  14.202  11.105  11.105
 1095   1HH2  ARG 136          1HH2      ARG 136  11.797  13.248  13.248
 1096   2HH2  ARG 136          2HH2      ARG 136  13.416  12.656  12.656
 1097    H    GLU 137           HN       GLU 137   6.330  13.864  13.864
 1098    HA   GLU 137           HA       GLU 137   4.783  16.097  16.097
 1099   1HB   GLU 137          2HB       GLU 137   5.857  14.982  14.982
 1100   2HB   GLU 137          1HB       GLU 137   5.212  16.611  16.611
 1101   1HG   GLU 137          2HG       GLU 137   3.339  15.172  15.172
 1102   2HG   GLU 137          1HG       GLU 137   3.799  14.072  14.072

  Start of MODEL   13
    1   1H    PRO   1          1H        PRO   1 -16.360   7.580   7.580
    2   2H    PRO   1          2H        PRO   1 -15.990   6.690   6.690
    3    HA   PRO   1           HA       PRO   1 -16.632   4.805   4.805
    4   1HB   PRO   1          2HB       PRO   1 -19.210   5.446   5.446
    5   2HB   PRO   1          1HB       PRO   1 -18.842   4.543   4.543
    6   1HG   PRO   1          2HG       PRO   1 -19.879   7.208   7.208
    7   2HG   PRO   1          1HG       PRO   1 -19.535   6.290   6.290
    8   1HD   PRO   1          1HD       PRO   1 -18.081   8.513   8.513
    9   2HD   PRO   1          2HD       PRO   1 -17.718   7.564   7.564
   10    H    ASN   2           H        ASN   2 -15.125   6.569   6.569
   11    HA   ASN   2           HA       ASN   2 -15.730   5.450   5.450
   12   1HB   ASN   2          2HB       ASN   2 -16.230   8.339   8.339
   13   2HB   ASN   2          1HB       ASN   2 -15.622   7.906   7.906
   14   1HD2  ASN   2          2HD2      ASN   2 -19.502   7.252   7.252
   15   2HD2  ASN   2          1HD2      ASN   2 -18.463   8.087   8.087
   16    H    PHE   3           H        PHE   3 -13.781   4.925   4.925
   17    HA   PHE   3           HA       PHE   3 -11.367   6.373   6.373
   18   1HB   PHE   3          2HB       PHE   3 -11.737   3.766   3.766
   19   2HB   PHE   3          1HB       PHE   3 -10.179   4.446   4.446
   20    HD1  PHE   3           HD1      PHE   3 -13.452   3.715   3.715
   21    HD2  PHE   3           HD2      PHE   3  -9.162   3.547   3.547
   22    HE1  PHE   3           HE1      PHE   3 -13.575   2.607   2.607
   23    HE2  PHE   3           HE2      PHE   3  -9.294   2.433   2.433
   24    HZ   PHE   3           HZ       PHE   3 -11.500   1.956   1.956
   25    H    SER   4           H        SER   4 -13.493   6.307   6.307
   26    HA   SER   4           HA       SER   4 -11.651   6.587   6.587
   27   1HB   SER   4          2HB       SER   4 -13.556   7.204   7.204
   28   2HB   SER   4          1HB       SER   4 -14.107   5.997   5.997
   29    HG   SER   4           HG       SER   4 -14.572   8.758   8.758
   30    H    GLY   5           H        GLY   5 -10.282   8.213   8.213
   31   1HA   GLY   5          2HA       GLY   5 -10.853  10.863  10.863
   32   2HA   GLY   5          1HA       GLY   5 -10.570  10.812  10.812
   33    H    ASN   6           H        ASN   6  -8.694  12.260  12.260
   34    HA   ASN   6           HA       ASN   6  -6.408  10.614  10.614
   35   1HB   ASN   6          2HB       ASN   6  -6.960  13.578  13.578
   36   2HB   ASN   6          1HB       ASN   6  -5.293  13.004  13.004
   37   1HD2  ASN   6          2HD2      ASN   6  -5.941  11.458  11.458
   38   2HD2  ASN   6          1HD2      ASN   6  -5.361  10.935  10.935
   39    H    TRP   7           H        TRP   7  -4.300  11.102  11.102
   40    HA   TRP   7           HA       TRP   7  -4.898  11.669  11.669
   41   1HB   TRP   7          2HB       TRP   7  -3.909   9.007   9.007
   42   2HB   TRP   7          1HB       TRP   7  -3.895   9.470   9.470
   43    HD1  TRP   7           HD1      TRP   7  -6.127   8.147   8.147
   44    HE1  TRP   7           HE1      TRP   7  -8.562   7.982   7.982
   45    HE3  TRP   7           HE3      TRP   7  -5.651  10.766  10.766
   46    HZ2  TRP   7           HZ2      TRP   7 -10.095   8.895   8.895
   47    HZ3  TRP   7           HZ3      TRP   7  -7.605  11.146  11.146
   48    HH2  TRP   7           HH2      TRP   7  -9.806  10.204  10.204
   49    H    LYS   8           H        LYS   8  -3.332  12.910  12.910
   50    HA   LYS   8           HA       LYS   8  -0.559  12.540  12.540
   51   1HB   LYS   8          2HB       LYS   8  -2.015  15.016  15.016
   52   2HB   LYS   8          1HB       LYS   8  -0.255  14.947  14.947
   53   1HG   LYS   8          2HG       LYS   8  -0.697  14.065  14.065
   54   2HG   LYS   8          1HG       LYS   8  -2.274  14.826  14.826
   55   1HD   LYS   8          2HD       LYS   8  -1.279  16.975  16.975
   56   2HD   LYS   8          1HD       LYS   8   0.335  16.271  16.271
   57   1HE   LYS   8          2HE       LYS   8  -1.173  15.765  15.765
   58   2HE   LYS   8          1HE       LYS   8  -0.559  17.399  17.399
   59   1HZ   LYS   8          3HZ       LYS   8   1.637  16.427  16.427
   60   2HZ   LYS   8          2HZ       LYS   8   1.021  14.886  14.886
   61   3HZ   LYS   8          1HZ       LYS   8   1.086  16.087  16.087
   62    H    ILE   9           H        ILE   9   0.584  11.469  11.469
   63    HA   ILE   9           HA       ILE   9  -0.157  10.987  10.987
   64    HB   ILE   9           HB       ILE   9   1.468   9.640   9.640
   65   1HG1  ILE   9          2HG1      ILE   9   2.703  11.000  11.000
   66   2HG1  ILE   9          1HG1      ILE   9   1.579   9.642   9.642
   67   1HG2  ILE   9          1HG2      ILE   9   2.495  11.947  11.947
   68   2HG2  ILE   9          3HG2      ILE   9   3.645  11.641  11.641
   69   3HG2  ILE   9          2HG2      ILE   9   3.418  10.445  10.445
   70   1HD1  ILE   9          2HD1      ILE   9   3.294   8.419   8.419
   71   2HD1  ILE   9          1HD1      ILE   9   4.421   9.686   9.686
   72   3HD1  ILE   9          3HD1      ILE   9   3.709   8.626   8.626
   73    H    ILE  10           H        ILE  10   0.396  11.918  11.918
   74    HA   ILE  10           HA       ILE  10   1.771  14.567  14.567
   75    HB   ILE  10           HB       ILE  10   0.241  15.352  15.352
   76   1HG1  ILE  10          2HG1      ILE  10  -1.908  13.614  13.614
   77   2HG1  ILE  10          1HG1      ILE  10  -0.540  12.503  12.503
   78   1HG2  ILE  10          3HG2      ILE  10  -1.143  14.197  14.197
   79   2HG2  ILE  10          2HG2      ILE  10  -1.801  15.467  15.467
   80   3HG2  ILE  10          1HG2      ILE  10  -0.338  15.763  15.763
   81   1HD1  ILE  10          2HD1      ILE  10   0.318  14.251  14.251
   82   2HD1  ILE  10          1HD1      ILE  10  -1.423  14.401  14.401
   83   3HD1  ILE  10          3HD1      ILE  10  -0.645  12.826  12.826
   84    H    ARG  11           H        ARG  11   1.407  11.504  11.504
   85    HA   ARG  11           HA       ARG  11   3.729  12.227  12.227
   86   1HB   ARG  11          2HB       ARG  11   0.981  11.646  11.646
   87   2HB   ARG  11          1HB       ARG  11   2.280  10.825  10.825
   88   1HG   ARG  11          2HG       ARG  11   3.429  13.048  13.048
   89   2HG   ARG  11          1HG       ARG  11   1.998  13.809  13.809
   90   1HD   ARG  11          2HD       ARG  11   0.715  12.473  12.473
   91   2HD   ARG  11          1HD       ARG  11   2.295  12.396  12.396
   92    HE   ARG  11           HE       ARG  11   1.103  15.020  15.020
   93   1HH1  ARG  11          1HH1      ARG  11   3.453  14.809  14.809
   94   2HH1  ARG  11          2HH1      ARG  11   3.820  14.225  14.225
   95   1HH2  ARG  11          1HH2      ARG  11   0.066  15.193  15.193
   96   2HH2  ARG  11          2HH2      ARG  11   1.327  15.358  15.358
   97    H    SER  12           H        SER  12   4.445  10.180  10.180
   98    HA   SER  12           HA       SER  12   3.834   7.537   7.537
   99   1HB   SER  12          2HB       SER  12   4.352   7.875   7.875
  100   2HB   SER  12          1HB       SER  12   5.769   8.848   8.848
  101    HG   SER  12           HG       SER  12   6.887   7.081   7.081
  102    H    GLU  13           H        GLU  13   5.851   6.074   6.074
  103    HA   GLU  13           HA       GLU  13   8.063   7.436   7.436
  104   1HB   GLU  13          2HB       GLU  13   7.497   6.702   6.702
  105   2HB   GLU  13          1HB       GLU  13   6.223   7.732   7.732
  106   1HG   GLU  13          2HG       GLU  13   5.548   5.091   5.091
  107   2HG   GLU  13          1HG       GLU  13   6.054   4.989   4.989
  108    H    ASN  14           H        ASN  14   7.714   5.219   5.219
  109    HA   ASN  14           HA       ASN  14   9.621   3.374   3.374
  110   1HB   ASN  14          2HB       ASN  14   7.505   1.647   1.647
  111   2HB   ASN  14          1HB       ASN  14   8.278   1.663   1.663
  112   1HD2  ASN  14          2HD2      ASN  14   5.234   2.692   2.692
  113   2HD2  ASN  14          1HD2      ASN  14   6.581   1.678   1.678
  114    H    PHE  15           H        PHE  15   9.424   5.132   5.132
  115    HA   PHE  15           HA       PHE  15   8.957   3.629   3.629
  116   1HB   PHE  15          2HB       PHE  15   9.155   6.179   6.179
  117   2HB   PHE  15          1HB       PHE  15  10.892   5.929   5.929
  118    HD1  PHE  15           HD2      PHE  15  10.125   3.412   3.412
  119    HD2  PHE  15           HD1      PHE  15   9.809   7.685   7.685
  120    HE1  PHE  15           HE2      PHE  15  10.180   3.484   3.484
  121    HE2  PHE  15           HE1      PHE  15   9.853   7.752   7.752
  122    HZ   PHE  15           HZ       PHE  15  10.039   5.638   5.638
  123    H    GLU  16           H        GLU  16  12.091   4.676   4.676
  124    HA   GLU  16           HA       GLU  16  13.704   3.107   3.107
  125   1HB   GLU  16          2HB       GLU  16  14.069   4.470   4.470
  126   2HB   GLU  16          1HB       GLU  16  15.269   3.256   3.256
  127   1HG   GLU  16          2HG       GLU  16  14.457   5.268   5.268
  128   2HG   GLU  16          1HG       GLU  16  15.545   5.782   5.782
  129    H    GLU  17           H        GLU  17  12.004   2.191   2.191
  130    HA   GLU  17           HA       GLU  17  13.546  -0.229  -0.229
  131   1HB   GLU  17          2HB       GLU  17  11.896  -0.915  -0.915
  132   2HB   GLU  17          1HB       GLU  17  12.298   0.783   0.783
  133   1HG   GLU  17          2HG       GLU  17  10.201   1.470   1.470
  134   2HG   GLU  17          1HG       GLU  17  10.040   0.342   0.342
  135    H    LEU  18           H        LEU  18  10.760   0.572   0.572
  136    HA   LEU  18           HA       LEU  18  10.066  -2.210  -2.210
  137   1HB   LEU  18          2HB       LEU  18   8.704   0.190   0.190
  138   2HB   LEU  18          1HB       LEU  18   9.088  -0.195  -0.195
  139    HG   LEU  18           HG       LEU  18   8.144  -2.476  -2.476
  140   1HD1  LEU  18          3HD1      LEU  18   7.911  -1.416  -1.416
  141   2HD1  LEU  18          2HD1      LEU  18   6.548  -2.371  -2.371
  142   3HD1  LEU  18          1HD1      LEU  18   8.168  -3.069  -3.069
  143   1HD2  LEU  18          1HD2      LEU  18   6.621   0.055   0.055
  144   2HD2  LEU  18          3HD2      LEU  18   6.449  -1.290  -1.290
  145   3HD2  LEU  18          2HD2      LEU  18   5.712  -1.380  -1.380
  146    H    LEU  19           H        LEU  19  12.259   0.137   0.137
  147    HA   LEU  19           HA       LEU  19  12.457  -1.316  -1.316
  148   1HB   LEU  19          2HB       LEU  19  14.270   0.930   0.930
  149   2HB   LEU  19          1HB       LEU  19  13.937   0.417   0.417
  150    HG   LEU  19           HG       LEU  19  12.046   1.833   1.833
  151   1HD1  LEU  19          3HD1      LEU  19  13.826   2.706   2.706
  152   2HD1  LEU  19          2HD1      LEU  19  12.166   3.033   3.033
  153   3HD1  LEU  19          1HD1      LEU  19  12.765   3.657   3.657
  154   1HD2  LEU  19          3HD2      LEU  19  11.441   0.026   0.026
  155   2HD2  LEU  19          2HD2      LEU  19  10.347   0.752   0.752
  156   3HD2  LEU  19          1HD2      LEU  19  10.789   1.640   1.640
  157    H    LYS  20           H        LYS  20  13.882  -1.427  -1.427
  158    HA   LYS  20           HA       LYS  20  16.366  -2.721  -2.721
  159   1HB   LYS  20          2HB       LYS  20  15.429  -2.847  -2.847
  160   2HB   LYS  20          1HB       LYS  20  17.072  -2.778  -2.778
  161   1HG   LYS  20          2HG       LYS  20  15.902  -0.385  -0.385
  162   2HG   LYS  20          1HG       LYS  20  15.297  -0.613  -0.613
  163   1HD   LYS  20          2HD       LYS  20  18.217  -0.703  -0.703
  164   2HD   LYS  20          1HD       LYS  20  17.422   0.658   0.658
  165   1HE   LYS  20          2HE       LYS  20  16.709  -1.295  -1.295
  166   2HE   LYS  20          1HE       LYS  20  18.235  -1.965  -1.965
  167   1HZ   LYS  20          1HZ       LYS  20  19.142   0.369   0.369
  168   2HZ   LYS  20          3HZ       LYS  20  17.749   0.598   0.598
  169   3HZ   LYS  20          2HZ       LYS  20  18.848  -0.634  -0.634
  170    H    VAL  21           H        VAL  21  13.217  -3.516  -3.516
  171    HA   VAL  21           HA       VAL  21  13.756  -6.339  -6.339
  172    HB   VAL  21           HB       VAL  21  11.979  -5.053  -5.053
  173   1HG1  VAL  21          1HG1      VAL  21  11.270  -3.665  -3.665
  174   2HG1  VAL  21          3HG1      VAL  21  10.525  -5.076  -5.076
  175   3HG1  VAL  21          2HG1      VAL  21   9.917  -4.454  -4.454
  176   1HG2  VAL  21          3HG2      VAL  21  11.868  -7.530  -7.530
  177   2HG2  VAL  21          2HG2      VAL  21  10.265  -6.798  -6.798
  178   3HG2  VAL  21          1HG2      VAL  21  10.914  -7.311  -7.311
  179    H    LEU  22           H        LEU  22  12.281  -4.333  -4.333
  180    HA   LEU  22           HA       LEU  22  11.436  -6.425  -6.425
  181   1HB   LEU  22          2HB       LEU  22  11.781  -3.481  -3.481
  182   2HB   LEU  22          1HB       LEU  22  11.923  -4.250  -4.250
  183    HG   LEU  22           HG       LEU  22   9.715  -5.205  -5.205
  184   1HD1  LEU  22          3HD1      LEU  22   9.872  -5.679  -5.679
  185   2HD1  LEU  22          2HD1      LEU  22   9.533  -3.976  -3.976
  186   3HD1  LEU  22          1HD1      LEU  22   8.333  -4.989  -4.989
  187   1HD2  LEU  22          3HD2      LEU  22  10.097  -2.684  -2.684
  188   2HD2  LEU  22          2HD2      LEU  22   8.454  -3.212  -3.212
  189   3HD2  LEU  22          1HD2      LEU  22   9.422  -2.417  -2.417
  190    H    GLY  23           H        GLY  23  14.258  -4.305  -4.305
  191   1HA   GLY  23          2HA       GLY  23  15.598  -5.997  -5.997
  192   2HA   GLY  23          1HA       GLY  23  16.083  -4.362  -4.362
  193    H    VAL  24           H        VAL  24  18.239  -5.281  -5.281
  194    HA   VAL  24           HA       VAL  24  18.725  -6.329  -6.329
  195    HB   VAL  24           HB       VAL  24  20.051  -7.471  -7.471
  196   1HG1  VAL  24          2HG1      VAL  24  21.111  -7.382  -7.382
  197   2HG1  VAL  24          1HG1      VAL  24  20.047  -8.765  -8.765
  198   3HG1  VAL  24          3HG1      VAL  24  21.275  -8.816  -8.816
  199   1HG2  VAL  24          1HG2      VAL  24  17.846  -8.582  -8.582
  200   2HG2  VAL  24          3HG2      VAL  24  17.716  -8.168  -8.168
  201   3HG2  VAL  24          2HG2      VAL  24  18.725  -9.523  -9.523
  202    H    ASN  25           H        ASN  25  20.163  -5.048  -5.048
  203    HA   ASN  25           HA       ASN  25  22.669  -4.225  -4.225
  204   1HB   ASN  25          2HB       ASN  25  21.607  -4.194  -4.194
  205   2HB   ASN  25          1HB       ASN  25  21.295  -2.520  -2.520
  206   1HD2  ASN  25          2HD2      ASN  25  24.618  -1.534  -1.534
  207   2HD2  ASN  25          1HD2      ASN  25  23.004  -1.078  -1.078
  208    H    VAL  26           H        VAL  26  23.010  -1.546  -1.546
  209    HA   VAL  26           HA       VAL  26  21.105  -0.475  -0.475
  210    HB   VAL  26           HB       VAL  26  23.080   1.171   1.171
  211   1HG1  VAL  26          1HG1      VAL  26  23.007  -1.740  -1.740
  212   2HG1  VAL  26          3HG1      VAL  26  24.160  -0.606  -0.606
  213   3HG1  VAL  26          2HG1      VAL  26  22.428  -0.346  -0.346
  214   1HG2  VAL  26          2HG2      VAL  26  24.450   0.480   0.480
  215   2HG2  VAL  26          1HG2      VAL  26  25.304   0.193   0.193
  216   3HG2  VAL  26          3HG2      VAL  26  24.554  -1.152  -1.152
  217    H    MET  27           H        MET  27  23.016   0.425   0.425
  218    HA   MET  27           HA       MET  27  21.898   3.074   3.074
  219   1HB   MET  27          2HB       MET  27  23.973   1.899   1.899
  220   2HB   MET  27          1HB       MET  27  22.758   1.546   1.546
  221   1HG   MET  27          2HG       MET  27  22.333   3.826   3.826
  222   2HG   MET  27          1HG       MET  27  23.049   4.329   4.329
  223   1HE   MET  27          3HE       MET  27  23.327   2.580   2.580
  224   2HE   MET  27          2HE       MET  27  24.546   3.480   3.480
  225   3HE   MET  27          1HE       MET  27  25.003   2.014   2.014
  226    H    LEU  28           H        LEU  28  20.869  -0.120  -0.120
  227    HA   LEU  28           HA       LEU  28  18.919   0.491   0.491
  228   1HB   LEU  28          2HB       LEU  28  19.551  -1.727  -1.727
  229   2HB   LEU  28          1HB       LEU  28  17.874  -1.667  -1.667
  230    HG   LEU  28           HG       LEU  28  19.221  -3.056  -3.056
  231   1HD1  LEU  28          3HD1      LEU  28  17.360  -1.350  -1.350
  232   2HD1  LEU  28          2HD1      LEU  28  18.719  -0.543  -0.543
  233   3HD1  LEU  28          1HD1      LEU  28  18.327  -2.212  -2.212
  234   1HD2  LEU  28          2HD2      LEU  28  21.371  -1.829  -1.829
  235   2HD2  LEU  28          1HD2      LEU  28  21.065  -2.117  -2.117
  236   3HD2  LEU  28          3HD2      LEU  28  20.780  -0.519  -0.519
  237    H    ARG  29           H        ARG  29  18.868   0.960   0.960
  238    HA   ARG  29           HA       ARG  29  15.947   1.224   1.224
  239   1HB   ARG  29          2HB       ARG  29  18.012   1.882   1.882
  240   2HB   ARG  29          1HB       ARG  29  16.280   1.663   1.663
  241   1HG   ARG  29          2HG       ARG  29  16.397  -0.635  -0.635
  242   2HG   ARG  29          1HG       ARG  29  17.801  -0.573  -0.573
  243   1HD   ARG  29          2HD       ARG  29  19.207   0.118   0.118
  244   2HD   ARG  29          1HD       ARG  29  17.800  -0.006  -0.006
  245    HE   ARG  29           HE       ARG  29  18.103  -2.486  -2.486
  246   1HH1  ARG  29          1HH2      ARG  29  20.478  -0.694  -0.694
  247   2HH1  ARG  29          2HH2      ARG  29  20.871  -1.935  -1.935
  248   1HH2  ARG  29          2HH1      ARG  29  18.276  -4.021  -4.021
  249   2HH2  ARG  29          1HH1      ARG  29  19.627  -3.815  -3.815
  250    H    LYS  30           H        LYS  30  18.783   3.354   3.354
  251    HA   LYS  30           HA       LYS  30  17.342   5.761   5.761
  252   1HB   LYS  30          2HB       LYS  30  19.824   5.409   5.409
  253   2HB   LYS  30          1HB       LYS  30  20.012   5.529   5.529
  254   1HG   LYS  30          2HG       LYS  30  19.134   7.776   7.776
  255   2HG   LYS  30          1HG       LYS  30  18.675   7.661   7.661
  256   1HD   LYS  30          2HD       LYS  30  21.057   7.410   7.410
  257   2HD   LYS  30          1HD       LYS  30  21.508   7.558   7.558
  258   1HE   LYS  30          2HE       LYS  30  21.726   9.769   9.769
  259   2HE   LYS  30          1HE       LYS  30  19.991   9.778   9.778
  260   1HZ   LYS  30          1HZ       LYS  30  21.208   9.280   9.280
  261   2HZ   LYS  30          3HZ       LYS  30  20.604  10.781  10.781
  262   3HZ   LYS  30          2HZ       LYS  30  19.554   9.455   9.455
  263    H    ILE  31           H        ILE  31  17.919   3.950   3.950
  264    HA   ILE  31           HA       ILE  31  17.368   6.201   6.201
  265    HB   ILE  31           HB       ILE  31  17.287   3.217   3.217
  266   1HG1  ILE  31          2HG1      ILE  31  19.501   5.090   5.090
  267   2HG1  ILE  31          1HG1      ILE  31  19.483   4.414   4.414
  268   1HG2  ILE  31          1HG2      ILE  31  17.098   5.698   5.698
  269   2HG2  ILE  31          3HG2      ILE  31  17.810   4.233   4.233
  270   3HG2  ILE  31          2HG2      ILE  31  16.145   4.217   4.217
  271   1HD1  ILE  31          2HD1      ILE  31  19.170   2.127   2.127
  272   2HD1  ILE  31          1HD1      ILE  31  19.632   2.937   2.937
  273   3HD1  ILE  31          3HD1      ILE  31  20.762   2.873   2.873
  274    H    ALA  32           H        ALA  32  15.508   3.736   3.736
  275    HA   ALA  32           HA       ALA  32  13.067   4.246   4.246
  276   1HB   ALA  32          3HB       ALA  32  13.752   2.580   2.580
  277   2HB   ALA  32          2HB       ALA  32  12.076   2.824   2.824
  278   3HB   ALA  32          1HB       ALA  32  13.211   2.037   2.037
  279    H    VAL  33           H        VAL  33  14.601   5.413   5.413
  280    HA   VAL  33           HA       VAL  33  12.239   6.675   6.675
  281    HB   VAL  33           HB       VAL  33  15.123   7.403   7.403
  282   1HG1  VAL  33          1HG1      VAL  33  12.528   7.539   7.539
  283   2HG1  VAL  33          3HG1      VAL  33  14.107   7.785   7.785
  284   3HG1  VAL  33          2HG1      VAL  33  13.545   8.884   8.884
  285   1HG2  VAL  33          3HG2      VAL  33  14.223   4.822   4.822
  286   2HG2  VAL  33          2HG2      VAL  33  15.478   5.488   5.488
  287   3HG2  VAL  33          1HG2      VAL  33  13.811   5.420   5.420
  288    H    ALA  34           H        ALA  34  14.952   7.597   7.597
  289    HA   ALA  34           HA       ALA  34  14.196  10.403  10.403
  290   1HB   ALA  34          1HB       ALA  34  16.225   8.654   8.654
  291   2HB   ALA  34          3HB       ALA  34  15.845  10.226  10.226
  292   3HB   ALA  34          2HB       ALA  34  16.479  10.124  10.124
  293    H    ALA  35           H        ALA  35  13.663   7.485   7.485
  294    HA   ALA  35           HA       ALA  35  12.539   8.682   8.682
  295   1HB   ALA  35          1HB       ALA  35  12.240   5.959   5.959
  296   2HB   ALA  35          3HB       ALA  35  11.434   6.380   6.380
  297   3HB   ALA  35          2HB       ALA  35  13.195   6.386   6.386
  298    H    ALA  36           H        ALA  36  11.141   7.589   7.589
  299    HA   ALA  36           HA       ALA  36   8.407   7.983   7.983
  300   1HB   ALA  36          3HB       ALA  36   9.968   7.498   7.498
  301   2HB   ALA  36          2HB       ALA  36   8.545   8.497   8.497
  302   3HB   ALA  36          1HB       ALA  36   8.369   6.900   6.900
  303    H    SER  37           H        SER  37  10.344  10.039  10.039
  304    HA   SER  37           HA       SER  37  10.179  12.346  12.346
  305   1HB   SER  37          2HB       SER  37   9.728  12.333  12.333
  306   2HB   SER  37          1HB       SER  37  10.054  13.781  13.781
  307    HG   SER  37           HG       SER  37  11.905  12.651  12.651
  308    H    LYS  38           H        LYS  38   7.933  11.142  11.142
  309    HA   LYS  38           HA       LYS  38   5.677  11.544  11.544
  310   1HB   LYS  38          2HB       LYS  38   5.910  14.092  14.092
  311   2HB   LYS  38          1HB       LYS  38   4.760  13.740  13.740
  312   1HG   LYS  38          2HG       LYS  38   6.908  13.428  13.428
  313   2HG   LYS  38          1HG       LYS  38   7.688  14.384  14.384
  314   1HD   LYS  38          2HD       LYS  38   6.386  16.272  16.272
  315   2HD   LYS  38          1HD       LYS  38   5.093  15.330  15.330
  316   1HE   LYS  38          2HE       LYS  38   6.604  14.813  14.813
  317   2HE   LYS  38          1HE       LYS  38   7.841  15.836  15.836
  318   1HZ   LYS  38          1HZ       LYS  38   6.236  17.685  17.685
  319   2HZ   LYS  38          3HZ       LYS  38   5.147  16.687  16.687
  320   3HZ   LYS  38          2HZ       LYS  38   6.636  17.095  17.095
  321    HA   PRO  39           HA       PRO  39   4.917  10.016  10.016
  322   1HB   PRO  39          2HB       PRO  39   4.025   7.527   7.527
  323   2HB   PRO  39          1HB       PRO  39   5.707   7.908   7.908
  324   1HG   PRO  39          2HG       PRO  39   4.451   7.488   7.488
  325   2HG   PRO  39          1HG       PRO  39   6.129   7.228   7.228
  326   1HD   PRO  39          2HD       PRO  39   5.207   9.431   9.431
  327   2HD   PRO  39          1HD       PRO  39   6.752   9.348   9.348
  328    H    ALA  40           H        ALA  40   2.899  10.047  10.047
  329    HA   ALA  40           HA       ALA  40   0.596  10.689  10.689
  330   1HB   ALA  40          2HB       ALA  40   1.283  11.177  11.177
  331   2HB   ALA  40          1HB       ALA  40  -0.413  11.164  11.164
  332   3HB   ALA  40          3HB       ALA  40   0.703  12.314  12.314
  333    H    VAL  41           H        VAL  41  -1.570   9.864   9.864
  334    HA   VAL  41           HA       VAL  41  -1.406   7.190   7.190
  335    HB   VAL  41           HB       VAL  41  -2.352   7.701   7.701
  336   1HG1  VAL  41          2HG1      VAL  41  -2.808   5.272   5.272
  337   2HG1  VAL  41          1HG1      VAL  41  -3.064   5.300   5.300
  338   3HG1  VAL  41          3HG1      VAL  41  -4.047   6.318   6.318
  339   1HG2  VAL  41          2HG2      VAL  41  -0.304   5.868   5.868
  340   2HG2  VAL  41          1HG2      VAL  41  -0.003   7.202   7.202
  341   3HG2  VAL  41          3HG2      VAL  41  -0.819   5.745   5.745
  342    H    GLU  42           H        GLU  42  -3.633   6.384   6.384
  343    HA   GLU  42           HA       GLU  42  -5.793   8.404   8.404
  344   1HB   GLU  42          2HB       GLU  42  -4.685   8.968   8.968
  345   2HB   GLU  42          1HB       GLU  42  -4.801   7.293   7.293
  346   1HG   GLU  42          2HG       GLU  42  -7.312   7.494   7.494
  347   2HG   GLU  42          1HG       GLU  42  -7.087   9.216   9.216
  348    H    ILE  43           H        ILE  43  -7.339   7.200   7.200
  349    HA   ILE  43           HA       ILE  43  -7.535   4.315   4.315
  350    HB   ILE  43           HB       ILE  43  -8.625   5.991   5.991
  351   1HG1  ILE  43          2HG1      ILE  43  -7.052   3.611   3.611
  352   2HG1  ILE  43          1HG1      ILE  43  -6.164   4.700   4.700
  353   1HG2  ILE  43          2HG2      ILE  43  -9.389   3.263   3.263
  354   2HG2  ILE  43          1HG2      ILE  43  -9.133   3.476   3.476
  355   3HG2  ILE  43          3HG2      ILE  43 -10.332   4.458   4.458
  356   1HD1  ILE  43          3HD1      ILE  43  -7.550   6.161   6.161
  357   2HD1  ILE  43          2HD1      ILE  43  -6.442   4.958   4.958
  358   3HD1  ILE  43          1HD1      ILE  43  -5.846   6.191   6.191
  359    H    LYS  44           H        LYS  44  -9.344   3.415   3.415
  360    HA   LYS  44           HA       LYS  44 -11.569   5.263   5.263
  361   1HB   LYS  44          2HB       LYS  44 -11.290   2.813   2.813
  362   2HB   LYS  44          1HB       LYS  44 -11.567   4.471   4.471
  363   1HG   LYS  44          2HG       LYS  44  -9.190   4.974   4.974
  364   2HG   LYS  44          1HG       LYS  44  -8.864   3.408   3.408
  365   1HD   LYS  44          2HD       LYS  44  -9.194   2.250   2.250
  366   2HD   LYS  44          1HD       LYS  44 -10.233   3.506   3.506
  367   1HE   LYS  44          2HE       LYS  44  -7.933   4.912   4.912
  368   2HE   LYS  44          1HE       LYS  44  -7.273   3.301   3.301
  369   1HZ   LYS  44          3HZ       LYS  44  -8.941   3.223   3.223
  370   2HZ   LYS  44          2HZ       LYS  44  -9.015   4.912   4.912
  371   3HZ   LYS  44          1HZ       LYS  44  -7.539   4.156   4.156
  372    H    GLN  45           H        GLN  45 -13.371   4.707   4.707
  373    HA   GLN  45           HA       GLN  45 -13.536   1.923   1.923
  374   1HB   GLN  45          2HB       GLN  45 -13.775   3.744   3.744
  375   2HB   GLN  45          1HB       GLN  45 -15.162   4.372   4.372
  376   1HG   GLN  45          2HG       GLN  45 -16.435   2.359   2.359
  377   2HG   GLN  45          1HG       GLN  45 -15.031   1.562   1.562
  378   1HE2  GLN  45          2HE2      GLN  45 -16.353   2.618   2.618
  379   2HE2  GLN  45          1HE2      GLN  45 -16.055   1.296   1.296
  380    H    GLU  46           H        GLU  46 -14.707   0.506   0.506
  381    HA   GLU  46           HA       GLU  46 -17.162   1.495   1.495
  382   1HB   GLU  46          2HB       GLU  46 -15.201  -0.685  -0.685
  383   2HB   GLU  46          1HB       GLU  46 -16.806  -0.559  -0.559
  384   1HG   GLU  46          2HG       GLU  46 -16.325   1.632   1.632
  385   2HG   GLU  46          1HG       GLU  46 -14.813   1.720   1.720
  386    H    GLY  47           H        GLY  47 -17.456   0.928   0.928
  387   1HA   GLY  47          2HA       GLY  47 -19.090  -0.327  -0.327
  388   2HA   GLY  47          1HA       GLY  47 -19.039  -1.575  -1.575
  389    H    ASP  48           H        ASP  48 -18.221  -3.435  -3.435
  390    HA   ASP  48           HA       ASP  48 -16.397  -3.406  -3.406
  391   1HB   ASP  48          2HB       ASP  48 -16.250  -5.911  -5.911
  392   2HB   ASP  48          1HB       ASP  48 -17.823  -5.306  -5.306
  393    H    THR  49           H        THR  49 -15.851  -2.764  -2.764
  394    HA   THR  49           HA       THR  49 -13.273  -4.196  -4.196
  395    HB   THR  49           HB       THR  49 -14.953  -2.690  -2.690
  396    HG1  THR  49           HG1      THR  49 -15.097  -4.650  -4.650
  397   1HG2  THR  49          2HG2      THR  49 -12.033  -3.129  -3.129
  398   2HG2  THR  49          1HG2      THR  49 -12.886  -3.657  -3.657
  399   3HG2  THR  49          3HG2      THR  49 -13.016  -1.983  -1.983
  400    H    PHE  50           H        PHE  50 -11.326  -3.090  -3.090
  401    HA   PHE  50           HA       PHE  50 -11.444  -0.131  -0.131
  402   1HB   PHE  50          2HB       PHE  50 -10.062  -2.013  -2.013
  403   2HB   PHE  50          1HB       PHE  50  -9.836  -0.259  -0.259
  404    HD1  PHE  50           HD2      PHE  50 -11.836   1.249   1.249
  405    HD2  PHE  50           HD1      PHE  50 -12.010  -2.988  -2.988
  406    HE1  PHE  50           HE2      PHE  50 -13.951   1.523   1.523
  407    HE2  PHE  50           HE1      PHE  50 -14.120  -2.718  -2.718
  408    HZ   PHE  50           HZ       PHE  50 -15.103  -0.468  -0.468
  409    H    TYR  51           H        TYR  51 -10.165   0.633   0.633
  410    HA   TYR  51           HA       TYR  51  -7.814  -0.927  -0.927
  411   1HB   TYR  51          2HB       TYR  51  -9.542  -0.206  -0.206
  412   2HB   TYR  51          1HB       TYR  51  -9.237   1.468   1.468
  413    HD1  TYR  51           HD1      TYR  51  -6.756   2.249   2.249
  414    HD2  TYR  51           HD2      TYR  51  -8.323  -1.173  -1.173
  415    HE1  TYR  51           HE1      TYR  51  -4.912   2.374   2.374
  416    HE2  TYR  51           HE2      TYR  51  -6.469  -1.045  -1.045
  417    HH   TYR  51           HH       TYR  51  -4.581   1.611   1.611
  418    H    ILE  52           H        ILE  52  -5.719   0.157   0.157
  419    HA   ILE  52           HA       ILE  52  -5.631   2.834   2.834
  420    HB   ILE  52           HB       ILE  52  -3.781   0.788   0.788
  421   1HG1  ILE  52          2HG1      ILE  52  -6.720   1.035   1.035
  422   2HG1  ILE  52          1HG1      ILE  52  -5.917  -0.399  -0.399
  423   1HG2  ILE  52          3HG2      ILE  52  -4.133   3.422   3.422
  424   2HG2  ILE  52          2HG2      ILE  52  -5.293   2.793   2.793
  425   3HG2  ILE  52          1HG2      ILE  52  -3.597   2.321   2.321
  426   1HD1  ILE  52          3HD1      ILE  52  -4.408   0.288   0.288
  427   2HD1  ILE  52          2HD1      ILE  52  -6.076   0.572   0.572
  428   3HD1  ILE  52          1HD1      ILE  52  -5.593  -1.015  -1.015
  429    H    LYS  53           H        LYS  53  -4.483   3.928   3.928
  430    HA   LYS  53           HA       LYS  53  -2.019   2.664   2.664
  431   1HB   LYS  53          2HB       LYS  53  -3.523   3.539   3.539
  432   2HB   LYS  53          1HB       LYS  53  -3.611   5.095   5.095
  433   1HG   LYS  53          2HG       LYS  53  -1.383   5.640   5.640
  434   2HG   LYS  53          1HG       LYS  53  -0.975   3.965   3.965
  435   1HD   LYS  53          2HD       LYS  53  -1.247   5.118   5.118
  436   2HD   LYS  53          1HD       LYS  53  -2.645   4.064   4.064
  437   1HE   LYS  53          2HE       LYS  53  -4.067   5.861   5.861
  438   2HE   LYS  53          1HE       LYS  53  -2.713   6.933   6.933
  439   1HZ   LYS  53          1HZ       LYS  53  -2.120   6.638   6.638
  440   2HZ   LYS  53          3HZ       LYS  53  -3.689   6.023   6.023
  441   3HZ   LYS  53          2HZ       LYS  53  -3.464   7.613   7.613
  442    H    THR  54           H        THR  54  -0.205   3.205   3.205
  443    HA   THR  54           HA       THR  54  -0.104   5.861   5.861
  444    HB   THR  54           HB       THR  54   1.719   3.457   3.457
  445    HG1  THR  54           HG1      THR  54   0.214   2.742   2.742
  446   1HG2  THR  54          2HG2      THR  54   2.067   6.151   6.151
  447   2HG2  THR  54          1HG2      THR  54   1.564   5.341   5.341
  448   3HG2  THR  54          3HG2      THR  54   2.980   4.770   4.770
  449    H    SER  55           H        SER  55   1.419   7.370   7.370
  450    HA   SER  55           HA       SER  55   3.318   6.446   6.446
  451   1HB   SER  55          2HB       SER  55   2.879   8.969   8.969
  452   2HB   SER  55          1HB       SER  55   1.883   7.625   7.625
  453    HG   SER  55           HG       SER  55   1.357   9.329   9.329
  454    H    THR  56           H        THR  56   5.347   7.369   7.369
  455    HA   THR  56           HA       THR  56   5.949   9.092   9.092
  456    HB   THR  56           HB       THR  56   8.371   8.145   8.145
  457    HG1  THR  56           HG1      THR  56   8.312   6.490   6.490
  458   1HG2  THR  56          1HG2      THR  56   7.034   7.798   7.798
  459   2HG2  THR  56          3HG2      THR  56   6.299   6.393   6.393
  460   3HG2  THR  56          2HG2      THR  56   8.036   6.421   6.421
  461    H    THR  57           H        THR  57   7.774   8.418   8.418
  462    HA   THR  57           HA       THR  57   7.409  11.101  11.101
  463    HB   THR  57           HB       THR  57   9.844  11.628  11.628
  464    HG1  THR  57           HG1      THR  57  11.088  10.341  10.341
  465   1HG2  THR  57          2HG2      THR  57   8.242  12.402  12.402
  466   2HG2  THR  57          1HG2      THR  57   8.864  11.083  11.083
  467   3HG2  THR  57          3HG2      THR  57   9.945  12.370  12.370
  468    H    VAL  58           H        VAL  58   9.379   8.158   8.158
  469    HA   VAL  58           HA       VAL  58   9.176   8.013   8.013
  470    HB   VAL  58           HB       VAL  58  11.258   6.733   6.733
  471   1HG1  VAL  58          3HG1      VAL  58  10.810   6.936   6.936
  472   2HG1  VAL  58          2HG1      VAL  58  12.424   6.656   6.656
  473   3HG1  VAL  58          1HG1      VAL  58  11.132   5.497   5.497
  474   1HG2  VAL  58          3HG2      VAL  58  11.397   9.224   9.224
  475   2HG2  VAL  58          2HG2      VAL  58  12.782   8.483   8.483
  476   3HG2  VAL  58          1HG2      VAL  58  11.491   9.204   9.204
  477    H    ARG  59           H        ARG  59   8.131   6.609   6.609
  478    HA   ARG  59           HA       ARG  59   7.579   4.023   4.023
  479   1HB   ARG  59          2HB       ARG  59   9.018   3.846   3.846
  480   2HB   ARG  59          1HB       ARG  59   7.707   4.554   4.554
  481   1HG   ARG  59          2HG       ARG  59   6.311   2.697   2.697
  482   2HG   ARG  59          1HG       ARG  59   7.177   2.149   2.149
  483   1HD   ARG  59          2HD       ARG  59   8.781   2.274   2.274
  484   2HD   ARG  59          1HD       ARG  59   7.523   1.039   1.039
  485    HE   ARG  59           HE       ARG  59   9.817   1.206   1.206
  486   1HH1  ARG  59          2HH1      ARG  59   7.239   0.002   0.002
  487   2HH1  ARG  59          1HH1      ARG  59   7.498  -1.682  -1.682
  488   1HH2  ARG  59          1HH2      ARG  59  10.092  -1.142  -1.142
  489   2HH2  ARG  59          2HH2      ARG  59   9.113  -2.330  -2.330
  490    H    THR  60           H        THR  60   5.478   3.018   3.018
  491    HA   THR  60           HA       THR  60   3.433   4.703   4.703
  492    HB   THR  60           HB       THR  60   3.118   3.984   3.984
  493    HG1  THR  60           HG1      THR  60   4.094   5.767   5.767
  494   1HG2  THR  60          2HG2      THR  60   1.240   4.647   4.647
  495   2HG2  THR  60          1HG2      THR  60   1.639   6.231   6.231
  496   3HG2  THR  60          3HG2      THR  60   1.058   4.950   4.950
  497    H    THR  61           H        THR  61   3.056   2.878   2.878
  498    HA   THR  61           HA       THR  61   2.580   0.240   0.240
  499    HB   THR  61           HB       THR  61   1.854  -0.302  -0.302
  500    HG1  THR  61           HG1      THR  61   1.471   1.398   1.398
  501   1HG2  THR  61          2HG2      THR  61   4.568   0.817   0.817
  502   2HG2  THR  61          1HG2      THR  61   4.246   0.072   0.072
  503   3HG2  THR  61          3HG2      THR  61   4.071  -0.873  -0.873
  504    H    GLU  62           H        GLU  62   0.507  -0.932  -0.932
  505    HA   GLU  62           HA       GLU  62  -1.928   0.690   0.690
  506   1HB   GLU  62          2HB       GLU  62  -1.047  -0.433  -0.433
  507   2HB   GLU  62          1HB       GLU  62  -2.761  -0.294  -0.294
  508   1HG   GLU  62          2HG       GLU  62  -2.576   1.833   1.833
  509   2HG   GLU  62          1HG       GLU  62  -1.791   2.174   2.174
  510    H    ILE  63           H        ILE  63  -3.276  -0.609  -0.609
  511    HA   ILE  63           HA       ILE  63  -3.117  -3.569  -3.569
  512    HB   ILE  63           HB       ILE  63  -3.787  -3.814  -3.814
  513   1HG1  ILE  63          2HG1      ILE  63  -3.211  -0.839  -0.839
  514   2HG1  ILE  63          1HG1      ILE  63  -4.835  -1.527  -1.527
  515   1HG2  ILE  63          2HG2      ILE  63  -1.318  -3.486  -3.486
  516   2HG2  ILE  63          1HG2      ILE  63  -1.352  -2.098  -2.098
  517   3HG2  ILE  63          3HG2      ILE  63  -1.605  -3.723  -3.723
  518   1HD1  ILE  63          2HD1      ILE  63  -2.952  -2.718  -2.718
  519   2HD1  ILE  63          1HD1      ILE  63  -3.437  -1.053  -1.053
  520   3HD1  ILE  63          3HD1      ILE  63  -4.660  -2.316  -2.316
  521    H    ASN  64           H        ASN  64  -5.276  -4.651  -4.651
  522    HA   ASN  64           HA       ASN  64  -7.649  -2.959  -2.959
  523   1HB   ASN  64          2HB       ASN  64  -8.603  -3.828  -3.828
  524   2HB   ASN  64          1HB       ASN  64  -7.223  -2.759  -2.759
  525   1HD2  ASN  64          2HD2      ASN  64  -5.017  -5.412  -5.412
  526   2HD2  ASN  64          1HD2      ASN  64  -5.032  -3.961  -3.961
  527    H    PHE  65           H        PHE  65  -9.197  -4.168  -4.168
  528    HA   PHE  65           HA       PHE  65  -9.403  -7.067  -7.067
  529   1HB   PHE  65          2HB       PHE  65  -8.813  -7.734  -7.734
  530   2HB   PHE  65          1HB       PHE  65  -7.457  -6.900  -6.900
  531    HD1  PHE  65           HD2      PHE  65  -6.974  -4.503  -4.503
  532    HD2  PHE  65           HD1      PHE  65  -9.961  -6.820  -6.820
  533    HE1  PHE  65           HE2      PHE  65  -7.028  -2.828  -2.828
  534    HE2  PHE  65           HE1      PHE  65 -10.023  -5.151  -5.151
  535    HZ   PHE  65           HZ       PHE  65  -8.558  -3.154  -3.154
  536    H    LYS  66           H        LYS  66 -10.753  -7.965  -7.965
  537    HA   LYS  66           HA       LYS  66 -13.031  -6.103  -6.103
  538   1HB   LYS  66          2HB       LYS  66 -14.497  -8.202  -8.202
  539   2HB   LYS  66          1HB       LYS  66 -13.903  -7.602  -7.602
  540   1HG   LYS  66          2HG       LYS  66 -11.982  -9.234  -9.234
  541   2HG   LYS  66          1HG       LYS  66 -12.795  -9.916  -9.916
  542   1HD   LYS  66          2HD       LYS  66 -14.338 -11.000 -11.000
  543   2HD   LYS  66          1HD       LYS  66 -14.556  -9.621  -9.621
  544   1HE   LYS  66          2HE       LYS  66 -12.125 -11.426 -11.426
  545   2HE   LYS  66          1HE       LYS  66 -13.554 -11.677 -11.677
  546   1HZ   LYS  66          2HZ       LYS  66 -13.192  -9.198  -9.198
  547   2HZ   LYS  66          1HZ       LYS  66 -11.601  -9.480  -9.480
  548   3HZ   LYS  66          3HZ       LYS  66 -12.243 -10.387 -10.387
  549    H    VAL  67           H        VAL  67 -14.098  -6.558  -6.558
  550    HA   VAL  67           HA       VAL  67 -12.162  -7.636  -7.636
  551    HB   VAL  67           HB       VAL  67 -14.858  -6.957  -6.957
  552   1HG1  VAL  67          3HG1      VAL  67 -11.972  -6.387  -6.387
  553   2HG1  VAL  67          2HG1      VAL  67 -13.271  -5.510  -5.510
  554   3HG1  VAL  67          1HG1      VAL  67 -13.168  -7.265  -7.265
  555   1HG2  VAL  67          3HG2      VAL  67 -13.206  -4.991  -4.991
  556   2HG2  VAL  67          2HG2      VAL  67 -14.959  -5.167  -5.167
  557   3HG2  VAL  67          1HG2      VAL  67 -14.097  -4.448  -4.448
  558    H    GLY  68           H        GLY  68 -12.088  -9.877  -9.877
  559   1HA   GLY  68          2HA       GLY  68 -13.510 -11.659 -11.659
  560   2HA   GLY  68          1HA       GLY  68 -14.638 -11.387 -11.387
  561    H    GLU  69           H        GLU  69 -12.588 -11.058 -11.058
  562    HA   GLU  69           HA       GLU  69 -11.685 -13.910 -13.910
  563   1HB   GLU  69          2HB       GLU  69 -12.606 -11.933 -11.933
  564   2HB   GLU  69          1HB       GLU  69 -11.615 -13.320 -13.320
  565   1HG   GLU  69          2HG       GLU  69 -14.088 -13.676 -13.676
  566   2HG   GLU  69          1HG       GLU  69 -14.196 -13.597 -13.597
  567    H    GLU  70           H        GLU  70  -9.587 -14.299 -14.299
  568    HA   GLU  70           HA       GLU  70  -7.633 -12.223 -12.223
  569   1HB   GLU  70          2HB       GLU  70  -5.985 -13.998 -13.998
  570   2HB   GLU  70          1HB       GLU  70  -7.136 -14.525 -14.525
  571   1HG   GLU  70          2HG       GLU  70  -8.036 -15.020 -15.020
  572   2HG   GLU  70          1HG       GLU  70  -6.562 -15.887 -15.887
  573    H    PHE  71           H        PHE  71  -5.780 -11.908 -11.908
  574    HA   PHE  71           HA       PHE  71  -6.491 -12.134 -12.134
  575   1HB   PHE  71          2HB       PHE  71  -6.462  -9.656  -9.656
  576   2HB   PHE  71          1HB       PHE  71  -7.847 -10.194 -10.194
  577    HD1  PHE  71           HD2      PHE  71  -7.657 -10.088 -10.088
  578    HD2  PHE  71           HD1      PHE  71  -4.962  -8.060  -8.060
  579    HE1  PHE  71           HE2      PHE  71  -6.951  -8.596  -8.596
  580    HE2  PHE  71           HE1      PHE  71  -4.258  -6.567  -6.567
  581    HZ   PHE  71           HZ       PHE  71  -5.249  -6.831  -6.831
  582    H    GLU  72           H        GLU  72  -4.805 -10.823 -10.823
  583    HA   GLU  72           HA       GLU  72  -2.172 -11.138 -11.138
  584   1HB   GLU  72          2HB       GLU  72  -2.435 -10.687 -10.687
  585   2HB   GLU  72          1HB       GLU  72  -1.161 -11.509 -11.509
  586   1HG   GLU  72          2HG       GLU  72  -2.761 -13.338 -13.338
  587   2HG   GLU  72          1HG       GLU  72  -3.974 -12.545 -12.545
  588    H    GLU  73           H        GLU  73  -0.761  -9.373  -9.373
  589    HA   GLU  73           HA       GLU  73  -1.367  -6.867  -6.867
  590   1HB   GLU  73          2HB       GLU  73  -1.613  -5.559  -5.559
  591   2HB   GLU  73          1HB       GLU  73  -2.965  -6.650  -6.650
  592   1HG   GLU  73          2HG       GLU  73  -2.447  -8.005  -8.005
  593   2HG   GLU  73          1HG       GLU  73  -0.710  -7.804  -7.804
  594    H    GLN  74           H        GLN  74   0.123  -5.099  -5.099
  595    HA   GLN  74           HA       GLN  74   2.820  -6.403  -6.403
  596   1HB   GLN  74          2HB       GLN  74   1.864  -3.629  -3.629
  597   2HB   GLN  74          1HB       GLN  74   3.534  -3.888  -3.888
  598   1HG   GLN  74          2HG       GLN  74   3.439  -5.848  -5.848
  599   2HG   GLN  74          1HG       GLN  74   2.118  -4.891  -4.891
  600   1HE2  GLN  74          1HE2      GLN  74   5.557  -4.588  -4.588
  601   2HE2  GLN  74          2HE2      GLN  74   5.930  -3.350  -3.350
  602    H    THR  75           H        THR  75   4.298  -5.717  -5.717
  603    HA   THR  75           HA       THR  75   2.867  -5.120  -5.120
  604    HB   THR  75           HB       THR  75   4.525  -7.022  -7.022
  605    HG1  THR  75           HG1      THR  75   4.561  -6.774  -6.774
  606   1HG2  THR  75          1HG2      THR  75   6.207  -4.917  -4.917
  607   2HG2  THR  75          3HG2      THR  75   6.896  -5.535  -5.535
  608   3HG2  THR  75          2HG2      THR  75   6.583  -6.630  -6.630
  609    H    VAL  76           H        VAL  76   5.572  -3.920  -3.920
  610    HA   VAL  76           HA       VAL  76   5.033  -1.193  -1.193
  611    HB   VAL  76           HB       VAL  76   6.342  -1.900  -1.900
  612   1HG1  VAL  76          1HG1      VAL  76   6.370   0.464   0.464
  613   2HG1  VAL  76          3HG1      VAL  76   4.848   0.628   0.628
  614   3HG1  VAL  76          2HG1      VAL  76   6.346   0.347   0.347
  615   1HG2  VAL  76          1HG2      VAL  76   3.440  -1.482  -1.482
  616   2HG2  VAL  76          3HG2      VAL  76   4.155  -2.792  -2.792
  617   3HG2  VAL  76          2HG2      VAL  76   4.036  -1.174  -1.174
  618    H    ASP  77           H        ASP  77   7.483  -3.639  -3.639
  619    HA   ASP  77           HA       ASP  77   9.679  -1.742  -1.742
  620   1HB   ASP  77          2HB       ASP  77   9.602  -4.103  -4.103
  621   2HB   ASP  77          1HB       ASP  77  10.160  -4.651  -4.651
  622    H    GLY  78           H        GLY  78   7.998  -4.347  -4.347
  623   1HA   GLY  78          2HA       GLY  78   7.657  -3.607  -3.607
  624   2HA   GLY  78          1HA       GLY  78   9.419  -3.606  -3.606
  625    H    ARG  79           H        ARG  79   7.177  -5.873  -5.873
  626    HA   ARG  79           HA       ARG  79   8.240  -8.038  -8.038
  627   1HB   ARG  79          2HB       ARG  79   8.052  -7.853  -7.853
  628   2HB   ARG  79          1HB       ARG  79   7.937  -9.419  -9.419
  629   1HG   ARG  79          2HG       ARG  79  10.091  -8.470  -8.470
  630   2HG   ARG  79          1HG       ARG  79  10.253  -7.570  -7.570
  631   1HD   ARG  79          2HD       ARG  79  11.474  -9.687  -9.687
  632   2HD   ARG  79          1HD       ARG  79  10.101  -9.692  -9.692
  633    HE   ARG  79           HE       ARG  79   9.082 -10.821 -10.821
  634   1HH1  ARG  79          2HH1      ARG  79  10.176 -12.024 -12.024
  635   2HH1  ARG  79          1HH1      ARG  79  10.957 -13.435 -13.435
  636   1HH2  ARG  79          1HH2      ARG  79  10.796 -12.373 -12.373
  637   2HH2  ARG  79          2HH2      ARG  79  11.309 -13.633 -13.633
  638    HA   PRO  80           HA       PRO  80   3.915  -8.931  -8.931
  639   1HB   PRO  80          2HB       PRO  80   4.063 -11.553 -11.553
  640   2HB   PRO  80          1HB       PRO  80   4.419 -10.168 -10.168
  641   1HG   PRO  80          2HG       PRO  80   6.304 -12.098 -12.098
  642   2HG   PRO  80          1HG       PRO  80   6.504 -11.139 -11.139
  643   1HD   PRO  80          2HD       PRO  80   7.644 -10.556 -10.556
  644   2HD   PRO  80          1HD       PRO  80   7.558  -9.451  -9.451
  645    H    CYS  81           H        CYS  81   2.294  -9.746  -9.746
  646    HA   CYS  81           HA       CYS  81   2.686 -12.078 -12.078
  647   1HB   CYS  81          2HB       CYS  81   2.251 -10.808 -10.808
  648   2HB   CYS  81          1HB       CYS  81   3.828 -10.476 -10.476
  649    HG   CYS  81           HG       CYS  81   1.409  -8.523  -8.523
  650    H    LYS  82           H        LYS  82   0.712 -12.915 -12.915
  651    HA   LYS  82           HA       LYS  82  -1.691 -11.643 -11.643
  652   1HB   LYS  82          2HB       LYS  82  -1.336 -14.061 -14.061
  653   2HB   LYS  82          1HB       LYS  82  -1.297 -14.293 -14.293
  654   1HG   LYS  82          2HG       LYS  82  -3.646 -13.139 -13.139
  655   2HG   LYS  82          1HG       LYS  82  -3.620 -13.617 -13.617
  656   1HD   LYS  82          2HD       LYS  82  -3.083 -15.546 -15.546
  657   2HD   LYS  82          1HD       LYS  82  -4.680 -15.312 -15.312
  658   1HE   LYS  82          2HE       LYS  82  -3.239 -15.681 -15.681
  659   2HE   LYS  82          1HE       LYS  82  -2.279 -16.646 -16.646
  660   1HZ   LYS  82          2HZ       LYS  82  -4.505 -17.626 -17.626
  661   2HZ   LYS  82          1HZ       LYS  82  -5.122 -16.961 -16.961
  662   3HZ   LYS  82          3HZ       LYS  82  -3.878 -18.111 -18.111
  663    H    SER  83           H        SER  83  -2.731 -10.199 -10.199
  664    HA   SER  83           HA       SER  83  -2.409 -10.314 -10.314
  665   1HB   SER  83          2HB       SER  83  -1.934  -8.146  -8.146
  666   2HB   SER  83          1HB       SER  83  -3.186  -8.198  -8.198
  667    HG   SER  83           HG       SER  83  -3.674  -6.895  -6.895
  668    H    LEU  84           H        LEU  84  -4.395  -9.797  -9.797
  669    HA   LEU  84           HA       LEU  84  -6.969 -10.525 -10.525
  670   1HB   LEU  84          2HB       LEU  84  -6.096 -12.678 -12.678
  671   2HB   LEU  84          1HB       LEU  84  -5.842 -11.954 -11.954
  672    HG   LEU  84           HG       LEU  84  -8.266 -11.550 -11.550
  673   1HD1  LEU  84          2HD1      LEU  84  -8.721 -11.326 -11.326
  674   2HD1  LEU  84          1HD1      LEU  84  -8.515 -13.069 -13.069
  675   3HD1  LEU  84          3HD1      LEU  84  -9.834 -12.418 -12.418
  676   1HD2  LEU  84          2HD2      LEU  84  -7.088 -13.803 -13.803
  677   2HD2  LEU  84          1HD2      LEU  84  -8.851 -13.769 -13.769
  678   3HD2  LEU  84          3HD2      LEU  84  -7.944 -14.410 -14.410
  679    H    VAL  85           H        VAL  85  -8.792  -9.713  -9.713
  680    HA   VAL  85           HA       VAL  85  -7.961  -8.073  -8.073
  681    HB   VAL  85           HB       VAL  85  -9.573  -6.890  -6.890
  682   1HG1  VAL  85          2HG1      VAL  85  -9.528  -6.097  -6.097
  683   2HG1  VAL  85          1HG1      VAL  85  -8.045  -5.308  -5.308
  684   3HG1  VAL  85          3HG1      VAL  85  -9.577  -4.936  -4.936
  685   1HG2  VAL  85          3HG2      VAL  85  -6.617  -6.830  -6.830
  686   2HG2  VAL  85          2HG2      VAL  85  -7.423  -7.174  -7.174
  687   3HG2  VAL  85          1HG2      VAL  85  -7.397  -5.529  -5.529
  688    H    LYS  86           H        LYS  86  -9.370  -8.329  -8.329
  689    HA   LYS  86           HA       LYS  86 -12.221  -8.926  -8.926
  690   1HB   LYS  86          2HB       LYS  86 -12.086  -9.841  -9.841
  691   2HB   LYS  86          1HB       LYS  86 -11.742 -10.877 -10.877
  692   1HG   LYS  86          2HG       LYS  86  -9.300 -10.266 -10.266
  693   2HG   LYS  86          1HG       LYS  86  -9.741  -9.451  -9.451
  694   1HD   LYS  86          2HD       LYS  86 -10.458 -11.483 -11.483
  695   2HD   LYS  86          1HD       LYS  86 -10.454 -12.340 -12.340
  696   1HE   LYS  86          2HE       LYS  86  -8.429 -13.070 -13.070
  697   2HE   LYS  86          1HE       LYS  86  -7.889 -11.602 -11.602
  698   1HZ   LYS  86          1HZ       LYS  86  -8.697 -11.712 -11.712
  699   2HZ   LYS  86          3HZ       LYS  86  -7.091 -11.831 -11.831
  700   3HZ   LYS  86          2HZ       LYS  86  -7.974 -10.407 -10.407
  701    H    TRP  87           H        TRP  87 -13.741  -7.899  -7.899
  702    HA   TRP  87           HA       TRP  87 -12.810  -5.235  -5.235
  703   1HB   TRP  87          2HB       TRP  87 -15.443  -6.703  -6.703
  704   2HB   TRP  87          1HB       TRP  87 -15.212  -5.133  -5.133
  705    HD1  TRP  87           HD1      TRP  87 -16.041  -6.757  -6.757
  706    HE1  TRP  87           HE1      TRP  87 -16.166  -5.028  -5.028
  707    HE3  TRP  87           HE3      TRP  87 -13.927  -2.759  -2.759
  708    HZ2  TRP  87           HZ2      TRP  87 -15.458  -2.294  -2.294
  709    HZ3  TRP  87           HZ3      TRP  87 -13.641  -0.604  -0.604
  710    HH2  TRP  87           HH2      TRP  87 -14.400  -0.376  -0.376
  711    H    GLU  88           H        GLU  88 -13.589  -4.440  -4.440
  712    HA   GLU  88           HA       GLU  88 -13.051  -6.420  -6.420
  713   1HB   GLU  88          2HB       GLU  88 -11.009  -4.963  -4.963
  714   2HB   GLU  88          1HB       GLU  88 -11.873  -3.652  -3.652
  715   1HG   GLU  88          2HG       GLU  88 -10.512  -4.520  -4.520
  716   2HG   GLU  88          1HG       GLU  88 -12.088  -5.253  -5.253
  717    H    SER  89           H        SER  89 -13.970  -3.126  -3.126
  718    HA   SER  89           HA       SER  89 -16.164  -3.215  -3.215
  719   1HB   SER  89          2HB       SER  89 -15.714  -0.900  -0.900
  720   2HB   SER  89          1HB       SER  89 -14.211  -1.800  -1.800
  721    HG   SER  89           HG       SER  89 -14.739   0.289   0.289
  722    H    GLU  90           H        GLU  90 -17.007  -0.512  -0.512
  723    HA   GLU  90           HA       GLU  90 -18.420  -1.368  -1.368
  724   1HB   GLU  90          2HB       GLU  90 -19.430   0.927   0.927
  725   2HB   GLU  90          1HB       GLU  90 -19.599   0.018   0.018
  726   1HG   GLU  90          2HG       GLU  90 -17.912   1.256   1.256
  727   2HG   GLU  90          1HG       GLU  90 -17.250   1.853   1.853
  728    H    ASN  91           H        ASN  91 -15.571   0.549   0.549
  729    HA   ASN  91           HA       ASN  91 -15.198   0.853   0.853
  730   1HB   ASN  91          2HB       ASN  91 -14.657   3.147   3.147
  731   2HB   ASN  91          1HB       ASN  91 -14.673   3.170   3.170
  732   1HD2  ASN  91          2HD2      ASN  91 -18.009   4.184   4.184
  733   2HD2  ASN  91          1HD2      ASN  91 -16.437   4.333   4.333
  734    H    LYS  92           H        LYS  92 -13.905  -0.825  -0.825
  735    HA   LYS  92           HA       LYS  92 -11.124   0.108   0.108
  736   1HB   LYS  92          2HB       LYS  92 -11.734   0.699   0.699
  737   2HB   LYS  92          1HB       LYS  92 -12.131  -0.989  -0.989
  738   1HG   LYS  92          2HG       LYS  92  -9.791  -1.614  -1.614
  739   2HG   LYS  92          1HG       LYS  92  -9.412   0.098   0.098
  740   1HD   LYS  92          2HD       LYS  92 -10.039   0.504   0.504
  741   2HD   LYS  92          1HD       LYS  92 -10.423  -1.206  -1.206
  742   1HE   LYS  92          2HE       LYS  92  -7.755  -0.842  -0.842
  743   2HE   LYS  92          1HE       LYS  92  -7.930  -0.009  -0.009
  744   1HZ   LYS  92          3HZ       LYS  92  -8.778  -2.053  -2.053
  745   2HZ   LYS  92          2HZ       LYS  92  -8.600  -2.855  -2.855
  746   3HZ   LYS  92          1HZ       LYS  92  -7.231  -2.293  -2.293
  747    H    MET  93           H        MET  93 -10.292  -1.489  -1.489
  748    HA   MET  93           HA       MET  93 -11.048  -4.306  -4.306
  749   1HB   MET  93          2HB       MET  93 -10.757  -4.870  -4.870
  750   2HB   MET  93          1HB       MET  93 -11.980  -3.626  -3.626
  751   1HG   MET  93          2HG       MET  93  -9.481  -2.305  -2.305
  752   2HG   MET  93          1HG       MET  93  -9.548  -3.530  -3.530
  753   1HE   MET  93          1HE       MET  93 -11.518  -4.115  -4.115
  754   2HE   MET  93          3HE       MET  93 -12.825  -3.062  -3.062
  755   3HE   MET  93          2HE       MET  93 -11.240  -2.981  -2.981
  756    H    VAL  94           H        VAL  94  -9.428  -5.893  -5.893
  757    HA   VAL  94           HA       VAL  94  -6.661  -4.854  -4.854
  758    HB   VAL  94           HB       VAL  94  -7.528  -7.687  -7.687
  759   1HG1  VAL  94          2HG1      VAL  94  -5.303  -5.863  -5.863
  760   2HG1  VAL  94          1HG1      VAL  94  -5.754  -7.178  -7.178
  761   3HG1  VAL  94          3HG1      VAL  94  -5.229  -7.529  -7.529
  762   1HG2  VAL  94          3HG2      VAL  94  -8.000  -5.250  -5.250
  763   2HG2  VAL  94          2HG2      VAL  94  -9.128  -6.548  -6.548
  764   3HG2  VAL  94          1HG2      VAL  94  -7.792  -6.847  -6.847
  765    H    CYS  95           H        CYS  95  -4.950  -6.499  -6.499
  766    HA   CYS  95           HA       CYS  95  -5.915  -7.814  -7.814
  767   1HB   CYS  95          2HB       CYS  95  -5.360  -5.477  -5.477
  768   2HB   CYS  95          1HB       CYS  95  -3.734  -5.706  -5.706
  769    HG   CYS  95           HG       CYS  95  -4.605  -6.548  -6.548
  770    H    GLU  96           H        GLU  96  -4.697  -9.530  -9.530
  771    HA   GLU  96           HA       GLU  96  -2.237 -10.116 -10.116
  772   1HB   GLU  96          2HB       GLU  96  -3.917 -12.085 -12.085
  773   2HB   GLU  96          1HB       GLU  96  -2.655 -12.457 -12.457
  774   1HG   GLU  96          2HG       GLU  96  -5.023 -10.841 -10.841
  775   2HG   GLU  96          1HG       GLU  96  -5.200 -12.585 -12.585
  776    H    GLN  97           H        GLN  97  -0.489 -11.234 -11.234
  777    HA   GLN  97           HA       GLN  97  -0.743 -10.884 -10.884
  778   1HB   GLN  97          2HB       GLN  97  -0.124  -8.623  -8.623
  779   2HB   GLN  97          1HB       GLN  97   1.492  -9.312  -9.312
  780   1HG   GLN  97          2HG       GLN  97   0.848  -9.742  -9.742
  781   2HG   GLN  97          1HG       GLN  97  -0.405  -8.536  -8.536
  782   1HE2  GLN  97          2HE2      GLN  97   1.840  -5.836  -5.836
  783   2HE2  GLN  97          1HE2      GLN  97   0.228  -6.368  -6.368
  784    H    LYS  98           H        LYS  98   0.557 -12.263 -12.263
  785    HA   LYS  98           HA       LYS  98   3.058 -13.224 -13.224
  786   1HB   LYS  98          2HB       LYS  98   2.461 -15.579 -15.579
  787   2HB   LYS  98          1HB       LYS  98   1.378 -14.897 -14.897
  788   1HG   LYS  98          2HG       LYS  98  -0.354 -14.535 -14.535
  789   2HG   LYS  98          1HG       LYS  98   0.741 -14.815 -14.815
  790   1HD   LYS  98          2HD       LYS  98  -0.607 -16.806 -16.806
  791   2HD   LYS  98          1HD       LYS  98   1.039 -17.175 -17.175
  792   1HE   LYS  98          2HE       LYS  98   0.095 -17.916 -17.916
  793   2HE   LYS  98          1HE       LYS  98  -0.115 -16.213 -16.213
  794   1HZ   LYS  98          3HZ       LYS  98  -2.098 -17.727 -17.727
  795   2HZ   LYS  98          2HZ       LYS  98  -2.165 -17.643 -17.643
  796   3HZ   LYS  98          1HZ       LYS  98  -2.298 -16.227 -16.227
  797    H    LEU  99           H        LEU  99   4.609 -13.980 -13.980
  798    HA   LEU  99           HA       LEU  99   4.536 -12.595 -12.595
  799   1HB   LEU  99          2HB       LEU  99   6.100 -15.029 -15.029
  800   2HB   LEU  99          1HB       LEU  99   6.379 -14.184 -14.184
  801    HG   LEU  99           HG       LEU  99   6.317 -12.518 -12.518
  802   1HD1  LEU  99          2HD1      LEU  99   8.512 -14.482 -14.482
  803   2HD1  LEU  99          1HD1      LEU  99   8.774 -13.080 -13.080
  804   3HD1  LEU  99          3HD1      LEU  99   7.644 -14.342 -14.342
  805   1HD2  LEU  99          2HD2      LEU  99   6.697 -11.644 -11.644
  806   2HD2  LEU  99          1HD2      LEU  99   8.038 -11.303 -11.303
  807   3HD2  LEU  99          3HD2      LEU  99   8.169 -12.612 -12.612
  808    H    LEU 100           H        LEU 100   4.688 -13.681 -13.681
  809    HA   LEU 100           HA       LEU 100   2.513 -15.672 -15.672
  810   1HB   LEU 100          2HB       LEU 100   3.846 -13.741 -13.741
  811   2HB   LEU 100          1HB       LEU 100   2.819 -15.054 -15.054
  812    HG   LEU 100           HG       LEU 100   1.923 -13.044 -13.044
  813   1HD1  LEU 100          2HD1      LEU 100   1.966 -12.930 -12.930
  814   2HD1  LEU 100          1HD1      LEU 100   0.500 -12.370 -12.370
  815   3HD1  LEU 100          3HD1      LEU 100   2.051 -11.618 -11.618
  816   1HD2  LEU 100          1HD2      LEU 100   0.693 -15.327 -15.327
  817   2HD2  LEU 100          3HD2      LEU 100   0.464 -14.837 -14.837
  818   3HD2  LEU 100          2HD2      LEU 100  -0.324 -13.938 -13.938
  819    H    LYS 101           H        LYS 101   5.890 -15.544 -15.544
  820    HA   LYS 101           HA       LYS 101   6.115 -18.279 -18.279
  821   1HB   LYS 101          2HB       LYS 101   6.497 -16.807 -16.807
  822   2HB   LYS 101          1HB       LYS 101   7.850 -16.067 -16.067
  823   1HG   LYS 101          2HG       LYS 101   8.783 -17.785 -17.785
  824   2HG   LYS 101          1HG       LYS 101   8.817 -18.403 -18.403
  825   1HD   LYS 101          2HD       LYS 101   7.103 -19.919 -19.919
  826   2HD   LYS 101          1HD       LYS 101   6.402 -18.955 -18.955
  827   1HE   LYS 101          2HE       LYS 101   7.389 -20.651 -20.651
  828   2HE   LYS 101          1HE       LYS 101   8.713 -19.487 -19.487
  829   1HZ   LYS 101          1HZ       LYS 101   9.474 -20.668 -20.668
  830   2HZ   LYS 101          3HZ       LYS 101   8.343 -21.881 -21.881
  831   3HZ   LYS 101          2HZ       LYS 101   9.609 -21.562 -21.562
  832    H    GLY 102           H        GLY 102   7.777 -19.385 -19.385
  833   1HA   GLY 102          2HA       GLY 102   9.449 -19.776 -19.776
  834   2HA   GLY 102          1HA       GLY 102  10.039 -18.149 -18.149
  835    H    GLU 103           H        GLU 103  10.409 -17.921 -17.921
  836    HA   GLU 103           HA       GLU 103   8.290 -16.537 -16.537
  837   1HB   GLU 103          2HB       GLU 103   7.434 -18.881 -18.881
  838   2HB   GLU 103          1HB       GLU 103   8.892 -19.276 -19.276
  839   1HG   GLU 103          2HG       GLU 103   8.318 -17.855 -17.855
  840   2HG   GLU 103          1HG       GLU 103   7.164 -16.949 -16.949
  841    H    GLY 104           H        GLY 104   9.104 -15.374 -15.374
  842   1HA   GLY 104          2HA       GLY 104  11.587 -16.162 -16.162
  843   2HA   GLY 104          1HA       GLY 104  11.710 -14.704 -14.704
  844    HA   PRO 105           HA       PRO 105   9.912 -12.542 -12.542
  845   1HB   PRO 105          2HB       PRO 105   9.086 -10.264 -10.264
  846   2HB   PRO 105          1HB       PRO 105  10.784 -10.609 -10.609
  847   1HG   PRO 105          2HG       PRO 105   9.388 -10.686 -10.686
  848   2HG   PRO 105          1HG       PRO 105  11.115 -10.494 -10.494
  849   1HD   PRO 105          2HD       PRO 105   9.791 -12.887 -12.887
  850   2HD   PRO 105          1HD       PRO 105  11.484 -12.731 -12.731
  851    H    LYS 106           H        LYS 106   7.730 -11.110 -11.110
  852    HA   LYS 106           HA       LYS 106   5.466 -12.378 -12.378
  853   1HB   LYS 106          2HB       LYS 106   5.801 -13.620 -13.620
  854   2HB   LYS 106          1HB       LYS 106   5.739 -12.105 -12.105
  855   1HG   LYS 106          2HG       LYS 106   3.460 -11.761 -11.761
  856   2HG   LYS 106          1HG       LYS 106   3.485 -12.958 -12.958
  857   1HD   LYS 106          2HD       LYS 106   3.366 -14.748 -14.748
  858   2HD   LYS 106          1HD       LYS 106   4.172 -13.872 -13.872
  859   1HE   LYS 106          2HE       LYS 106   1.383 -13.208 -13.208
  860   2HE   LYS 106          1HE       LYS 106   1.705 -14.277 -14.277
  861   1HZ   LYS 106          1HZ       LYS 106   3.074 -12.373 -12.373
  862   2HZ   LYS 106          3HZ       LYS 106   2.327 -11.397 -11.397
  863   3HZ   LYS 106          2HZ       LYS 106   1.387 -12.173 -12.173
  864    H    THR 107           H        THR 107   3.840 -10.868 -10.868
  865    HA   THR 107           HA       THR 107   4.151  -8.193  -8.193
  866    HB   THR 107           HB       THR 107   2.911  -7.622  -7.622
  867    HG1  THR 107           HG1      THR 107   3.396  -9.865  -9.865
  868   1HG2  THR 107          1HG2      THR 107   5.702  -7.514  -7.514
  869   2HG2  THR 107          3HG2      THR 107   5.453  -7.160  -7.160
  870   3HG2  THR 107          2HG2      THR 107   4.627  -6.201  -6.201
  871    H    SER 108           H        SER 108   2.327  -7.100  -7.100
  872    HA   SER 108           HA       SER 108  -0.364  -7.983  -7.983
  873   1HB   SER 108          2HB       SER 108   0.763  -8.468  -8.468
  874   2HB   SER 108          1HB       SER 108  -0.966  -8.357  -8.357
  875    HG   SER 108           HG       SER 108   0.503 -10.476 -10.476
  876    H    TRP 109           H        TRP 109  -1.719  -6.142  -6.142
  877    HA   TRP 109           HA       TRP 109  -0.746  -3.992  -3.992
  878   1HB   TRP 109          2HB       TRP 109  -1.184  -2.283  -2.283
  879   2HB   TRP 109          1HB       TRP 109   0.223  -3.305  -3.305
  880    HD1  TRP 109           HD1      TRP 109   0.195  -4.919  -4.919
  881    HE1  TRP 109           HE1      TRP 109  -1.418  -5.250  -5.250
  882    HE3  TRP 109           HE3      TRP 109  -3.799  -2.179  -2.179
  883    HZ2  TRP 109           HZ2      TRP 109  -4.044  -4.461  -4.461
  884    HZ3  TRP 109           HZ3      TRP 109  -5.839  -1.987  -1.987
  885    HH2  TRP 109           HH2      TRP 109  -5.967  -3.125  -3.125
  886    H    THR 110           H        THR 110  -2.425  -2.117  -2.117
  887    HA   THR 110           HA       THR 110  -5.183  -3.220  -3.220
  888    HB   THR 110           HB       THR 110  -5.825  -2.584  -2.584
  889    HG1  THR 110           HG1      THR 110  -4.894  -1.006  -1.006
  890   1HG2  THR 110          3HG2      THR 110  -3.944  -4.502  -4.502
  891   2HG2  THR 110          2HG2      THR 110  -3.096  -3.440  -3.440
  892   3HG2  THR 110          1HG2      THR 110  -4.662  -4.119  -4.119
  893    H    MET 111           H        MET 111  -6.799  -1.352  -1.352
  894    HA   MET 111           HA       MET 111  -5.844   1.350   1.350
  895   1HB   MET 111          2HB       MET 111  -7.278   1.535   1.535
  896   2HB   MET 111          1HB       MET 111  -5.903   0.452   0.452
  897   1HG   MET 111          2HG       MET 111  -7.263  -1.484  -1.484
  898   2HG   MET 111          1HG       MET 111  -8.619  -0.554  -0.554
  899   1HE   MET 111          1HE       MET 111  -7.960  -2.631  -2.631
  900   2HE   MET 111          3HE       MET 111  -9.269  -2.349  -2.349
  901   3HE   MET 111          2HE       MET 111  -7.596  -2.085  -2.085
  902    H    GLU 112           H        GLU 112  -7.237   2.797   2.797
  903    HA   GLU 112           HA       GLU 112  -9.957   1.823   1.823
  904   1HB   GLU 112          2HB       GLU 112  -8.337   1.771   1.771
  905   2HB   GLU 112          1HB       GLU 112  -8.125   3.510   3.510
  906   1HG   GLU 112          2HG       GLU 112 -10.852   3.317   3.317
  907   2HG   GLU 112          1HG       GLU 112 -10.384   2.005   2.005
  908    H    LEU 113           H        LEU 113 -11.572   3.437   3.437
  909    HA   LEU 113           HA       LEU 113 -10.738   6.014   6.014
  910   1HB   LEU 113          2HB       LEU 113 -12.589   4.139   4.139
  911   2HB   LEU 113          1HB       LEU 113 -13.603   5.280   5.280
  912    HG   LEU 113           HG       LEU 113 -13.360   5.739   5.739
  913   1HD1  LEU 113          3HD1      LEU 113 -13.024   7.603   7.603
  914   2HD1  LEU 113          2HD1      LEU 113 -12.312   8.222   8.222
  915   3HD1  LEU 113          1HD1      LEU 113 -14.007   7.748   7.748
  916   1HD2  LEU 113          2HD2      LEU 113 -10.610   5.389   5.389
  917   2HD2  LEU 113          1HD2      LEU 113 -11.341   5.817   5.817
  918   3HD2  LEU 113          3HD2      LEU 113 -10.815   7.084   7.084
  919    H    THR 114           H        THR 114 -11.457   7.941   7.941
  920    HA   THR 114           HA       THR 114 -12.391   7.553   7.553
  921    HB   THR 114           HB       THR 114 -11.830   9.925   9.925
  922    HG1  THR 114           HG1      THR 114 -11.085   9.838   9.838
  923   1HG2  THR 114          3HG2      THR 114 -10.079   8.039   8.039
  924   2HG2  THR 114          2HG2      THR 114  -9.591   8.657   8.657
  925   3HG2  THR 114          1HG2      THR 114  -9.478   9.690   9.690
  926    H    ASN 115           H        ASN 115 -14.131   8.970   8.970
  927    HA   ASN 115           HA       ASN 115 -16.526   8.748   8.748
  928   1HB   ASN 115          2HB       ASN 115 -15.805  10.409  10.409
  929   2HB   ASN 115          1HB       ASN 115 -17.433  10.382  10.382
  930   1HD2  ASN 115          2HD2      ASN 115 -17.742   6.768   6.768
  931   2HD2  ASN 115          1HD2      ASN 115 -17.925   7.776   7.776
  932    H    ASP 116           H        ASP 116 -14.061  11.203  11.203
  933    HA   ASP 116           HA       ASP 116 -15.804  13.242  13.242
  934   1HB   ASP 116          2HB       ASP 116 -13.736  13.675  13.675
  935   2HB   ASP 116          1HB       ASP 116 -12.784  13.283  13.283
  936    H    GLY 117           H        GLY 117 -13.557  10.758  10.758
  937   1HA   GLY 117          2HA       GLY 117 -14.113   9.926   9.926
  938   2HA   GLY 117          1HA       GLY 117 -13.996  11.614  11.614
  939    H    GLU 118           H        GLU 118 -11.659  11.477  11.477
  940    HA   GLU 118           HA       GLU 118  -9.488  11.528  11.528
  941   1HB   GLU 118          2HB       GLU 118  -9.392  10.863  10.863
  942   2HB   GLU 118          1HB       GLU 118  -8.044  11.424  11.424
  943   1HG   GLU 118          2HG       GLU 118  -9.322  13.518  13.518
  944   2HG   GLU 118          1HG       GLU 118 -10.576  12.966  12.966
  945    H    LEU 119           H        LEU 119  -7.573   9.897   9.897
  946    HA   LEU 119           HA       LEU 119  -8.571   7.111   7.111
  947   1HB   LEU 119          2HB       LEU 119  -8.847   7.834   7.834
  948   2HB   LEU 119          1HB       LEU 119  -7.102   8.038   8.038
  949    HG   LEU 119           HG       LEU 119  -8.377   5.427   5.427
  950   1HD1  LEU 119          3HD1      LEU 119  -7.916   6.607   6.607
  951   2HD1  LEU 119          2HD1      LEU 119  -7.767   4.865   4.865
  952   3HD1  LEU 119          1HD1      LEU 119  -9.293   5.676   5.676
  953   1HD2  LEU 119          2HD2      LEU 119  -5.650   6.401   6.401
  954   2HD2  LEU 119          1HD2      LEU 119  -6.101   5.256   5.256
  955   3HD2  LEU 119          3HD2      LEU 119  -6.101   4.750   4.750
  956    H    ILE 120           H        ILE 120  -7.176   6.388   6.388
  957    HA   ILE 120           HA       ILE 120  -4.279   7.090   7.090
  958    HB   ILE 120           HB       ILE 120  -5.193   7.625   7.625
  959   1HG1  ILE 120          2HG1      ILE 120  -3.574   5.070   5.070
  960   2HG1  ILE 120          1HG1      ILE 120  -2.877   6.640   6.640
  961   1HG2  ILE 120          1HG2      ILE 120  -6.171   4.773   4.773
  962   2HG2  ILE 120          3HG2      ILE 120  -5.975   5.600   5.600
  963   3HG2  ILE 120          2HG2      ILE 120  -7.096   6.236   6.236
  964   1HD1  ILE 120          1HD1      ILE 120  -4.123   7.442   7.442
  965   2HD1  ILE 120          3HD1      ILE 120  -4.130   5.727   5.727
  966   3HD1  ILE 120          2HD1      ILE 120  -2.600   6.566   6.566
  967    H    LEU 121           H        LEU 121  -2.736   5.337   5.337
  968    HA   LEU 121           HA       LEU 121  -3.979   2.653   2.653
  969   1HB   LEU 121          2HB       LEU 121  -3.424   3.744   3.744
  970   2HB   LEU 121          1HB       LEU 121  -1.749   3.883   3.883
  971    HG   LEU 121           HG       LEU 121  -2.567   1.158   1.158
  972   1HD1  LEU 121          3HD1      LEU 121  -3.127   2.249   2.249
  973   2HD1  LEU 121          2HD1      LEU 121  -3.071   0.539   0.539
  974   3HD1  LEU 121          1HD1      LEU 121  -4.323   1.579   1.579
  975   1HD2  LEU 121          1HD2      LEU 121  -0.273   2.033   2.033
  976   2HD2  LEU 121          3HD2      LEU 121  -0.712   0.713   0.713
  977   3HD2  LEU 121          2HD2      LEU 121  -0.749   2.379   2.379
  978    H    THR 122           H        THR 122  -2.741   0.930   0.930
  979    HA   THR 122           HA       THR 122  -0.195   1.643   1.643
  980    HB   THR 122           HB       THR 122  -1.361  -0.756  -0.756
  981    HG1  THR 122           HG1      THR 122  -2.995   1.559   1.559
  982   1HG2  THR 122          2HG2      THR 122  -0.724   2.007   2.007
  983   2HG2  THR 122          1HG2      THR 122  -1.310   0.709   0.709
  984   3HG2  THR 122          3HG2      THR 122   0.225   0.533   0.533
  985    H    MET 123           H        MET 123   1.236  -0.393  -0.393
  986    HA   MET 123           HA       MET 123   0.696  -2.342  -2.342
  987   1HB   MET 123          2HB       MET 123   3.221  -0.663  -0.663
  988   2HB   MET 123          1HB       MET 123   2.834  -1.922  -1.922
  989   1HG   MET 123          2HG       MET 123   0.734  -0.550  -0.550
  990   2HG   MET 123          1HG       MET 123   1.500   0.763   0.763
  991   1HE   MET 123          1HE       MET 123   1.325  -1.522  -1.522
  992   2HE   MET 123          3HE       MET 123   0.767   0.048   0.048
  993   3HE   MET 123          2HE       MET 123   2.194  -0.707  -0.707
  994    H    THR 124           H        THR 124   2.342  -4.080  -4.080
  995    HA   THR 124           HA       THR 124   3.913  -4.324  -4.324
  996    HB   THR 124           HB       THR 124   2.055  -6.544  -6.544
  997    HG1  THR 124           HG1      THR 124   0.698  -5.795  -5.795
  998   1HG2  THR 124          2HG2      THR 124   4.069  -7.042  -7.042
  999   2HG2  THR 124          1HG2      THR 124   3.482  -5.901  -5.901
 1000   3HG2  THR 124          3HG2      THR 124   2.560  -7.362  -7.362
 1001    H    ALA 125           H        ALA 125   5.541  -5.912  -5.912
 1002    HA   ALA 125           HA       ALA 125   5.837  -7.510  -7.510
 1003   1HB   ALA 125          2HB       ALA 125   6.628  -5.039  -5.039
 1004   2HB   ALA 125          1HB       ALA 125   8.050  -5.538  -5.538
 1005   3HB   ALA 125          3HB       ALA 125   7.612  -6.388  -6.388
 1006    H    ASP 126           H        ASP 126   6.155  -9.299  -9.299
 1007    HA   ASP 126           HA       ASP 126   7.469 -10.874 -10.874
 1008   1HB   ASP 126          2HB       ASP 126   9.396  -8.976  -8.976
 1009   2HB   ASP 126          1HB       ASP 126   9.692  -9.246  -9.246
 1010    H    ASP 127           H        ASP 127   8.520  -7.958  -7.958
 1011    HA   ASP 127           HA       ASP 127   6.561  -8.496  -8.496
 1012   1HB   ASP 127          2HB       ASP 127   8.592  -9.934  -9.934
 1013   2HB   ASP 127          1HB       ASP 127   9.516  -8.442  -8.442
 1014    H    VAL 128           H        VAL 128   7.349  -6.359  -6.359
 1015    HA   VAL 128           HA       VAL 128   7.700  -4.141  -4.141
 1016    HB   VAL 128           HB       VAL 128   8.801  -2.853  -2.853
 1017   1HG1  VAL 128          3HG1      VAL 128   9.850  -5.623  -5.623
 1018   2HG1  VAL 128          2HG1      VAL 128  10.763  -4.499  -4.499
 1019   3HG1  VAL 128          1HG1      VAL 128  10.394  -4.084  -4.084
 1020   1HG2  VAL 128          3HG2      VAL 128   7.807  -5.097  -5.097
 1021   2HG2  VAL 128          2HG2      VAL 128   8.020  -3.398  -3.398
 1022   3HG2  VAL 128          1HG2      VAL 128   9.409  -4.484  -4.484
 1023    H    VAL 129           H        VAL 129   6.795  -2.027  -2.027
 1024    HA   VAL 129           HA       VAL 129   4.470  -2.659  -2.659
 1025    HB   VAL 129           HB       VAL 129   4.272  -2.067  -2.067
 1026   1HG1  VAL 129          2HG1      VAL 129   2.528  -0.774  -0.774
 1027   2HG1  VAL 129          1HG1      VAL 129   1.779  -1.358  -1.358
 1028   3HG1  VAL 129          3HG1      VAL 129   3.059  -0.147  -0.147
 1029   1HG2  VAL 129          1HG2      VAL 129   3.022  -3.835  -3.835
 1030   2HG2  VAL 129          3HG2      VAL 129   3.587  -4.213  -4.213
 1031   3HG2  VAL 129          2HG2      VAL 129   2.041  -3.396  -3.396
 1032    H    CYS 130           H        CYS 130   4.515  -1.101  -1.101
 1033    HA   CYS 130           HA       CYS 130   5.609   1.575   1.575
 1034   1HB   CYS 130          2HB       CYS 130   6.378   0.148   0.148
 1035   2HB   CYS 130          1HB       CYS 130   4.890   0.736   0.736
 1036    HG   CYS 130           HG       CYS 130   6.466   3.033   3.033
 1037    H    THR 131           H        THR 131   4.107   3.082   3.082
 1038    HA   THR 131           HA       THR 131   1.374   2.864   2.864
 1039    HB   THR 131           HB       THR 131   2.381   4.317   4.317
 1040    HG1  THR 131           HG1      THR 131   1.262   2.686   2.686
 1041   1HG2  THR 131          3HG2      THR 131  -0.354   4.084   4.084
 1042   2HG2  THR 131          2HG2      THR 131  -0.140   4.464   4.464
 1043   3HG2  THR 131          1HG2      THR 131   0.507   5.547   5.547
 1044    H    ARG 132           H        ARG 132   0.731   4.442   4.442
 1045    HA   ARG 132           HA       ARG 132   2.211   7.027   7.027
 1046   1HB   ARG 132          2HB       ARG 132   1.290   5.396   5.396
 1047   2HB   ARG 132          1HB       ARG 132   1.946   7.030   7.030
 1048   1HG   ARG 132          2HG       ARG 132   3.984   6.071   6.071
 1049   2HG   ARG 132          1HG       ARG 132   3.834   5.657   5.657
 1050   1HD   ARG 132          2HD       ARG 132   3.466   3.457   3.457
 1051   2HD   ARG 132          1HD       ARG 132   2.427   3.809   3.809
 1052    HE   ARG 132           HE       ARG 132   5.202   3.127   3.127
 1053   1HH1  ARG 132          2HH1      ARG 132   6.095   5.459   5.459
 1054   2HH1  ARG 132          1HH1      ARG 132   5.462   5.606   5.606
 1055   1HH2  ARG 132          1HH2      ARG 132   2.972   3.241   3.241
 1056   2HH2  ARG 132          2HH2      ARG 132   3.694   4.350   4.350
 1057    H    VAL 133           H        VAL 133   0.632   8.326   8.326
 1058    HA   VAL 133           HA       VAL 133  -2.200   7.900   7.900
 1059    HB   VAL 133           HB       VAL 133  -0.757  10.423  10.423
 1060   1HG1  VAL 133          1HG1      VAL 133  -3.624   9.561   9.561
 1061   2HG1  VAL 133          3HG1      VAL 133  -3.084  10.589  10.589
 1062   3HG1  VAL 133          2HG1      VAL 133  -2.928  11.146  11.146
 1063   1HG2  VAL 133          1HG2      VAL 133  -1.738   8.007   8.007
 1064   2HG2  VAL 133          3HG2      VAL 133  -0.129   8.728   8.728
 1065   3HG2  VAL 133          2HG2      VAL 133  -1.480   9.561   9.561
 1066    H    TYR 134           H        TYR 134  -3.533   8.672   8.672
 1067    HA   TYR 134           HA       TYR 134  -2.264  10.488  10.488
 1068   1HB   TYR 134          2HB       TYR 134  -3.892   7.999   7.999
 1069   2HB   TYR 134          1HB       TYR 134  -3.964   9.273   9.273
 1070    HD1  TYR 134           HD2      TYR 134  -1.953   9.948   9.948
 1071    HD2  TYR 134           HD1      TYR 134  -1.867   6.713   6.713
 1072    HE1  TYR 134           HE2      TYR 134   0.208   9.179   9.179
 1073    HE2  TYR 134           HE1      TYR 134   0.296   5.946   5.946
 1074    HH   TYR 134           HH       TYR 134   1.460   6.893   6.893
 1075    H    VAL 135           H        VAL 135  -3.308  12.364  12.364
 1076    HA   VAL 135           HA       VAL 135  -6.188  12.436  12.436
 1077    HB   VAL 135           HB       VAL 135  -4.053  14.091  14.091
 1078   1HG1  VAL 135          2HG1      VAL 135  -4.184  15.282  15.282
 1079   2HG1  VAL 135          1HG1      VAL 135  -5.875  15.657  15.657
 1080   3HG1  VAL 135          3HG1      VAL 135  -4.604  16.326  16.326
 1081   1HG2  VAL 135          1HG2      VAL 135  -6.331  13.549  13.549
 1082   2HG2  VAL 135          3HG2      VAL 135  -5.703  15.177  15.177
 1083   3HG2  VAL 135          2HG2      VAL 135  -6.956  14.896  14.896
 1084    H    ARG 136           H        ARG 136  -7.705  13.133  13.133
 1085    HA   ARG 136           HA       ARG 136  -7.194  12.630  12.630
 1086   1HB   ARG 136          2HB       ARG 136  -9.339  13.770  13.770
 1087   2HB   ARG 136          1HB       ARG 136  -9.128  14.687  14.687
 1088   1HG   ARG 136          2HG       ARG 136  -9.577  12.876  12.876
 1089   2HG   ARG 136          1HG       ARG 136  -9.060  11.705  11.705
 1090   1HD   ARG 136          2HD       ARG 136 -11.635  13.305  13.305
 1091   2HD   ARG 136          1HD       ARG 136 -11.466  11.556  11.556
 1092    HE   ARG 136           HE       ARG 136 -10.284  12.158  12.158
 1093   1HH1  ARG 136          2HH1      ARG 136 -13.170  11.046  11.046
 1094   2HH1  ARG 136          1HH1      ARG 136 -14.141  11.778  11.778
 1095   1HH2  ARG 136          1HH2      ARG 136 -11.597  13.835  13.835
 1096   2HH2  ARG 136          2HH2      ARG 136 -13.249  13.357  13.357
 1097    H    GLU 137           HN       GLU 137  -6.105  13.581  13.581
 1098    HA   GLU 137           HA       GLU 137  -4.623  15.076  15.076
 1099   1HB   GLU 137          2HB       GLU 137  -7.071  15.776  15.776
 1100   2HB   GLU 137          1HB       GLU 137  -6.706  17.134  17.134
 1101   1HG   GLU 137          2HG       GLU 137  -4.667  17.578  17.578
 1102   2HG   GLU 137          1HG       GLU 137  -5.306  16.385  16.385

  Start of MODEL   14
    1   1H    PRO   1          1H        PRO   1 -16.425   6.878   6.878
    2   2H    PRO   1          2H        PRO   1 -16.086   6.041   6.041
    3    HA   PRO   1           HA       PRO   1 -16.804   4.142   4.142
    4   1HB   PRO   1          2HB       PRO   1 -19.379   4.831   4.831
    5   2HB   PRO   1          1HB       PRO   1 -19.014   3.981   3.981
    6   1HG   PRO   1          2HG       PRO   1 -19.970   6.660   6.660
    7   2HG   PRO   1          1HG       PRO   1 -19.601   5.805   5.805
    8   1HD   PRO   1          1HD       PRO   1 -18.115   7.923   7.923
    9   2HD   PRO   1          2HD       PRO   1 -17.754   7.068   7.068
   10    H    ASN   2           H        ASN   2 -15.265   5.773   5.773
   11    HA   ASN   2           HA       ASN   2 -15.806   4.515   4.515
   12   1HB   ASN   2          2HB       ASN   2 -16.818   7.265   7.265
   13   2HB   ASN   2          1HB       ASN   2 -15.933   7.031   7.031
   14   1HD2  ASN   2          2HD2      ASN   2 -19.701   5.704   5.704
   15   2HD2  ASN   2          1HD2      ASN   2 -19.010   6.766   6.766
   16    H    PHE   3           H        PHE   3 -13.880   4.289   4.289
   17    HA   PHE   3           HA       PHE   3 -11.598   5.947   5.947
   18   1HB   PHE   3          2HB       PHE   3 -11.719   3.368   3.368
   19   2HB   PHE   3          1HB       PHE   3 -10.244   4.178   4.178
   20    HD1  PHE   3           HD1      PHE   3 -13.449   3.062   3.062
   21    HD2  PHE   3           HD2      PHE   3  -9.158   3.239   3.239
   22    HE1  PHE   3           HE1      PHE   3 -13.485   1.845   1.845
   23    HE2  PHE   3           HE2      PHE   3  -9.201   1.996   1.996
   24    HZ   PHE   3           HZ       PHE   3 -11.367   1.300   1.300
   25    H    SER   4           H        SER   4 -13.793   5.640   5.640
   26    HA   SER   4           HA       SER   4 -12.101   6.179   6.179
   27   1HB   SER   4          2HB       SER   4 -14.854   7.311   7.311
   28   2HB   SER   4          1HB       SER   4 -14.027   6.334   6.334
   29    HG   SER   4           HG       SER   4 -15.763   5.554   5.554
   30    H    GLY   5           H        GLY   5 -10.882   7.911   7.911
   31   1HA   GLY   5          2HA       GLY   5 -11.681  10.519  10.519
   32   2HA   GLY   5          1HA       GLY   5 -11.307  10.442  10.442
   33    H    ASN   6           H        ASN   6  -9.602  12.061  12.061
   34    HA   ASN   6           HA       ASN   6  -7.245  10.610  10.610
   35   1HB   ASN   6          2HB       ASN   6  -8.015  13.522  13.522
   36   2HB   ASN   6          1HB       ASN   6  -6.315  13.079  13.079
   37   1HD2  ASN   6          2HD2      ASN   6  -7.013  11.511  11.511
   38   2HD2  ASN   6          1HD2      ASN   6  -6.313  11.027  11.027
   39    H    TRP   7           H        TRP   7  -5.116  11.296  11.296
   40    HA   TRP   7           HA       TRP   7  -5.622  11.761  11.761
   41   1HB   TRP   7          2HB       TRP   7  -4.441   9.210   9.210
   42   2HB   TRP   7          1HB       TRP   7  -4.405   9.655   9.655
   43    HD1  TRP   7           HD1      TRP   7  -6.617   8.189   8.189
   44    HE1  TRP   7           HE1      TRP   7  -8.987   7.775   7.775
   45    HE3  TRP   7           HE3      TRP   7  -6.182  10.702  10.702
   46    HZ2  TRP   7           HZ2      TRP   7 -10.491   8.472   8.472
   47    HZ3  TRP   7           HZ3      TRP   7  -8.091  10.857  10.857
   48    HH2  TRP   7           HH2      TRP   7 -10.224   9.740   9.740
   49    H    LYS   8           H        LYS   8  -4.127  13.093  13.093
   50    HA   LYS   8           HA       LYS   8  -1.396  12.994  12.994
   51   1HB   LYS   8          2HB       LYS   8  -2.883  15.343  15.343
   52   2HB   LYS   8          1HB       LYS   8  -1.195  15.384  15.384
   53   1HG   LYS   8          2HG       LYS   8  -2.179  14.487  14.487
   54   2HG   LYS   8          1HG       LYS   8  -3.675  15.202  15.202
   55   1HD   LYS   8          2HD       LYS   8  -2.756  17.022  17.022
   56   2HD   LYS   8          1HD       LYS   8  -2.103  17.269  17.269
   57   1HE   LYS   8          2HE       LYS   8  -0.228  17.491  17.491
   58   2HE   LYS   8          1HE       LYS   8  -0.096  15.859  15.859
   59   1HZ   LYS   8          1HZ       LYS   8  -1.335  16.546  16.546
   60   2HZ   LYS   8          3HZ       LYS   8   0.234  15.935  15.935
   61   3HZ   LYS   8          2HZ       LYS   8  -1.106  14.983  14.983
   62    H    ILE   9           H        ILE   9  -0.132  11.952  11.952
   63    HA   ILE   9           HA       ILE   9  -0.648  11.281  11.281
   64    HB   ILE   9           HB       ILE   9   1.068  10.217  10.217
   65   1HG1  ILE   9          2HG1      ILE   9   2.293  11.622  11.622
   66   2HG1  ILE   9          1HG1      ILE   9   1.348  10.135  10.135
   67   1HG2  ILE   9          2HG2      ILE   9   1.988  12.990  12.990
   68   2HG2  ILE   9          1HG2      ILE   9   3.298  11.865  11.865
   69   3HG2  ILE   9          3HG2      ILE   9   2.256  11.598  11.598
   70   1HD1  ILE   9          1HD1      ILE   9   3.899  10.437  10.437
   71   2HD1  ILE   9          3HD1      ILE   9   3.851   9.776   9.776
   72   3HD1  ILE   9          2HD1      ILE   9   3.014   8.946   8.946
   73    H    ILE  10           H        ILE  10   0.255  12.013  12.013
   74    HA   ILE  10           HA       ILE  10   1.080  14.878  14.878
   75    HB   ILE  10           HB       ILE  10  -0.248  15.167  15.167
   76   1HG1  ILE  10          2HG1      ILE  10  -2.088  13.150  13.150
   77   2HG1  ILE  10          1HG1      ILE  10  -0.646  12.255  12.255
   78   1HG2  ILE  10          3HG2      ILE  10  -1.614  14.256  14.256
   79   2HG2  ILE  10          2HG2      ILE  10  -2.551  14.825  14.825
   80   3HG2  ILE  10          1HG2      ILE  10  -1.390  15.898  15.898
   81   1HD1  ILE  10          3HD1      ILE  10   0.521  13.566  13.566
   82   2HD1  ILE  10          2HD1      ILE  10  -1.120  13.872  13.872
   83   3HD1  ILE  10          1HD1      ILE  10  -0.532  12.216  12.216
   84    H    ARG  11           H        ARG  11   1.244  11.656  11.656
   85    HA   ARG  11           HA       ARG  11   3.872  12.389  12.389
   86   1HB   ARG  11          2HB       ARG  11   1.432  11.743  11.743
   87   2HB   ARG  11          1HB       ARG  11   2.915  10.933  10.933
   88   1HG   ARG  11          2HG       ARG  11   4.043  12.996  12.996
   89   2HG   ARG  11          1HG       ARG  11   2.811  13.911  13.911
   90   1HD   ARG  11          2HD       ARG  11   1.156  13.309  13.309
   91   2HD   ARG  11          1HD       ARG  11   2.426  12.464  12.464
   92    HE   ARG  11           HE       ARG  11   3.175  15.204  15.204
   93   1HH1  ARG  11          1HH2      ARG  11   4.050  14.327  14.327
   94   2HH1  ARG  11          2HH2      ARG  11   2.860  14.881  14.881
   95   1HH2  ARG  11          2HH1      ARG  11   0.432  15.419  15.419
   96   2HH2  ARG  11          1HH1      ARG  11   0.811  15.499  15.499
   97    H    SER  12           H        SER  12   4.937  10.291  10.291
   98    HA   SER  12           HA       SER  12   3.991   7.709   7.709
   99   1HB   SER  12          2HB       SER  12   4.168   8.264   8.264
  100   2HB   SER  12          1HB       SER  12   5.642   9.191   9.191
  101    HG   SER  12           HG       SER  12   6.787   7.366   7.366
  102    H    GLU  13           H        GLU  13   5.613   6.075   6.075
  103    HA   GLU  13           HA       GLU  13   8.269   6.943   6.943
  104   1HB   GLU  13          2HB       GLU  13   7.910   5.746   5.746
  105   2HB   GLU  13          1HB       GLU  13   7.006   7.249   7.249
  106   1HG   GLU  13          2HG       GLU  13   5.614   4.822   4.822
  107   2HG   GLU  13          1HG       GLU  13   5.877   4.891   4.891
  108    H    ASN  14           H        ASN  14   9.520   4.911   4.911
  109    HA   ASN  14           HA       ASN  14  10.391   2.796   2.796
  110   1HB   ASN  14          2HB       ASN  14   7.571   2.037   2.037
  111   2HB   ASN  14          1HB       ASN  14   8.861   0.980   0.980
  112   1HD2  ASN  14          2HD2      ASN  14   6.433   2.536   2.536
  113   2HD2  ASN  14          1HD2      ASN  14   6.081   2.466   2.466
  114    H    PHE  15           H        PHE  15  10.025   4.896   4.896
  115    HA   PHE  15           HA       PHE  15   9.280   3.576   3.576
  116   1HB   PHE  15          2HB       PHE  15   9.609   6.118   6.118
  117   2HB   PHE  15          1HB       PHE  15  11.325   5.796   5.796
  118    HD1  PHE  15           HD2      PHE  15  11.814   4.199   4.199
  119    HD2  PHE  15           HD1      PHE  15   8.356   6.692   6.692
  120    HE1  PHE  15           HE2      PHE  15  11.402   4.151   4.151
  121    HE2  PHE  15           HE1      PHE  15   7.961   6.639   6.639
  122    HZ   PHE  15           HZ       PHE  15   9.475   5.355   5.355
  123    H    GLU  16           H        GLU  16  12.546   4.522   4.522
  124    HA   GLU  16           HA       GLU  16  13.952   2.904   2.904
  125   1HB   GLU  16          2HB       GLU  16  14.715   4.766   4.766
  126   2HB   GLU  16          1HB       GLU  16  15.148   3.320   3.320
  127   1HG   GLU  16          2HG       GLU  16  16.351   2.502   2.502
  128   2HG   GLU  16          1HG       GLU  16  16.106   4.113   4.113
  129    H    GLU  17           H        GLU  17  12.470   2.124   2.124
  130    HA   GLU  17           HA       GLU  17  13.841  -0.336  -0.336
  131   1HB   GLU  17          2HB       GLU  17  11.077   0.575   0.575
  132   2HB   GLU  17          1HB       GLU  17  11.944  -0.791  -0.791
  133   1HG   GLU  17          2HG       GLU  17  13.859   1.025   1.025
  134   2HG   GLU  17          1HG       GLU  17  12.486   2.132   2.132
  135    H    LEU  18           H        LEU  18  10.929   0.468   0.468
  136    HA   LEU  18           HA       LEU  18  10.355  -2.328  -2.328
  137   1HB   LEU  18          2HB       LEU  18   8.537  -0.639  -0.639
  138   2HB   LEU  18          1HB       LEU  18   9.136   0.210   0.210
  139    HG   LEU  18           HG       LEU  18   8.768  -1.867  -1.867
  140   1HD1  LEU  18          1HD1      LEU  18   7.975  -2.845  -2.845
  141   2HD1  LEU  18          3HD1      LEU  18   7.053  -3.434  -3.434
  142   3HD1  LEU  18          2HD1      LEU  18   8.794  -3.701  -3.701
  143   1HD2  LEU  18          2HD2      LEU  18   6.985   0.033   0.033
  144   2HD2  LEU  18          1HD2      LEU  18   6.546  -1.368  -1.368
  145   3HD2  LEU  18          3HD2      LEU  18   6.155  -1.335  -1.335
  146    H    LEU  19           H        LEU  19  12.382   0.121   0.121
  147    HA   LEU  19           HA       LEU  19  12.311  -1.008  -1.008
  148   1HB   LEU  19          2HB       LEU  19  13.756   1.319   1.319
  149   2HB   LEU  19          1HB       LEU  19  14.130   0.789   0.789
  150    HG   LEU  19           HG       LEU  19  12.270   2.685   2.685
  151   1HD1  LEU  19          1HD1      LEU  19  13.213   2.118   2.118
  152   2HD1  LEU  19          3HD1      LEU  19  12.112   0.746   0.746
  153   3HD1  LEU  19          2HD1      LEU  19  11.472   2.388   2.388
  154   1HD2  LEU  19          3HD2      LEU  19  10.676   0.127   0.127
  155   2HD2  LEU  19          2HD2      LEU  19  10.687   1.110   1.110
  156   3HD2  LEU  19          1HD2      LEU  19  10.014   1.760   1.760
  157    H    LYS  20           H        LYS  20  14.109  -1.250  -1.250
  158    HA   LYS  20           HA       LYS  20  16.482  -2.449  -2.449
  159   1HB   LYS  20          2HB       LYS  20  15.704  -2.566  -2.566
  160   2HB   LYS  20          1HB       LYS  20  17.312  -2.769  -2.769
  161   1HG   LYS  20          2HG       LYS  20  16.209  -0.226  -0.226
  162   2HG   LYS  20          1HG       LYS  20  16.118  -0.374  -0.374
  163   1HD   LYS  20          2HD       LYS  20  18.622  -0.846  -0.846
  164   2HD   LYS  20          1HD       LYS  20  18.270   0.623   0.623
  165   1HE   LYS  20          2HE       LYS  20  17.982  -0.952  -0.952
  166   2HE   LYS  20          1HE       LYS  20  18.822  -2.150  -2.150
  167   1HZ   LYS  20          2HZ       LYS  20  19.903   0.571   0.571
  168   2HZ   LYS  20          1HZ       LYS  20  20.235  -0.701  -0.701
  169   3HZ   LYS  20          3HZ       LYS  20  20.719  -0.815  -0.815
  170    H    VAL  21           H        VAL  21  13.445  -3.429  -3.429
  171    HA   VAL  21           HA       VAL  21  14.147  -6.256  -6.256
  172    HB   VAL  21           HB       VAL  21  12.453  -5.149  -5.149
  173   1HG1  VAL  21          3HG1      VAL  21  11.481  -3.693  -3.693
  174   2HG1  VAL  21          2HG1      VAL  21  10.697  -5.111  -5.111
  175   3HG1  VAL  21          1HG1      VAL  21  10.274  -4.560  -4.560
  176   1HG2  VAL  21          1HG2      VAL  21  11.702  -7.467  -7.467
  177   2HG2  VAL  21          3HG2      VAL  21  12.270  -7.502  -7.502
  178   3HG2  VAL  21          2HG2      VAL  21  10.637  -6.943  -6.943
  179    H    LEU  22           H        LEU  22  12.312  -4.160  -4.160
  180    HA   LEU  22           HA       LEU  22  11.352  -6.139  -6.139
  181   1HB   LEU  22          2HB       LEU  22  11.634  -3.193  -3.193
  182   2HB   LEU  22          1HB       LEU  22  11.629  -3.831  -3.831
  183    HG   LEU  22           HG       LEU  22   9.467  -4.849  -4.849
  184   1HD1  LEU  22          3HD1      LEU  22   9.880  -5.529  -5.529
  185   2HD1  LEU  22          2HD1      LEU  22   9.546  -3.866  -3.866
  186   3HD1  LEU  22          1HD1      LEU  22   8.288  -4.835  -4.835
  187   1HD2  LEU  22          1HD2      LEU  22   9.887  -2.003  -2.003
  188   2HD2  LEU  22          3HD2      LEU  22   8.996  -2.670  -2.670
  189   3HD2  LEU  22          2HD2      LEU  22   8.271  -2.667  -2.667
  190    H    GLY  23           H        GLY  23  14.034  -3.861  -3.861
  191   1HA   GLY  23          2HA       GLY  23  15.277  -5.450  -5.450
  192   2HA   GLY  23          1HA       GLY  23  15.653  -3.769  -3.769
  193    H    VAL  24           H        VAL  24  17.855  -4.077  -4.077
  194    HA   VAL  24           HA       VAL  24  18.725  -5.165  -5.165
  195    HB   VAL  24           HB       VAL  24  20.508  -6.583  -6.583
  196   1HG1  VAL  24          1HG1      VAL  24  18.288  -7.459  -7.459
  197   2HG1  VAL  24          3HG1      VAL  24  17.715  -7.440  -7.440
  198   3HG1  VAL  24          2HG1      VAL  24  19.070  -8.473  -8.473
  199   1HG2  VAL  24          2HG2      VAL  24  18.861  -5.929  -5.929
  200   2HG2  VAL  24          1HG2      VAL  24  20.582  -5.636  -5.636
  201   3HG2  VAL  24          3HG2      VAL  24  19.984  -7.287  -7.287
  202    H    ASN  25           H        ASN  25  19.634  -3.648  -3.648
  203    HA   ASN  25           HA       ASN  25  22.212  -2.717  -2.717
  204   1HB   ASN  25          2HB       ASN  25  20.655  -2.535  -2.535
  205   2HB   ASN  25          1HB       ASN  25  20.463  -0.908  -0.908
  206   1HD2  ASN  25          2HD2      ASN  25  23.669   0.106   0.106
  207   2HD2  ASN  25          1HD2      ASN  25  22.157   0.554   0.554
  208    H    VAL  26           H        VAL  26  22.294   0.008   0.008
  209    HA   VAL  26           HA       VAL  26  20.732   0.815   0.815
  210    HB   VAL  26           HB       VAL  26  22.722   2.412   2.412
  211   1HG1  VAL  26          2HG1      VAL  26  22.095  -0.003  -0.003
  212   2HG1  VAL  26          1HG1      VAL  26  23.682  -0.376  -0.376
  213   3HG1  VAL  26          3HG1      VAL  26  23.509   0.918   0.918
  214   1HG2  VAL  26          2HG2      VAL  26  24.001   0.397   0.397
  215   2HG2  VAL  26          1HG2      VAL  26  23.839   2.130   2.130
  216   3HG2  VAL  26          3HG2      VAL  26  24.891   1.541   1.541
  217    H    MET  27           H        MET  27  22.278   1.997   1.997
  218    HA   MET  27           HA       MET  27  21.113   4.638   4.638
  219   1HB   MET  27          2HB       MET  27  23.108   3.984   3.984
  220   2HB   MET  27          1HB       MET  27  21.989   3.154   3.154
  221   1HG   MET  27          2HG       MET  27  20.888   5.180   5.180
  222   2HG   MET  27          1HG       MET  27  21.632   6.060   6.060
  223   1HE   MET  27          1HE       MET  27  21.363   5.368   5.368
  224   2HE   MET  27          3HE       MET  27  22.862   5.775   5.775
  225   3HE   MET  27          2HE       MET  27  22.630   4.159   4.159
  226    H    LEU  28           H        LEU  28  19.949   1.534   1.534
  227    HA   LEU  28           HA       LEU  28  17.863   2.335   2.335
  228   1HB   LEU  28          2HB       LEU  28  18.703  -0.055  -0.055
  229   2HB   LEU  28          1HB       LEU  28  16.971   0.028   0.028
  230    HG   LEU  28           HG       LEU  28  18.105  -1.157  -1.157
  231   1HD1  LEU  28          1HD1      LEU  28  16.180   0.706   0.706
  232   2HD1  LEU  28          3HD1      LEU  28  17.423   1.429   1.429
  233   3HD1  LEU  28          2HD1      LEU  28  16.833  -0.196  -0.196
  234   1HD2  LEU  28          2HD2      LEU  28  20.230   0.350   0.350
  235   2HD2  LEU  28          1HD2      LEU  28  19.877  -0.266  -0.266
  236   3HD2  LEU  28          3HD2      LEU  28  19.464   1.397   1.397
  237    H    ARG  29           H        ARG  29  18.031   2.196   2.196
  238    HA   ARG  29           HA       ARG  29  15.129   2.551   2.551
  239   1HB   ARG  29          2HB       ARG  29  17.159   2.877   2.877
  240   2HB   ARG  29          1HB       ARG  29  15.462   2.433   2.433
  241   1HG   ARG  29          2HG       ARG  29  16.067   0.261   0.261
  242   2HG   ARG  29          1HG       ARG  29  16.625   0.498   0.498
  243   1HD   ARG  29          2HD       ARG  29  18.375  -0.420  -0.420
  244   2HD   ARG  29          1HD       ARG  29  18.840   1.064   1.064
  245    HE   ARG  29           HE       ARG  29  17.646   1.340   1.340
  246   1HH1  ARG  29          2HH1      ARG  29  19.063   3.602   3.602
  247   2HH1  ARG  29          1HH1      ARG  29  20.636   3.524   3.524
  248   1HH2  ARG  29          1HH2      ARG  29  20.253   0.268   0.268
  249   2HH2  ARG  29          2HH2      ARG  29  21.308   1.638   1.638
  250    H    LYS  30           H        LYS  30  18.030   4.564   4.564
  251    HA   LYS  30           HA       LYS  30  16.635   6.829   6.829
  252   1HB   LYS  30          2HB       LYS  30  18.675   8.068   8.068
  253   2HB   LYS  30          1HB       LYS  30  19.100   6.478   6.478
  254   1HG   LYS  30          2HG       LYS  30  20.465   6.337   6.337
  255   2HG   LYS  30          1HG       LYS  30  18.990   6.041   6.041
  256   1HD   LYS  30          2HD       LYS  30  19.401   7.924   7.924
  257   2HD   LYS  30          1HD       LYS  30  19.132   8.847   8.847
  258   1HE   LYS  30          2HE       LYS  30  21.501   8.647   8.647
  259   2HE   LYS  30          1HE       LYS  30  21.791   7.646   7.646
  260   1HZ   LYS  30          2HZ       LYS  30  20.997   9.529   9.529
  261   2HZ   LYS  30          1HZ       LYS  30  20.921  10.483  10.483
  262   3HZ   LYS  30          3HZ       LYS  30  22.414   9.882   9.882
  263    H    ILE  31           H        ILE  31  17.037   5.662   5.662
  264    HA   ILE  31           HA       ILE  31  16.280   8.210   8.210
  265    HB   ILE  31           HB       ILE  31  16.437   5.384   5.384
  266   1HG1  ILE  31          2HG1      ILE  31  18.323   7.723   7.723
  267   2HG1  ILE  31          1HG1      ILE  31  18.574   6.478   6.478
  268   1HG2  ILE  31          2HG2      ILE  31  15.730   8.042   8.042
  269   2HG2  ILE  31          1HG2      ILE  31  16.673   6.911   6.911
  270   3HG2  ILE  31          3HG2      ILE  31  15.084   6.442   6.442
  271   1HD1  ILE  31          3HD1      ILE  31  18.034   5.585   5.585
  272   2HD1  ILE  31          2HD1      ILE  31  19.627   6.255   6.255
  273   3HD1  ILE  31          1HD1      ILE  31  19.047   4.842   4.842
  274    H    ALA  32           H        ALA  32  14.686   5.342   5.342
  275    HA   ALA  32           HA       ALA  32  12.137   5.913   5.913
  276   1HB   ALA  32          1HB       ALA  32  12.862   3.983   3.983
  277   2HB   ALA  32          3HB       ALA  32  11.317   4.021   4.021
  278   3HB   ALA  32          2HB       ALA  32  12.792   3.595   3.595
  279    H    VAL  33           H        VAL  33  13.717   6.721   6.721
  280    HA   VAL  33           HA       VAL  33  11.241   7.497   7.497
  281    HB   VAL  33           HB       VAL  33  14.002   8.395   8.395
  282   1HG1  VAL  33          1HG1      VAL  33  11.851   9.083   9.083
  283   2HG1  VAL  33          3HG1      VAL  33  11.666   7.395   7.395
  284   3HG1  VAL  33          2HG1      VAL  33  13.060   8.320   8.320
  285   1HG2  VAL  33          2HG2      VAL  33  13.157   5.621   5.621
  286   2HG2  VAL  33          1HG2      VAL  33  14.737   6.258   6.258
  287   3HG2  VAL  33          3HG2      VAL  33  13.511   5.977   5.977
  288    H    ALA  34           H        ALA  34  14.090   9.096   9.096
  289    HA   ALA  34           HA       ALA  34  13.209  11.784  11.784
  290   1HB   ALA  34          3HB       ALA  34  15.525  10.699  10.699
  291   2HB   ALA  34          2HB       ALA  34  14.834  11.038  11.038
  292   3HB   ALA  34          1HB       ALA  34  15.081  12.350  12.350
  293    H    ALA  35           H        ALA  35  12.889   9.469   9.469
  294    HA   ALA  35           HA       ALA  35  11.458  11.152  11.152
  295   1HB   ALA  35          1HB       ALA  35  11.455   8.136   8.136
  296   2HB   ALA  35          3HB       ALA  35  10.746   8.960   8.960
  297   3HB   ALA  35          2HB       ALA  35  12.485   9.043   9.043
  298    H    ALA  36           H        ALA  36  10.435   8.821   8.821
  299    HA   ALA  36           HA       ALA  36   7.600   9.473   9.473
  300   1HB   ALA  36          2HB       ALA  36   8.366   7.160   7.160
  301   2HB   ALA  36          1HB       ALA  36   9.037   7.733   7.733
  302   3HB   ALA  36          3HB       ALA  36   7.296   7.780   7.780
  303    H    SER  37           H        SER  37   9.179  11.776  11.776
  304    HA   SER  37           HA       SER  37   9.161  12.175  12.175
  305   1HB   SER  37          2HB       SER  37   9.028  14.674  14.674
  306   2HB   SER  37          1HB       SER  37  10.461  13.743  13.743
  307    HG   SER  37           HG       SER  37   9.693  14.792  14.792
  308    H    LYS  38           H        LYS  38   6.930  13.267  13.267
  309    HA   LYS  38           HA       LYS  38   4.668  12.991  12.991
  310   1HB   LYS  38          2HB       LYS  38   5.039  15.416  15.416
  311   2HB   LYS  38          1HB       LYS  38   3.756  15.160  15.160
  312   1HG   LYS  38          2HG       LYS  38   6.689  15.274  15.274
  313   2HG   LYS  38          1HG       LYS  38   5.630  16.683  16.683
  314   1HD   LYS  38          2HD       LYS  38   4.475  15.948  15.948
  315   2HD   LYS  38          1HD       LYS  38   4.628  14.251  14.251
  316   1HE   LYS  38          2HE       LYS  38   6.080  14.310  14.310
  317   2HE   LYS  38          1HE       LYS  38   7.199  14.705  14.705
  318   1HZ   LYS  38          2HZ       LYS  38   6.524  17.110  17.110
  319   2HZ   LYS  38          1HZ       LYS  38   5.945  16.511  16.511
  320   3HZ   LYS  38          3HZ       LYS  38   7.586  16.344  16.344
  321    HA   PRO  39           HA       PRO  39   4.114  11.210  11.210
  322   1HB   PRO  39          2HB       PRO  39   3.368   8.702   8.702
  323   2HB   PRO  39          1HB       PRO  39   5.037   9.183   9.183
  324   1HG   PRO  39          2HG       PRO  39   3.693   8.791   8.791
  325   2HG   PRO  39          1HG       PRO  39   5.401   8.598   8.598
  326   1HD   PRO  39          2HD       PRO  39   4.313  10.809  10.809
  327   2HD   PRO  39          1HD       PRO  39   5.889  10.772  10.772
  328    H    ALA  40           H        ALA  40   2.117  10.911  10.911
  329    HA   ALA  40           HA       ALA  40  -0.257  11.590  11.590
  330   1HB   ALA  40          3HB       ALA  40   0.494  11.806  11.806
  331   2HB   ALA  40          2HB       ALA  40  -1.213  11.558  11.558
  332   3HB   ALA  40          1HB       ALA  40  -0.364  12.956  12.956
  333    H    VAL  41           H        VAL  41  -2.330  10.428  10.428
  334    HA   VAL  41           HA       VAL  41  -1.948   7.674   7.674
  335    HB   VAL  41           HB       VAL  41  -2.654   8.411   8.411
  336   1HG1  VAL  41          3HG1      VAL  41  -3.309   5.799   5.799
  337   2HG1  VAL  41          2HG1      VAL  41  -3.394   6.059   6.059
  338   3HG1  VAL  41          1HG1      VAL  41  -4.476   6.942   6.942
  339   1HG2  VAL  41          1HG2      VAL  41  -0.732   6.527   6.527
  340   2HG2  VAL  41          3HG2      VAL  41  -0.364   7.873   7.873
  341   3HG2  VAL  41          2HG2      VAL  41  -1.100   6.404   6.404
  342    H    GLU  42           H        GLU  42  -4.160   6.614   6.614
  343    HA   GLU  42           HA       GLU  42  -6.474   8.435   8.435
  344   1HB   GLU  42          2HB       GLU  42  -5.394   9.025   9.025
  345   2HB   GLU  42          1HB       GLU  42  -5.376   7.318   7.318
  346   1HG   GLU  42          2HG       GLU  42  -7.851   7.290   7.290
  347   2HG   GLU  42          1HG       GLU  42  -7.859   8.990   8.990
  348    H    ILE  43           H        ILE  43  -7.919   7.111   7.111
  349    HA   ILE  43           HA       ILE  43  -7.875   4.220   4.220
  350    HB   ILE  43           HB       ILE  43  -9.019   5.779   5.779
  351   1HG1  ILE  43          2HG1      ILE  43  -7.622   3.680   3.680
  352   2HG1  ILE  43          1HG1      ILE  43  -6.772   3.908   3.908
  353   1HG2  ILE  43          1HG2      ILE  43  -9.795   3.070   3.070
  354   2HG2  ILE  43          3HG2      ILE  43  -9.573   3.266   3.266
  355   3HG2  ILE  43          2HG2      ILE  43 -10.753   4.259   4.259
  356   1HD1  ILE  43          1HD1      ILE  43  -7.344   6.146   6.146
  357   2HD1  ILE  43          3HD1      ILE  43  -5.827   5.248   5.248
  358   3HD1  ILE  43          2HD1      ILE  43  -6.320   6.222   6.222
  359    H    LYS  44           H        LYS  44  -9.623   3.201   3.201
  360    HA   LYS  44           HA       LYS  44 -11.946   4.899   4.899
  361   1HB   LYS  44          2HB       LYS  44 -11.332   2.390   2.390
  362   2HB   LYS  44          1HB       LYS  44 -12.003   3.906   3.906
  363   1HG   LYS  44          2HG       LYS  44  -9.767   4.951   4.951
  364   2HG   LYS  44          1HG       LYS  44  -9.086   3.469   3.469
  365   1HD   LYS  44          2HD       LYS  44  -9.561   2.260   2.260
  366   2HD   LYS  44          1HD       LYS  44 -10.524   3.594   3.594
  367   1HE   LYS  44          2HE       LYS  44  -8.510   5.025   5.025
  368   2HE   LYS  44          1HE       LYS  44  -7.547   3.684   3.684
  369   1HZ   LYS  44          3HZ       LYS  44  -9.154   3.439   3.439
  370   2HZ   LYS  44          2HZ       LYS  44  -7.564   4.036   4.036
  371   3HZ   LYS  44          1HZ       LYS  44  -7.874   2.459   2.459
  372    H    GLN  45           H        GLN  45 -13.145   4.313   4.313
  373    HA   GLN  45           HA       GLN  45 -13.500   1.420   1.420
  374   1HB   GLN  45          2HB       GLN  45 -13.287   2.192   2.192
  375   2HB   GLN  45          1HB       GLN  45 -13.508   3.854   3.854
  376   1HG   GLN  45          2HG       GLN  45 -15.270   3.450   3.450
  377   2HG   GLN  45          1HG       GLN  45 -16.053   3.306   3.306
  378   1HE2  GLN  45          2HE2      GLN  45 -16.439   0.264   0.264
  379   2HE2  GLN  45          1HE2      GLN  45 -16.254   1.894   1.894
  380    H    GLU  46           H        GLU  46 -15.233   0.349   0.349
  381    HA   GLU  46           HA       GLU  46 -17.771   1.833   1.833
  382   1HB   GLU  46          2HB       GLU  46 -16.362  -0.055  -0.055
  383   2HB   GLU  46          1HB       GLU  46 -18.090   0.276   0.276
  384   1HG   GLU  46          2HG       GLU  46 -17.397   1.987   1.987
  385   2HG   GLU  46          1HG       GLU  46 -17.132   2.812   2.812
  386    H    GLY  47           H        GLY  47 -17.795   0.708   0.708
  387   1HA   GLY  47          2HA       GLY  47 -19.271  -0.833  -0.833
  388   2HA   GLY  47          1HA       GLY  47 -19.266  -1.850  -1.850
  389    H    ASP  48           H        ASP  48 -18.385  -3.784  -3.784
  390    HA   ASP  48           HA       ASP  48 -16.314  -3.979  -3.979
  391   1HB   ASP  48          2HB       ASP  48 -16.178  -6.395  -6.395
  392   2HB   ASP  48          1HB       ASP  48 -17.693  -5.902  -5.902
  393    H    THR  49           H        THR  49 -16.118  -2.974  -2.974
  394    HA   THR  49           HA       THR  49 -13.516  -4.293  -4.293
  395    HB   THR  49           HB       THR  49 -15.390  -2.616  -2.616
  396    HG1  THR  49           HG1      THR  49 -15.939  -4.719  -4.719
  397   1HG2  THR  49          3HG2      THR  49 -12.494  -3.163  -3.163
  398   2HG2  THR  49          2HG2      THR  49 -13.541  -3.377  -3.377
  399   3HG2  THR  49          1HG2      THR  49 -13.478  -1.818  -1.818
  400    H    PHE  50           H        PHE  50 -11.621  -3.188  -3.188
  401    HA   PHE  50           HA       PHE  50 -11.803  -0.233  -0.233
  402   1HB   PHE  50          2HB       PHE  50 -10.236  -2.180  -2.180
  403   2HB   PHE  50          1HB       PHE  50 -10.091  -0.423  -0.423
  404    HD1  PHE  50           HD2      PHE  50 -11.932   0.957   0.957
  405    HD2  PHE  50           HD1      PHE  50 -12.243  -3.312  -3.312
  406    HE1  PHE  50           HE2      PHE  50 -13.979   1.038   1.038
  407    HE2  PHE  50           HE1      PHE  50 -14.297  -3.235  -3.235
  408    HZ   PHE  50           HZ       PHE  50 -15.173  -1.063  -1.063
  409    H    TYR  51           H        TYR  51 -10.543   0.728   0.728
  410    HA   TYR  51           HA       TYR  51  -8.251  -0.748  -0.748
  411   1HB   TYR  51          2HB       TYR  51 -10.145   0.136   0.136
  412   2HB   TYR  51          1HB       TYR  51  -9.636   1.753   1.753
  413    HD1  TYR  51           HD1      TYR  51  -7.115   2.326   2.326
  414    HD2  TYR  51           HD2      TYR  51  -9.183  -0.913  -0.913
  415    HE1  TYR  51           HE1      TYR  51  -5.422   2.324   2.324
  416    HE2  TYR  51           HE2      TYR  51  -7.490  -0.905  -0.905
  417    HH   TYR  51           HH       TYR  51  -5.811   1.113   1.113
  418    H    ILE  52           H        ILE  52  -6.227   0.380   0.380
  419    HA   ILE  52           HA       ILE  52  -5.998   2.888   2.888
  420    HB   ILE  52           HB       ILE  52  -3.736   1.032   1.032
  421   1HG1  ILE  52          2HG1      ILE  52  -5.685  -0.576  -0.576
  422   2HG1  ILE  52          1HG1      ILE  52  -4.780  -0.464  -0.464
  423   1HG2  ILE  52          3HG2      ILE  52  -4.080   3.244   3.244
  424   2HG2  ILE  52          2HG2      ILE  52  -5.452   2.552   2.552
  425   3HG2  ILE  52          1HG2      ILE  52  -3.830   1.916   1.916
  426   1HD1  ILE  52          2HD1      ILE  52  -6.901   1.495   1.495
  427   2HD1  ILE  52          1HD1      ILE  52  -7.560  -0.101  -0.101
  428   3HD1  ILE  52          3HD1      ILE  52  -6.637   0.159   0.159
  429    H    LYS  53           H        LYS  53  -4.546   4.319   4.319
  430    HA   LYS  53           HA       LYS  53  -2.703   3.183   3.183
  431   1HB   LYS  53          2HB       LYS  53  -4.915   4.125   4.125
  432   2HB   LYS  53          1HB       LYS  53  -4.284   5.707   5.707
  433   1HG   LYS  53          2HG       LYS  53  -2.124   4.485   4.485
  434   2HG   LYS  53          1HG       LYS  53  -3.515   3.966   3.966
  435   1HD   LYS  53          2HD       LYS  53  -3.336   6.847   6.847
  436   2HD   LYS  53          1HD       LYS  53  -2.304   6.272   6.272
  437   1HE   LYS  53          2HE       LYS  53  -4.189   5.538   5.538
  438   2HE   LYS  53          1HE       LYS  53  -5.285   5.759   5.759
  439   1HZ   LYS  53          2HZ       LYS  53  -3.730   8.041   8.041
  440   2HZ   LYS  53          1HZ       LYS  53  -5.144   7.562   7.562
  441   3HZ   LYS  53          3HZ       LYS  53  -5.219   8.034   8.034
  442    H    THR  54           H        THR  54  -0.781   3.749   3.749
  443    HA   THR  54           HA       THR  54  -0.566   6.449   6.449
  444    HB   THR  54           HB       THR  54   1.543   4.280   4.280
  445    HG1  THR  54           HG1      THR  54   0.567   3.443   3.443
  446   1HG2  THR  54          1HG2      THR  54   1.496   6.907   6.907
  447   2HG2  THR  54          3HG2      THR  54   1.153   5.941   5.941
  448   3HG2  THR  54          2HG2      THR  54   2.620   5.646   5.646
  449    H    SER  55           H        SER  55   1.063   7.916   7.916
  450    HA   SER  55           HA       SER  55   2.651   7.156   7.156
  451   1HB   SER  55          2HB       SER  55   1.256   9.765   9.765
  452   2HB   SER  55          1HB       SER  55   1.660   8.584   8.584
  453    HG   SER  55           HG       SER  55  -0.281   7.829   7.829
  454    H    THR  56           H        THR  56   4.663   7.707   7.707
  455    HA   THR  56           HA       THR  56   5.075  10.103  10.103
  456    HB   THR  56           HB       THR  56   7.419   9.183   9.183
  457    HG1  THR  56           HG1      THR  56   7.959   7.465   7.465
  458   1HG2  THR  56          1HG2      THR  56   4.966   8.087   8.087
  459   2HG2  THR  56          3HG2      THR  56   6.188   6.824   6.824
  460   3HG2  THR  56          2HG2      THR  56   6.533   8.278   8.278
  461    H    THR  57           H        THR  57   7.598  10.864  10.864
  462    HA   THR  57           HA       THR  57   7.184  12.527  12.527
  463    HB   THR  57           HB       THR  57   8.874  12.963  12.963
  464    HG1  THR  57           HG1      THR  57  10.508  13.591  13.591
  465   1HG2  THR  57          3HG2      THR  57   9.560  10.582  10.582
  466   2HG2  THR  57          2HG2      THR  57  10.421  10.670  10.670
  467   3HG2  THR  57          1HG2      THR  57  10.929  11.678  11.678
  468    H    VAL  58           H        VAL  58   8.802   9.348   9.348
  469    HA   VAL  58           HA       VAL  58   8.863   9.388   9.388
  470    HB   VAL  58           HB       VAL  58  10.838   8.024   8.024
  471   1HG1  VAL  58          3HG1      VAL  58  10.418   8.178   8.178
  472   2HG1  VAL  58          2HG1      VAL  58  12.086   8.279   8.279
  473   3HG1  VAL  58          1HG1      VAL  58  11.101   6.874   6.874
  474   1HG2  VAL  58          3HG2      VAL  58  10.629  10.767  10.767
  475   2HG2  VAL  58          2HG2      VAL  58  12.072   9.923   9.923
  476   3HG2  VAL  58          1HG2      VAL  58  11.840  10.238  10.238
  477    H    ARG  59           H        ARG  59   7.594   7.748   7.748
  478    HA   ARG  59           HA       ARG  59   7.344   5.234   5.234
  479   1HB   ARG  59          2HB       ARG  59   8.473   5.102   5.102
  480   2HB   ARG  59          1HB       ARG  59   6.910   5.510   5.510
  481   1HG   ARG  59          2HG       ARG  59   5.913   3.529   3.529
  482   2HG   ARG  59          1HG       ARG  59   7.085   3.281   3.281
  483   1HD   ARG  59          2HD       ARG  59   8.100   3.297   3.297
  484   2HD   ARG  59          1HD       ARG  59   7.216   1.873   1.873
  485    HE   ARG  59           HE       ARG  59   9.502   2.871   2.871
  486   1HH1  ARG  59          1HH2      ARG  59   7.898   0.246   0.246
  487   2HH1  ARG  59          2HH2      ARG  59   9.043  -0.898  -0.898
  488   1HH2  ARG  59          2HH1      ARG  59  11.027   1.509   1.509
  489   2HH2  ARG  59          1HH1      ARG  59  10.814  -0.183  -0.183
  490    H    THR  60           H        THR  60   5.245   4.037   4.037
  491    HA   THR  60           HA       THR  60   2.920   5.527   5.527
  492    HB   THR  60           HB       THR  60   3.086   4.900   4.900
  493    HG1  THR  60           HG1      THR  60   4.457   6.535   6.535
  494   1HG2  THR  60          1HG2      THR  60   0.880   5.183   5.183
  495   2HG2  THR  60          3HG2      THR  60   1.281   6.899   6.899
  496   3HG2  THR  60          2HG2      THR  60   1.027   5.995   5.995
  497    H    THR  61           H        THR  61   2.252   3.677   3.677
  498    HA   THR  61           HA       THR  61   1.875   1.172   1.172
  499    HB   THR  61           HB       THR  61   1.650   0.240   0.240
  500    HG1  THR  61           HG1      THR  61   2.780   1.433   1.433
  501   1HG2  THR  61          1HG2      THR  61   3.462  -0.112  -0.112
  502   2HG2  THR  61          3HG2      THR  61   4.420   1.010   1.010
  503   3HG2  THR  61          2HG2      THR  61   3.863  -0.507  -0.507
  504    H    GLU  62           H        GLU  62  -0.079  -0.149  -0.149
  505    HA   GLU  62           HA       GLU  62  -2.228   1.277   1.277
  506   1HB   GLU  62          2HB       GLU  62  -3.754   1.423   1.423
  507   2HB   GLU  62          1HB       GLU  62  -2.311   2.398   2.398
  508   1HG   GLU  62          2HG       GLU  62  -1.612  -0.108  -0.108
  509   2HG   GLU  62          1HG       GLU  62  -3.295   0.096   0.096
  510    H    ILE  63           H        ILE  63  -3.033  -0.382  -0.382
  511    HA   ILE  63           HA       ILE  63  -3.195  -3.103  -3.103
  512    HB   ILE  63           HB       ILE  63  -3.428  -3.969  -3.969
  513   1HG1  ILE  63          2HG1      ILE  63  -3.542  -1.071  -1.071
  514   2HG1  ILE  63          1HG1      ILE  63  -4.902  -2.190  -2.190
  515   1HG2  ILE  63          1HG2      ILE  63  -1.157  -3.312  -3.312
  516   2HG2  ILE  63          3HG2      ILE  63  -1.355  -1.763  -1.763
  517   3HG2  ILE  63          2HG2      ILE  63  -1.317  -3.257  -3.257
  518   1HD1  ILE  63          1HD1      ILE  63  -2.795  -3.510  -3.510
  519   2HD1  ILE  63          3HD1      ILE  63  -2.901  -1.877  -1.877
  520   3HD1  ILE  63          2HD1      ILE  63  -4.320  -2.924  -2.924
  521    H    ASN  64           H        ASN  64  -5.276  -4.347  -4.347
  522    HA   ASN  64           HA       ASN  64  -7.647  -2.737  -2.737
  523   1HB   ASN  64          2HB       ASN  64  -8.752  -2.974  -2.974
  524   2HB   ASN  64          1HB       ASN  64  -7.147  -2.332  -2.332
  525   1HD2  ASN  64          2HD2      ASN  64  -8.102  -6.094  -6.094
  526   2HD2  ASN  64          1HD2      ASN  64  -9.081  -5.297  -5.297
  527    H    PHE  65           H        PHE  65  -9.255  -4.047  -4.047
  528    HA   PHE  65           HA       PHE  65  -9.377  -6.917  -6.917
  529   1HB   PHE  65          2HB       PHE  65  -8.712  -7.694  -7.694
  530   2HB   PHE  65          1HB       PHE  65  -7.419  -6.734  -6.734
  531    HD1  PHE  65           HD2      PHE  65  -7.070  -4.358  -4.358
  532    HD2  PHE  65           HD1      PHE  65  -9.869  -6.957  -6.957
  533    HE1  PHE  65           HE2      PHE  65  -7.205  -2.780  -2.780
  534    HE2  PHE  65           HE1      PHE  65 -10.016  -5.387  -5.387
  535    HZ   PHE  65           HZ       PHE  65  -8.694  -3.290  -3.290
  536    H    LYS  66           H        LYS  66 -10.653  -7.971  -7.971
  537    HA   LYS  66           HA       LYS  66 -12.985  -6.236  -6.236
  538   1HB   LYS  66          2HB       LYS  66 -14.385  -8.363  -8.363
  539   2HB   LYS  66          1HB       LYS  66 -13.840  -7.655  -7.655
  540   1HG   LYS  66          2HG       LYS  66 -11.870  -9.237  -9.237
  541   2HG   LYS  66          1HG       LYS  66 -12.631 -10.025 -10.025
  542   1HD   LYS  66          2HD       LYS  66 -13.942  -9.680  -9.680
  543   2HD   LYS  66          1HD       LYS  66 -13.153 -11.160 -11.160
  544   1HE   LYS  66          2HE       LYS  66 -15.230 -11.713 -11.713
  545   2HE   LYS  66          1HE       LYS  66 -14.825 -10.656 -10.656
  546   1HZ   LYS  66          2HZ       LYS  66 -16.098  -9.673  -9.673
  547   2HZ   LYS  66          1HZ       LYS  66 -16.992 -10.184 -10.184
  548   3HZ   LYS  66          3HZ       LYS  66 -15.942  -8.858  -8.858
  549    H    VAL  67           H        VAL  67 -13.981  -6.888  -6.888
  550    HA   VAL  67           HA       VAL  67 -11.962  -8.033  -8.033
  551    HB   VAL  67           HB       VAL  67 -14.652  -7.540  -7.540
  552   1HG1  VAL  67          1HG1      VAL  67 -11.777  -6.912  -6.912
  553   2HG1  VAL  67          3HG1      VAL  67 -13.076  -6.106  -6.106
  554   3HG1  VAL  67          2HG1      VAL  67 -12.933  -7.863  -7.863
  555   1HG2  VAL  67          3HG2      VAL  67 -13.146  -5.393  -5.393
  556   2HG2  VAL  67          2HG2      VAL  67 -14.886  -5.655  -5.655
  557   3HG2  VAL  67          1HG2      VAL  67 -14.005  -4.995  -4.995
  558    H    GLY  68           H        GLY  68 -11.821 -10.259 -10.259
  559   1HA   GLY  68          2HA       GLY  68 -13.152 -12.171 -12.171
  560   2HA   GLY  68          1HA       GLY  68 -14.342 -11.829 -11.829
  561    H    GLU  69           H        GLU  69 -11.998 -11.256 -11.256
  562    HA   GLU  69           HA       GLU  69 -11.219 -14.114 -14.114
  563   1HB   GLU  69          2HB       GLU  69 -12.246 -12.063 -12.063
  564   2HB   GLU  69          1HB       GLU  69 -11.306 -13.456 -13.456
  565   1HG   GLU  69          2HG       GLU  69 -13.033 -14.777 -14.777
  566   2HG   GLU  69          1HG       GLU  69 -14.043 -13.367 -13.367
  567    H    GLU  70           H        GLU  70  -9.198 -14.412 -14.412
  568    HA   GLU  70           HA       GLU  70  -7.210 -12.352 -12.352
  569   1HB   GLU  70          2HB       GLU  70  -6.855 -15.059 -15.059
  570   2HB   GLU  70          1HB       GLU  70  -5.566 -14.041 -14.041
  571   1HG   GLU  70          2HG       GLU  70  -6.042 -14.574 -14.574
  572   2HG   GLU  70          1HG       GLU  70  -7.778 -14.663 -14.663
  573    H    PHE  71           H        PHE  71  -5.506 -11.859 -11.859
  574    HA   PHE  71           HA       PHE  71  -6.347 -11.977 -11.977
  575   1HB   PHE  71          2HB       PHE  71  -6.408  -9.474  -9.474
  576   2HB   PHE  71          1HB       PHE  71  -7.750 -10.125 -10.125
  577    HD1  PHE  71           HD2      PHE  71  -7.512 -10.163 -10.163
  578    HD2  PHE  71           HD1      PHE  71  -4.962  -7.865  -7.865
  579    HE1  PHE  71           HE2      PHE  71  -6.850  -8.739  -8.739
  580    HE2  PHE  71           HE1      PHE  71  -4.306  -6.436  -6.436
  581    HZ   PHE  71           HZ       PHE  71  -5.247  -6.872  -6.872
  582    H    GLU  72           H        GLU  72  -4.762 -10.490 -10.490
  583    HA   GLU  72           HA       GLU  72  -2.079 -10.751 -10.751
  584   1HB   GLU  72          2HB       GLU  72  -2.392 -10.420 -10.420
  585   2HB   GLU  72          1HB       GLU  72  -1.101 -11.200 -11.200
  586   1HG   GLU  72          2HG       GLU  72  -2.750 -12.996 -12.996
  587   2HG   GLU  72          1HG       GLU  72  -3.892 -12.276 -12.276
  588    H    GLU  73           H        GLU  73  -0.728  -8.972  -8.972
  589    HA   GLU  73           HA       GLU  73  -1.337  -6.550  -6.550
  590   1HB   GLU  73          2HB       GLU  73  -1.884  -5.094  -5.094
  591   2HB   GLU  73          1HB       GLU  73  -2.978  -6.467  -6.467
  592   1HG   GLU  73          2HG       GLU  73  -0.409  -6.233  -6.233
  593   2HG   GLU  73          1HG       GLU  73  -1.996  -5.779  -5.779
  594    H    GLN  74           H        GLN  74   0.090  -4.719  -4.719
  595    HA   GLN  74           HA       GLN  74   2.821  -5.951  -5.951
  596   1HB   GLN  74          2HB       GLN  74   1.805  -3.122  -3.122
  597   2HB   GLN  74          1HB       GLN  74   3.506  -3.448  -3.448
  598   1HG   GLN  74          2HG       GLN  74   3.466  -5.062  -5.062
  599   2HG   GLN  74          1HG       GLN  74   1.881  -4.400  -4.400
  600   1HE2  GLN  74          2HE2      GLN  74   5.238  -2.210  -2.210
  601   2HE2  GLN  74          1HE2      GLN  74   5.338  -3.688  -3.688
  602    H    THR  75           H        THR  75   4.361  -5.228  -5.228
  603    HA   THR  75           HA       THR  75   2.962  -4.962  -4.962
  604    HB   THR  75           HB       THR  75   4.627  -6.827  -6.827
  605    HG1  THR  75           HG1      THR  75   4.198  -6.456  -6.456
  606   1HG2  THR  75          2HG2      THR  75   6.266  -4.667  -4.667
  607   2HG2  THR  75          1HG2      THR  75   6.965  -5.307  -5.307
  608   3HG2  THR  75          3HG2      THR  75   6.708  -6.370  -6.370
  609    H    VAL  76           H        VAL  76   5.669  -3.863  -3.863
  610    HA   VAL  76           HA       VAL  76   5.070  -1.047  -1.047
  611    HB   VAL  76           HB       VAL  76   6.563  -2.083  -2.083
  612   1HG1  VAL  76          2HG1      VAL  76   5.661   0.595   0.595
  613   2HG1  VAL  76          1HG1      VAL  76   5.629   0.288   0.288
  614   3HG1  VAL  76          3HG1      VAL  76   7.144   0.153   0.153
  615   1HG2  VAL  76          1HG2      VAL  76   4.174  -2.861  -2.861
  616   2HG2  VAL  76          3HG2      VAL  76   4.499  -1.792  -1.792
  617   3HG2  VAL  76          2HG2      VAL  76   3.679  -1.170  -1.170
  618    H    ASP  77           H        ASP  77   7.624  -3.440  -3.440
  619    HA   ASP  77           HA       ASP  77   9.689  -1.407  -1.407
  620   1HB   ASP  77          2HB       ASP  77  11.165  -3.424  -3.424
  621   2HB   ASP  77          1HB       ASP  77  10.406  -3.321  -3.321
  622    H    GLY  78           H        GLY  78   7.988  -3.939  -3.939
  623   1HA   GLY  78          2HA       GLY  78   7.464  -3.032  -3.032
  624   2HA   GLY  78          1HA       GLY  78   9.222  -2.978  -2.978
  625    H    ARG  79           H        ARG  79   7.114  -5.407  -5.407
  626    HA   ARG  79           HA       ARG  79   8.134  -7.419  -7.419
  627   1HB   ARG  79          2HB       ARG  79   8.235  -7.389  -7.389
  628   2HB   ARG  79          1HB       ARG  79   7.880  -8.925  -8.925
  629   1HG   ARG  79          2HG       ARG  79  10.203  -7.193  -7.193
  630   2HG   ARG  79          1HG       ARG  79  10.356  -8.404  -8.404
  631   1HD   ARG  79          2HD       ARG  79   9.339  -9.006  -9.006
  632   2HD   ARG  79          1HD       ARG  79  11.008  -9.250  -9.250
  633    HE   ARG  79           HE       ARG  79   9.007 -10.578 -10.578
  634   1HH1  ARG  79          1HH2      ARG  79  11.966 -10.974 -10.974
  635   2HH1  ARG  79          2HH2      ARG  79  11.715 -12.584 -12.584
  636   1HH2  ARG  79          2HH1      ARG  79   8.304 -12.563 -12.563
  637   2HH2  ARG  79          1HH1      ARG  79   9.642 -13.484 -13.484
  638    HA   PRO  80           HA       PRO  80   3.834  -8.469  -8.469
  639   1HB   PRO  80          2HB       PRO  80   4.027 -11.042 -11.042
  640   2HB   PRO  80          1HB       PRO  80   4.308  -9.608  -9.608
  641   1HG   PRO  80          2HG       PRO  80   6.286 -11.535 -11.535
  642   2HG   PRO  80          1HG       PRO  80   6.408 -10.515 -10.515
  643   1HD   PRO  80          2HD       PRO  80   7.619  -9.999  -9.999
  644   2HD   PRO  80          1HD       PRO  80   7.466  -8.848  -8.848
  645    H    CYS  81           H        CYS  81   2.310  -9.384  -9.384
  646    HA   CYS  81           HA       CYS  81   2.879 -11.794 -11.794
  647   1HB   CYS  81          2HB       CYS  81   2.544 -10.647 -10.647
  648   2HB   CYS  81          1HB       CYS  81   4.052 -10.206 -10.206
  649    HG   CYS  81           HG       CYS  81   3.087  -7.900  -7.900
  650    H    LYS  82           H        LYS  82   0.953 -12.702 -12.702
  651    HA   LYS  82           HA       LYS  82  -1.531 -11.423 -11.423
  652   1HB   LYS  82          2HB       LYS  82  -1.279 -13.779 -13.779
  653   2HB   LYS  82          1HB       LYS  82  -0.947 -14.170 -14.170
  654   1HG   LYS  82          2HG       LYS  82  -3.142 -14.569 -14.569
  655   2HG   LYS  82          1HG       LYS  82  -3.420 -12.844 -12.844
  656   1HD   LYS  82          2HD       LYS  82  -4.793 -13.846 -13.846
  657   2HD   LYS  82          1HD       LYS  82  -3.362 -13.329 -13.329
  658   1HE   LYS  82          2HE       LYS  82  -2.462 -15.540 -15.540
  659   2HE   LYS  82          1HE       LYS  82  -3.625 -16.105 -16.105
  660   1HZ   LYS  82          1HZ       LYS  82  -4.453 -15.049 -15.049
  661   2HZ   LYS  82          3HZ       LYS  82  -4.107 -16.690 -16.690
  662   3HZ   LYS  82          2HZ       LYS  82  -5.375 -15.951 -15.951
  663    H    SER  83           H        SER  83  -2.675 -10.203 -10.203
  664    HA   SER  83           HA       SER  83  -2.117 -10.411 -10.411
  665   1HB   SER  83          2HB       SER  83  -1.738  -8.207  -8.207
  666   2HB   SER  83          1HB       SER  83  -3.200  -8.232  -8.232
  667    HG   SER  83           HG       SER  83  -4.406  -8.122  -8.122
  668    H    LEU  84           H        LEU  84  -4.096  -9.896  -9.896
  669    HA   LEU  84           HA       LEU  84  -6.694 -10.677 -10.677
  670   1HB   LEU  84          2HB       LEU  84  -5.769 -12.857 -12.857
  671   2HB   LEU  84          1HB       LEU  84  -5.387 -12.227 -12.227
  672    HG   LEU  84           HG       LEU  84  -7.767 -11.905 -11.905
  673   1HD1  LEU  84          2HD1      LEU  84  -8.045 -12.022 -12.022
  674   2HD1  LEU  84          1HD1      LEU  84  -8.930 -13.397 -13.397
  675   3HD1  LEU  84          3HD1      LEU  84  -9.313 -11.768 -11.768
  676   1HD2  LEU  84          3HD2      LEU  84  -6.873 -14.599 -14.599
  677   2HD2  LEU  84          2HD2      LEU  84  -7.019 -14.037 -14.037
  678   3HD2  LEU  84          1HD2      LEU  84  -8.468 -14.382 -14.382
  679    H    VAL  85           H        VAL  85  -8.467 -10.008 -10.008
  680    HA   VAL  85           HA       VAL  85  -7.570  -8.436  -8.436
  681    HB   VAL  85           HB       VAL  85  -9.384  -7.235  -7.235
  682   1HG1  VAL  85          2HG1      VAL  85  -9.234  -6.502  -6.502
  683   2HG1  VAL  85          1HG1      VAL  85  -7.727  -5.744  -5.744
  684   3HG1  VAL  85          3HG1      VAL  85  -9.252  -5.276  -5.276
  685   1HG2  VAL  85          1HG2      VAL  85  -6.388  -7.102  -7.102
  686   2HG2  VAL  85          3HG2      VAL  85  -7.326  -7.409  -7.409
  687   3HG2  VAL  85          2HG2      VAL  85  -7.284  -5.790  -5.790
  688    H    LYS  86           H        LYS  86  -8.887  -8.767  -8.767
  689    HA   LYS  86           HA       LYS  86 -11.739  -9.475  -9.475
  690   1HB   LYS  86          2HB       LYS  86 -11.433 -10.455 -10.455
  691   2HB   LYS  86          1HB       LYS  86 -11.122 -11.436 -11.436
  692   1HG   LYS  86          2HG       LYS  86  -8.694 -10.733 -10.733
  693   2HG   LYS  86          1HG       LYS  86  -9.086  -9.981  -9.981
  694   1HD   LYS  86          2HD       LYS  86  -9.663 -12.067 -12.067
  695   2HD   LYS  86          1HD       LYS  86  -9.723 -12.878 -12.878
  696   1HE   LYS  86          2HE       LYS  86  -7.439 -13.085 -13.085
  697   2HE   LYS  86          1HE       LYS  86  -7.146 -11.582 -11.582
  698   1HZ   LYS  86          1HZ       LYS  86  -7.858 -12.701 -12.701
  699   2HZ   LYS  86          3HZ       LYS  86  -8.053 -14.151 -14.151
  700   3HZ   LYS  86          2HZ       LYS  86  -6.509 -13.461 -13.461
  701    H    TRP  87           H        TRP  87 -13.213  -8.553  -8.553
  702    HA   TRP  87           HA       TRP  87 -12.367  -5.872  -5.872
  703   1HB   TRP  87          2HB       TRP  87 -14.898  -7.484  -7.484
  704   2HB   TRP  87          1HB       TRP  87 -14.714  -5.933  -5.933
  705    HD1  TRP  87           HD1      TRP  87 -15.655  -7.473  -7.473
  706    HE1  TRP  87           HE1      TRP  87 -15.986  -5.678  -5.678
  707    HE3  TRP  87           HE3      TRP  87 -13.559  -3.482  -3.482
  708    HZ2  TRP  87           HZ2      TRP  87 -15.433  -2.896  -2.896
  709    HZ3  TRP  87           HZ3      TRP  87 -13.448  -1.276  -1.276
  710    HH2  TRP  87           HH2      TRP  87 -14.377  -0.980  -0.980
  711    H    GLU  88           H        GLU  88 -13.029  -5.131  -5.131
  712    HA   GLU  88           HA       GLU  88 -12.329  -7.121  -7.121
  713   1HB   GLU  88          2HB       GLU  88 -10.383  -5.556  -5.556
  714   2HB   GLU  88          1HB       GLU  88 -11.267  -4.308  -4.308
  715   1HG   GLU  88          2HG       GLU  88  -9.810  -5.148  -5.148
  716   2HG   GLU  88          1HG       GLU  88 -11.318  -6.002  -6.002
  717    H    SER  89           H        SER  89 -13.449  -3.868  -3.868
  718    HA   SER  89           HA       SER  89 -15.579  -4.108  -4.108
  719   1HB   SER  89          2HB       SER  89 -15.157  -1.908  -1.908
  720   2HB   SER  89          1HB       SER  89 -13.569  -2.666  -2.666
  721    HG   SER  89           HG       SER  89 -13.402  -1.690  -1.690
  722    H    GLU  90           H        GLU  90 -16.458  -1.344  -1.344
  723    HA   GLU  90           HA       GLU  90 -17.962  -2.108  -2.108
  724   1HB   GLU  90          2HB       GLU  90 -18.962   0.177   0.177
  725   2HB   GLU  90          1HB       GLU  90 -19.063  -0.776  -0.776
  726   1HG   GLU  90          2HG       GLU  90 -17.311   0.426   0.426
  727   2HG   GLU  90          1HG       GLU  90 -16.744   1.086   1.086
  728    H    ASN  91           H        ASN  91 -15.089  -0.179  -0.179
  729    HA   ASN  91           HA       ASN  91 -14.865   0.208   0.208
  730   1HB   ASN  91          2HB       ASN  91 -14.289   2.441   2.441
  731   2HB   ASN  91          1HB       ASN  91 -14.313   2.528   2.528
  732   1HD2  ASN  91          2HD2      ASN  91 -17.647   3.453   3.453
  733   2HD2  ASN  91          1HD2      ASN  91 -16.072   3.613   3.613
  734    H    LYS  92           H        LYS  92 -13.423  -1.468  -1.468
  735    HA   LYS  92           HA       LYS  92 -10.702  -0.513  -0.513
  736   1HB   LYS  92          2HB       LYS  92 -11.157   0.048   0.048
  737   2HB   LYS  92          1HB       LYS  92 -11.470  -1.657  -1.657
  738   1HG   LYS  92          2HG       LYS  92  -9.077  -1.896  -1.896
  739   2HG   LYS  92          1HG       LYS  92  -8.894  -0.278  -0.278
  740   1HD   LYS  92          2HD       LYS  92  -9.849  -1.373  -1.373
  741   2HD   LYS  92          1HD       LYS  92  -9.320  -2.879  -2.879
  742   1HE   LYS  92          2HE       LYS  92  -7.120  -1.323  -1.323
  743   2HE   LYS  92          1HE       LYS  92  -7.708  -0.661  -0.661
  744   1HZ   LYS  92          2HZ       LYS  92  -7.878  -3.046  -3.046
  745   2HZ   LYS  92          1HZ       LYS  92  -6.960  -3.459  -3.459
  746   3HZ   LYS  92          3HZ       LYS  92  -6.305  -2.431  -2.431
  747    H    MET  93           H        MET  93  -9.933  -2.069  -2.069
  748    HA   MET  93           HA       MET  93 -10.587  -4.908  -4.908
  749   1HB   MET  93          2HB       MET  93 -10.385  -5.406  -5.406
  750   2HB   MET  93          1HB       MET  93 -11.663  -4.240  -4.240
  751   1HG   MET  93          2HG       MET  93  -9.252  -2.771  -2.771
  752   2HG   MET  93          1HG       MET  93  -9.335  -3.951  -3.951
  753   1HE   MET  93          3HE       MET  93 -11.379  -4.611  -4.611
  754   2HE   MET  93          2HE       MET  93 -12.753  -3.601  -3.601
  755   3HE   MET  93          1HE       MET  93 -11.231  -3.432  -3.432
  756    H    VAL  94           H        VAL  94  -8.906  -6.428  -6.428
  757    HA   VAL  94           HA       VAL  94  -6.183  -5.251  -5.251
  758    HB   VAL  94           HB       VAL  94  -6.823  -8.134  -8.134
  759   1HG1  VAL  94          2HG1      VAL  94  -4.728  -6.132  -6.132
  760   2HG1  VAL  94          1HG1      VAL  94  -5.035  -7.458  -7.458
  761   3HG1  VAL  94          3HG1      VAL  94  -4.540  -7.798  -7.798
  762   1HG2  VAL  94          2HG2      VAL  94  -7.491  -5.744  -5.744
  763   2HG2  VAL  94          1HG2      VAL  94  -8.443  -7.202  -7.202
  764   3HG2  VAL  94          3HG2      VAL  94  -7.022  -7.264  -7.264
  765    H    CYS  95           H        CYS  95  -4.448  -6.829  -6.829
  766    HA   CYS  95           HA       CYS  95  -5.484  -8.122  -8.122
  767   1HB   CYS  95          2HB       CYS  95  -5.038  -5.739  -5.739
  768   2HB   CYS  95          1HB       CYS  95  -3.367  -5.953  -5.953
  769    HG   CYS  95           HG       CYS  95  -2.881  -7.344  -7.344
  770    H    GLU  96           H        GLU  96  -4.222  -9.759  -9.759
  771    HA   GLU  96           HA       GLU  96  -1.668 -10.318 -10.318
  772   1HB   GLU  96          2HB       GLU  96  -3.354 -12.322 -12.322
  773   2HB   GLU  96          1HB       GLU  96  -2.046 -12.660 -12.660
  774   1HG   GLU  96          2HG       GLU  96  -4.176 -11.057 -11.057
  775   2HG   GLU  96          1HG       GLU  96  -4.766 -12.603 -12.603
  776    H    GLN  97           H        GLN  97   0.020 -11.378 -11.378
  777    HA   GLN  97           HA       GLN  97  -0.425 -10.980 -10.980
  778   1HB   GLN  97          2HB       GLN  97   0.262  -8.744  -8.744
  779   2HB   GLN  97          1HB       GLN  97   1.861  -9.382  -9.382
  780   1HG   GLN  97          2HG       GLN  97   1.123  -9.622  -9.622
  781   2HG   GLN  97          1HG       GLN  97  -0.356  -8.775  -8.775
  782   1HE2  GLN  97          2HE2      GLN  97   1.227  -5.696  -5.696
  783   2HE2  GLN  97          1HE2      GLN  97  -0.139  -6.680  -6.680
  784    H    LYS  98           H        LYS  98   0.949 -12.177 -12.177
  785    HA   LYS  98           HA       LYS  98   3.498 -13.163 -13.163
  786   1HB   LYS  98          2HB       LYS  98   2.926 -15.503 -15.503
  787   2HB   LYS  98          1HB       LYS  98   1.886 -14.901 -14.901
  788   1HG   LYS  98          2HG       LYS  98   0.050 -14.605 -14.605
  789   2HG   LYS  98          1HG       LYS  98   1.062 -14.607 -14.607
  790   1HD   LYS  98          2HD       LYS  98   1.652 -17.036 -17.036
  791   2HD   LYS  98          1HD       LYS  98   0.267 -16.949 -16.949
  792   1HE   LYS  98          2HE       LYS  98  -1.083 -16.147 -16.147
  793   2HE   LYS  98          1HE       LYS  98   0.287 -16.660 -16.660
  794   1HZ   LYS  98          1HZ       LYS  98  -0.975 -18.467 -18.467
  795   2HZ   LYS  98          3HZ       LYS  98  -1.564 -18.333 -18.333
  796   3HZ   LYS  98          2HZ       LYS  98   0.026 -18.867 -18.867
  797    H    LEU  99           H        LEU  99   4.992 -13.785 -13.785
  798    HA   LEU  99           HA       LEU  99   4.719 -12.298 -12.298
  799   1HB   LEU  99          2HB       LEU  99   6.448 -14.685 -14.685
  800   2HB   LEU  99          1HB       LEU  99   6.609 -13.733 -13.733
  801    HG   LEU  99           HG       LEU  99   6.588 -12.235 -12.235
  802   1HD1  LEU  99          2HD1      LEU  99   8.681 -14.211 -14.211
  803   2HD1  LEU  99          1HD1      LEU  99   9.190 -12.711 -12.711
  804   3HD1  LEU  99          3HD1      LEU  99   8.109 -13.819 -13.819
  805   1HD2  LEU  99          2HD2      LEU  99   6.919 -11.506 -11.506
  806   2HD2  LEU  99          1HD2      LEU  99   7.766 -10.683 -10.683
  807   3HD2  LEU  99          3HD2      LEU  99   8.594 -11.920 -11.920
  808    H    LEU 100           H        LEU 100   4.779 -13.261 -13.261
  809    HA   LEU 100           HA       LEU 100   2.740 -15.395 -15.395
  810   1HB   LEU 100          2HB       LEU 100   3.779 -13.255 -13.255
  811   2HB   LEU 100          1HB       LEU 100   2.852 -14.628 -14.628
  812    HG   LEU 100           HG       LEU 100   1.905 -12.801 -12.801
  813   1HD1  LEU 100          3HD1      LEU 100   2.186 -11.804 -11.804
  814   2HD1  LEU 100          2HD1      LEU 100   0.826 -12.842 -12.842
  815   3HD1  LEU 100          1HD1      LEU 100   0.634 -11.598 -11.598
  816   1HD2  LEU 100          1HD2      LEU 100   0.862 -15.224 -15.224
  817   2HD2  LEU 100          3HD2      LEU 100   0.618 -14.688 -14.688
  818   3HD2  LEU 100          2HD2      LEU 100  -0.305 -13.951 -13.951
  819    H    LYS 101           H        LYS 101   6.102 -15.031 -15.031
  820    HA   LYS 101           HA       LYS 101   6.430 -17.640 -17.640
  821   1HB   LYS 101          2HB       LYS 101   6.802 -15.816 -15.816
  822   2HB   LYS 101          1HB       LYS 101   8.161 -15.266 -15.266
  823   1HG   LYS 101          2HG       LYS 101   8.075 -18.167 -18.167
  824   2HG   LYS 101          1HG       LYS 101   8.456 -17.063 -17.063
  825   1HD   LYS 101          2HD       LYS 101  10.091 -15.994 -15.994
  826   2HD   LYS 101          1HD       LYS 101   9.981 -17.591 -17.591
  827   1HE   LYS 101          2HE       LYS 101  10.762 -18.662 -18.662
  828   2HE   LYS 101          1HE       LYS 101  10.663 -17.150 -17.150
  829   1HZ   LYS 101          2HZ       LYS 101  12.313 -16.238 -16.238
  830   2HZ   LYS 101          1HZ       LYS 101  12.520 -17.814 -17.814
  831   3HZ   LYS 101          3HZ       LYS 101  12.914 -17.463 -17.463
  832    H    GLY 102           H        GLY 102   7.821 -18.872 -18.872
  833   1HA   GLY 102          2HA       GLY 102   9.437 -19.445 -19.445
  834   2HA   GLY 102          1HA       GLY 102  10.172 -17.868 -17.868
  835    H    GLU 103           H        GLU 103  10.517 -17.655 -17.655
  836    HA   GLU 103           HA       GLU 103   8.474 -16.165 -16.165
  837   1HB   GLU 103          2HB       GLU 103   7.476 -18.454 -18.454
  838   2HB   GLU 103          1HB       GLU 103   8.905 -18.949 -18.949
  839   1HG   GLU 103          2HG       GLU 103   8.401 -17.558 -17.558
  840   2HG   GLU 103          1HG       GLU 103   7.362 -16.515 -16.515
  841    H    GLY 104           H        GLY 104   9.344 -15.084 -15.084
  842   1HA   GLY 104          2HA       GLY 104  11.845 -16.029 -16.029
  843   2HA   GLY 104          1HA       GLY 104  11.933 -14.487 -14.487
  844    HA   PRO 105           HA       PRO 105  10.296 -12.645 -12.645
  845   1HB   PRO 105          2HB       PRO 105   9.406 -10.265 -10.265
  846   2HB   PRO 105          1HB       PRO 105  11.120 -10.631 -10.631
  847   1HG   PRO 105          2HG       PRO 105   9.608 -10.488 -10.488
  848   2HG   PRO 105          1HG       PRO 105  11.346 -10.303 -10.303
  849   1HD   PRO 105          2HD       PRO 105  10.022 -12.626 -12.626
  850   2HD   PRO 105          1HD       PRO 105  11.728 -12.499 -12.499
  851    H    LYS 106           H        LYS 106   8.135 -11.270 -11.270
  852    HA   LYS 106           HA       LYS 106   5.816 -12.517 -12.517
  853   1HB   LYS 106          2HB       LYS 106   6.246 -13.708 -13.708
  854   2HB   LYS 106          1HB       LYS 106   6.216 -12.174 -12.174
  855   1HG   LYS 106          2HG       LYS 106   3.916 -11.864 -11.864
  856   2HG   LYS 106          1HG       LYS 106   3.883 -13.046 -13.046
  857   1HD   LYS 106          2HD       LYS 106   2.986 -14.344 -14.344
  858   2HD   LYS 106          1HD       LYS 106   4.698 -14.675 -14.675
  859   1HE   LYS 106          2HE       LYS 106   3.739 -14.104 -14.104
  860   2HE   LYS 106          1HE       LYS 106   4.727 -12.736 -12.736
  861   1HZ   LYS 106          2HZ       LYS 106   1.836 -12.880 -12.880
  862   2HZ   LYS 106          1HZ       LYS 106   2.409 -12.238 -12.238
  863   3HZ   LYS 106          3HZ       LYS 106   2.852 -11.518 -11.518
  864    H    THR 107           H        THR 107   4.208 -11.016 -11.016
  865    HA   THR 107           HA       THR 107   4.534  -8.311  -8.311
  866    HB   THR 107           HB       THR 107   3.121  -7.834  -7.834
  867    HG1  THR 107           HG1      THR 107   3.644  -9.238  -9.238
  868   1HG2  THR 107          2HG2      THR 107   5.315  -6.857  -6.857
  869   2HG2  THR 107          1HG2      THR 107   6.110  -7.854  -7.854
  870   3HG2  THR 107          3HG2      THR 107   4.976  -6.596  -6.596
  871    H    SER 108           H        SER 108   2.749  -7.249  -7.249
  872    HA   SER 108           HA       SER 108   0.030  -8.159  -8.159
  873   1HB   SER 108          2HB       SER 108  -0.238  -8.388  -8.388
  874   2HB   SER 108          1HB       SER 108   0.261  -9.774  -9.774
  875    HG   SER 108           HG       SER 108   1.540  -8.884  -8.884
  876    H    TRP 109           H        TRP 109  -1.322  -6.349  -6.349
  877    HA   TRP 109           HA       TRP 109  -0.306  -4.188  -4.188
  878   1HB   TRP 109          2HB       TRP 109  -0.824  -2.475  -2.475
  879   2HB   TRP 109          1HB       TRP 109   0.566  -3.491  -3.491
  880    HD1  TRP 109           HD1      TRP 109   0.455  -5.021  -5.021
  881    HE1  TRP 109           HE1      TRP 109  -1.268  -5.333  -5.333
  882    HE3  TRP 109           HE3      TRP 109  -3.496  -2.440  -2.440
  883    HZ2  TRP 109           HZ2      TRP 109  -3.956  -4.584  -4.584
  884    HZ3  TRP 109           HZ3      TRP 109  -5.608  -2.259  -2.259
  885    HH2  TRP 109           HH2      TRP 109  -5.858  -3.323  -3.323
  886    H    THR 110           H        THR 110  -2.050  -2.330  -2.330
  887    HA   THR 110           HA       THR 110  -4.777  -3.520  -3.520
  888    HB   THR 110           HB       THR 110  -5.321  -2.847  -2.847
  889    HG1  THR 110           HG1      THR 110  -2.786  -1.595  -1.595
  890   1HG2  THR 110          3HG2      THR 110  -3.438  -4.748  -4.748
  891   2HG2  THR 110          2HG2      THR 110  -2.544  -3.661  -3.661
  892   3HG2  THR 110          1HG2      THR 110  -4.076  -4.353  -4.353
  893    H    MET 111           H        MET 111  -6.464  -1.797  -1.797
  894    HA   MET 111           HA       MET 111  -5.617   0.966   0.966
  895   1HB   MET 111          2HB       MET 111  -7.246   1.018   1.018
  896   2HB   MET 111          1HB       MET 111  -5.791   0.063   0.063
  897   1HG   MET 111          2HG       MET 111  -7.032  -1.985  -1.985
  898   2HG   MET 111          1HG       MET 111  -8.488  -1.016  -1.016
  899   1HE   MET 111          2HE       MET 111  -8.452   1.093   1.093
  900   2HE   MET 111          1HE       MET 111  -9.312   0.321   0.321
  901   3HE   MET 111          3HE       MET 111  -9.853   0.079   0.079
  902    H    GLU 112           H        GLU 112  -6.881   2.284   2.284
  903    HA   GLU 112           HA       GLU 112  -9.573   1.248   1.248
  904   1HB   GLU 112          2HB       GLU 112  -7.834   1.308   1.308
  905   2HB   GLU 112          1HB       GLU 112  -7.779   3.058   3.058
  906   1HG   GLU 112          2HG       GLU 112  -9.859   3.372   3.372
  907   2HG   GLU 112          1HG       GLU 112 -10.473   1.831   1.831
  908    H    LEU 113           H        LEU 113 -11.245   2.810   2.810
  909    HA   LEU 113           HA       LEU 113 -10.672   5.415   5.415
  910   1HB   LEU 113          2HB       LEU 113 -12.442   3.433   3.433
  911   2HB   LEU 113          1HB       LEU 113 -13.477   4.473   4.473
  912    HG   LEU 113           HG       LEU 113 -13.440   5.005   5.005
  913   1HD1  LEU 113          3HD1      LEU 113 -13.184   6.812   6.812
  914   2HD1  LEU 113          2HD1      LEU 113 -12.488   7.540   7.540
  915   3HD1  LEU 113          1HD1      LEU 113 -14.156   6.976   6.976
  916   1HD2  LEU 113          2HD2      LEU 113 -10.653   4.821   4.821
  917   2HD2  LEU 113          1HD2      LEU 113 -11.506   5.298   5.298
  918   3HD2  LEU 113          3HD2      LEU 113 -10.977   6.524   6.524
  919    H    THR 114           H        THR 114 -11.500   7.295   7.295
  920    HA   THR 114           HA       THR 114 -12.200   6.788   6.788
  921    HB   THR 114           HB       THR 114 -11.643   9.064   9.064
  922    HG1  THR 114           HG1      THR 114 -12.056  10.517  10.517
  923   1HG2  THR 114          1HG2      THR 114  -9.761   7.444   7.444
  924   2HG2  THR 114          3HG2      THR 114  -9.724   8.317   8.317
  925   3HG2  THR 114          2HG2      THR 114  -9.381   9.166   9.166
  926    H    ASN 115           H        ASN 115 -13.968   8.073   8.073
  927    HA   ASN 115           HA       ASN 115 -16.439   7.699   7.699
  928   1HB   ASN 115          2HB       ASN 115 -15.553   9.052   9.052
  929   2HB   ASN 115          1HB       ASN 115 -17.133   9.513   9.513
  930   1HD2  ASN 115          2HD2      ASN 115 -16.584   5.760   5.760
  931   2HD2  ASN 115          1HD2      ASN 115 -15.250   6.777   6.777
  932    H    ASP 116           H        ASP 116 -14.175  10.349  10.349
  933    HA   ASP 116           HA       ASP 116 -16.132  12.250  12.250
  934   1HB   ASP 116          2HB       ASP 116 -13.113  12.389  12.389
  935   2HB   ASP 116          1HB       ASP 116 -14.132  13.716  13.716
  936    H    GLY 117           H        GLY 117 -13.757   9.957   9.957
  937   1HA   GLY 117          2HA       GLY 117 -14.345   9.166   9.166
  938   2HA   GLY 117          1HA       GLY 117 -14.327  10.872  10.872
  939    H    GLU 118           H        GLU 118 -11.929  10.856  10.856
  940    HA   GLU 118           HA       GLU 118  -9.804  11.086  11.086
  941   1HB   GLU 118          2HB       GLU 118  -9.695  10.292  10.292
  942   2HB   GLU 118          1HB       GLU 118  -8.318  10.844  10.844
  943   1HG   GLU 118          2HG       GLU 118  -9.803  12.922  12.922
  944   2HG   GLU 118          1HG       GLU 118 -10.742  12.396  12.396
  945    H    LEU 119           H        LEU 119  -7.782   9.550   9.550
  946    HA   LEU 119           HA       LEU 119  -8.589   6.700   6.700
  947   1HB   LEU 119          2HB       LEU 119  -9.086   7.499   7.499
  948   2HB   LEU 119          1HB       LEU 119  -7.375   7.856   7.856
  949    HG   LEU 119           HG       LEU 119  -8.350   5.108   5.108
  950   1HD1  LEU 119          2HD1      LEU 119  -8.277   6.452   6.452
  951   2HD1  LEU 119          1HD1      LEU 119  -7.907   4.731   4.731
  952   3HD1  LEU 119          3HD1      LEU 119  -9.473   5.333   5.333
  953   1HD2  LEU 119          1HD2      LEU 119  -5.807   6.342   6.342
  954   2HD2  LEU 119          3HD2      LEU 119  -6.022   5.180   5.180
  955   3HD2  LEU 119          2HD2      LEU 119  -6.155   4.653   4.653
  956    H    ILE 120           H        ILE 120  -7.052   5.840   5.840
  957    HA   ILE 120           HA       ILE 120  -4.231   6.783   6.783
  958    HB   ILE 120           HB       ILE 120  -5.022   7.129   7.129
  959   1HG1  ILE 120          2HG1      ILE 120  -3.260   4.668   4.668
  960   2HG1  ILE 120          1HG1      ILE 120  -2.665   6.253   6.253
  961   1HG2  ILE 120          1HG2      ILE 120  -5.937   4.294   4.294
  962   2HG2  ILE 120          3HG2      ILE 120  -5.481   4.850   4.850
  963   3HG2  ILE 120          2HG2      ILE 120  -6.778   5.661   5.661
  964   1HD1  ILE 120          1HD1      ILE 120  -3.392   7.185   7.185
  965   2HD1  ILE 120          3HD1      ILE 120  -3.915   5.575   5.575
  966   3HD1  ILE 120          2HD1      ILE 120  -2.206   5.894   5.894
  967    H    LEU 121           H        LEU 121  -2.588   5.129   5.129
  968    HA   LEU 121           HA       LEU 121  -3.651   2.400   2.400
  969   1HB   LEU 121          2HB       LEU 121  -3.320   3.635   3.635
  970   2HB   LEU 121          1HB       LEU 121  -1.642   3.932   3.932
  971    HG   LEU 121           HG       LEU 121  -2.132   1.118   1.118
  972   1HD1  LEU 121          2HD1      LEU 121  -3.009   2.299   2.299
  973   2HD1  LEU 121          1HD1      LEU 121  -2.680   0.588   0.588
  974   3HD1  LEU 121          3HD1      LEU 121  -4.010   1.379   1.379
  975   1HD2  LEU 121          2HD2      LEU 121  -0.447   2.922   2.922
  976   2HD2  LEU 121          1HD2      LEU 121   0.052   1.743   1.743
  977   3HD2  LEU 121          3HD2      LEU 121  -0.505   1.199   1.199
  978    H    THR 122           H        THR 122  -2.434   0.821   0.821
  979    HA   THR 122           HA       THR 122   0.260   1.603   1.603
  980    HB   THR 122           HB       THR 122  -0.646  -0.746  -0.746
  981    HG1  THR 122           HG1      THR 122  -2.582  -0.085  -0.085
  982   1HG2  THR 122          3HG2      THR 122  -0.079   2.114   2.114
  983   2HG2  THR 122          2HG2      THR 122  -0.759   1.042   1.042
  984   3HG2  THR 122          1HG2      THR 122   0.790   0.655   0.655
  985    H    MET 123           H        MET 123   1.771  -0.339  -0.339
  986    HA   MET 123           HA       MET 123   1.094  -2.389  -2.389
  987   1HB   MET 123          2HB       MET 123   3.571  -0.646  -0.646
  988   2HB   MET 123          1HB       MET 123   3.182  -1.975  -1.975
  989   1HG   MET 123          2HG       MET 123   0.947  -0.641  -0.641
  990   2HG   MET 123          1HG       MET 123   1.894   0.725   0.725
  991   1HE   MET 123          1HE       MET 123   1.272  -1.971  -1.971
  992   2HE   MET 123          3HE       MET 123   2.325  -1.723  -1.723
  993   3HE   MET 123          2HE       MET 123   2.963  -2.461  -2.461
  994    H    THR 124           H        THR 124   2.725  -4.131  -4.131
  995    HA   THR 124           HA       THR 124   4.489  -4.291  -4.291
  996    HB   THR 124           HB       THR 124   2.662  -6.592  -6.592
  997    HG1  THR 124           HG1      THR 124   2.134  -4.582  -4.582
  998   1HG2  THR 124          3HG2      THR 124   4.845  -6.268  -6.268
  999   2HG2  THR 124          2HG2      THR 124   3.498  -5.980  -5.980
 1000   3HG2  THR 124          1HG2      THR 124   3.598  -7.495  -7.495
 1001    H    ALA 125           H        ALA 125   6.161  -5.798  -5.798
 1002    HA   ALA 125           HA       ALA 125   6.213  -7.500  -7.500
 1003   1HB   ALA 125          3HB       ALA 125   8.128  -5.178  -5.178
 1004   2HB   ALA 125          2HB       ALA 125   8.360  -6.488  -6.488
 1005   3HB   ALA 125          1HB       ALA 125   6.974  -5.410  -5.410
 1006    H    ASP 126           H        ASP 126   6.510  -9.224  -9.224
 1007    HA   ASP 126           HA       ASP 126   7.845 -10.820 -10.820
 1008   1HB   ASP 126          2HB       ASP 126   9.786  -9.098  -9.098
 1009   2HB   ASP 126          1HB       ASP 126  10.235  -9.284  -9.284
 1010    H    ASP 127           H        ASP 127   9.212  -7.870  -7.870
 1011    HA   ASP 127           HA       ASP 127   7.469  -8.214  -8.214
 1012   1HB   ASP 127          2HB       ASP 127   9.603  -9.633  -9.633
 1013   2HB   ASP 127          1HB       ASP 127  10.460  -8.096  -8.096
 1014    H    VAL 128           H        VAL 128   8.099  -6.230  -6.230
 1015    HA   VAL 128           HA       VAL 128   8.685  -3.897  -3.897
 1016    HB   VAL 128           HB       VAL 128   9.551  -2.733  -2.733
 1017   1HG1  VAL 128          2HG1      VAL 128  11.118  -4.153  -4.153
 1018   2HG1  VAL 128          1HG1      VAL 128  10.719  -5.522  -5.522
 1019   3HG1  VAL 128          3HG1      VAL 128  11.543  -4.116  -4.116
 1020   1HG2  VAL 128          1HG2      VAL 128   8.346  -5.073  -5.073
 1021   2HG2  VAL 128          3HG2      VAL 128   8.509  -3.406  -3.406
 1022   3HG2  VAL 128          2HG2      VAL 128   9.883  -4.505  -4.505
 1023    H    VAL 129           H        VAL 129   7.644  -1.858  -1.858
 1024    HA   VAL 129           HA       VAL 129   5.129  -2.528  -2.528
 1025    HB   VAL 129           HB       VAL 129   5.289  -1.787  -1.787
 1026   1HG1  VAL 129          1HG1      VAL 129   3.263  -0.644  -0.644
 1027   2HG1  VAL 129          3HG1      VAL 129   2.762  -1.083  -1.083
 1028   3HG1  VAL 129          2HG1      VAL 129   4.028   0.120   0.120
 1029   1HG2  VAL 129          3HG2      VAL 129   3.842  -3.676  -3.676
 1030   2HG2  VAL 129          2HG2      VAL 129   4.553  -3.940  -3.940
 1031   3HG2  VAL 129          1HG2      VAL 129   2.988  -3.140  -3.140
 1032    H    CYS 130           H        CYS 130   4.986  -1.039  -1.039
 1033    HA   CYS 130           HA       CYS 130   6.171   1.662   1.662
 1034   1HB   CYS 130          2HB       CYS 130   6.774   0.292   0.292
 1035   2HB   CYS 130          1HB       CYS 130   5.109   0.499   0.499
 1036    HG   CYS 130           HG       CYS 130   7.257   2.573   2.573
 1037    H    THR 131           H        THR 131   4.738   3.117   3.117
 1038    HA   THR 131           HA       THR 131   1.880   2.915   2.915
 1039    HB   THR 131           HB       THR 131   3.101   4.234   4.234
 1040    HG1  THR 131           HG1      THR 131   2.742   2.399   2.399
 1041   1HG2  THR 131          3HG2      THR 131   0.248   3.986   3.986
 1042   2HG2  THR 131          2HG2      THR 131   0.656   4.348   4.348
 1043   3HG2  THR 131          1HG2      THR 131   1.131   5.461   5.461
 1044    H    ARG 132           H        ARG 132   0.845   4.778   4.778
 1045    HA   ARG 132           HA       ARG 132   2.271   7.334   7.334
 1046   1HB   ARG 132          2HB       ARG 132   1.185   6.011   6.011
 1047   2HB   ARG 132          1HB       ARG 132   2.093   7.518   7.518
 1048   1HG   ARG 132          2HG       ARG 132   4.002   6.137   6.137
 1049   2HG   ARG 132          1HG       ARG 132   3.101   4.708   4.708
 1050   1HD   ARG 132          2HD       ARG 132   3.432   6.822   6.822
 1051   2HD   ARG 132          1HD       ARG 132   4.900   5.962   5.962
 1052    HE   ARG 132           HE       ARG 132   2.690   4.151   4.151
 1053   1HH1  ARG 132          1HH2      ARG 132   5.498   3.492   3.492
 1054   2HH1  ARG 132          2HH2      ARG 132   5.525   3.664   3.664
 1055   1HH2  ARG 132          2HH1      ARG 132   2.582   5.495   5.495
 1056   2HH2  ARG 132          1HH1      ARG 132   3.874   4.798   4.798
 1057    H    VAL 133           H        VAL 133   0.676   8.799   8.799
 1058    HA   VAL 133           HA       VAL 133  -2.148   7.985   7.985
 1059    HB   VAL 133           HB       VAL 133  -0.902  10.618  10.618
 1060   1HG1  VAL 133          3HG1      VAL 133  -3.366  10.620  10.620
 1061   2HG1  VAL 133          2HG1      VAL 133  -3.610   9.470   9.470
 1062   3HG1  VAL 133          1HG1      VAL 133  -3.013  11.092  11.092
 1063   1HG2  VAL 133          2HG2      VAL 133  -0.126   8.656   8.656
 1064   2HG2  VAL 133          1HG2      VAL 133  -1.099   9.774   9.774
 1065   3HG2  VAL 133          3HG2      VAL 133  -1.809   8.273   8.273
 1066    H    TYR 134           H        TYR 134  -3.677   8.742   8.742
 1067    HA   TYR 134           HA       TYR 134  -2.650  10.686  10.686
 1068   1HB   TYR 134          2HB       TYR 134  -4.092   8.083   8.083
 1069   2HB   TYR 134          1HB       TYR 134  -4.324   9.385   9.385
 1070    HD1  TYR 134           HD2      TYR 134  -2.465  10.238  10.238
 1071    HD2  TYR 134           HD1      TYR 134  -1.930   6.972   6.972
 1072    HE1  TYR 134           HE2      TYR 134  -0.315   9.666   9.666
 1073    HE2  TYR 134           HE1      TYR 134   0.216   6.395   6.395
 1074    HH   TYR 134           HH       TYR 134   1.977   8.206   8.206
 1075    H    VAL 135           H        VAL 135  -3.891  12.434  12.434
 1076    HA   VAL 135           HA       VAL 135  -6.706  12.255  12.255
 1077    HB   VAL 135           HB       VAL 135  -4.658  14.078  14.078
 1078   1HG1  VAL 135          1HG1      VAL 135  -5.176  15.266  15.266
 1079   2HG1  VAL 135          3HG1      VAL 135  -6.796  15.568  15.568
 1080   3HG1  VAL 135          2HG1      VAL 135  -5.391  16.254  16.254
 1081   1HG2  VAL 135          1HG2      VAL 135  -7.628  13.930  13.930
 1082   2HG2  VAL 135          3HG2      VAL 135  -6.331  13.621  13.621
 1083   3HG2  VAL 135          2HG2      VAL 135  -6.706  15.276  15.276
 1084    H    ARG 136           H        ARG 136  -8.363  12.834  12.834
 1085    HA   ARG 136           HA       ARG 136  -7.950  12.457  12.457
 1086   1HB   ARG 136          2HB       ARG 136 -10.115  13.357  13.357
 1087   2HB   ARG 136          1HB       ARG 136 -10.062  14.322  14.322
 1088   1HG   ARG 136          2HG       ARG 136 -10.402  12.505  12.505
 1089   2HG   ARG 136          1HG       ARG 136  -9.729  11.361  11.361
 1090   1HD   ARG 136          2HD       ARG 136 -12.439  12.713  12.713
 1091   2HD   ARG 136          1HD       ARG 136 -12.111  10.990  10.990
 1092    HE   ARG 136           HE       ARG 136 -10.899  11.657  11.657
 1093   1HH1  ARG 136          1HH2      ARG 136 -13.655  10.212  10.212
 1094   2HH1  ARG 136          2HH2      ARG 136 -14.666  10.905  10.905
 1095   1HH2  ARG 136          2HH1      ARG 136 -12.359  13.335  13.335
 1096   2HH2  ARG 136          1HH1      ARG 136 -13.932  12.675  12.675
 1097    H    GLU 137           HN       GLU 137  -7.029  13.543  13.543
 1098    HA   GLU 137           HA       GLU 137  -5.761  15.200  15.200
 1099   1HB   GLU 137          2HB       GLU 137  -8.276  15.706  15.706
 1100   2HB   GLU 137          1HB       GLU 137  -7.967  17.038  17.038
 1101   1HG   GLU 137          2HG       GLU 137  -6.034  17.688  17.688
 1102   2HG   GLU 137          1HG       GLU 137  -6.726  16.556  16.556

  Start of MODEL   15
    1   1H    PRO   1          1H        PRO   1 -15.097   5.824   5.824
    2   2H    PRO   1          2H        PRO   1 -15.580   5.059   5.059
    3    HA   PRO   1           HA       PRO   1 -17.342   4.177   4.177
    4   1HB   PRO   1          2HB       PRO   1 -18.574   6.428   6.428
    5   2HB   PRO   1          1HB       PRO   1 -19.052   5.634   5.634
    6   1HG   PRO   1          2HG       PRO   1 -17.812   8.195   8.195
    7   2HG   PRO   1          1HG       PRO   1 -18.289   7.394   7.394
    8   1HD   PRO   1          1HD       PRO   1 -15.640   7.799   7.799
    9   2HD   PRO   1          2HD       PRO   1 -16.122   7.006   7.006
   10    H    ASN   2           H        ASN   2 -15.839   6.634   6.634
   11    HA   ASN   2           HA       ASN   2 -15.937   4.651   4.651
   12   1HB   ASN   2          2HB       ASN   2 -16.747   7.561   7.561
   13   2HB   ASN   2          1HB       ASN   2 -16.263   6.719   6.719
   14   1HD2  ASN   2          2HD2      ASN   2 -20.023   6.375   6.375
   15   2HD2  ASN   2          1HD2      ASN   2 -19.011   7.725   7.725
   16    H    PHE   3           H        PHE   3 -14.015   4.408   4.408
   17    HA   PHE   3           HA       PHE   3 -11.770   6.183   6.183
   18   1HB   PHE   3          2HB       PHE   3 -11.863   3.502   3.502
   19   2HB   PHE   3          1HB       PHE   3 -10.392   4.381   4.381
   20    HD1  PHE   3           HD1      PHE   3 -13.495   3.414   3.414
   21    HD2  PHE   3           HD2      PHE   3  -9.199   3.493   3.493
   22    HE1  PHE   3           HE1      PHE   3 -13.389   2.325   2.325
   23    HE2  PHE   3           HE2      PHE   3  -9.105   2.390   2.390
   24    HZ   PHE   3           HZ       PHE   3 -11.202   1.795   1.795
   25    H    SER   4           H        SER   4 -14.048   6.039   6.039
   26    HA   SER   4           HA       SER   4 -12.399   6.281   6.281
   27   1HB   SER   4          2HB       SER   4 -14.962   5.701   5.701
   28   2HB   SER   4          1HB       SER   4 -15.153   7.441   7.441
   29    HG   SER   4           HG       SER   4 -15.199   6.493   6.493
   30    H    GLY   5           H        GLY   5 -11.168   7.960   7.960
   31   1HA   GLY   5          2HA       GLY   5 -11.906  10.564  10.564
   32   2HA   GLY   5          1HA       GLY   5 -11.459  10.577  10.577
   33    H    ASN   6           H        ASN   6  -9.750  12.082  12.082
   34    HA   ASN   6           HA       ASN   6  -7.482  10.526  10.526
   35   1HB   ASN   6          2HB       ASN   6  -8.165  13.465  13.465
   36   2HB   ASN   6          1HB       ASN   6  -6.485  12.972  12.972
   37   1HD2  ASN   6          2HD2      ASN   6  -7.359  11.318  11.318
   38   2HD2  ASN   6          1HD2      ASN   6  -6.614  10.860  10.860
   39    H    TRP   7           H        TRP   7  -5.287  11.186  11.186
   40    HA   TRP   7           HA       TRP   7  -5.656  11.768  11.768
   41   1HB   TRP   7          2HB       TRP   7  -4.592   9.150   9.150
   42   2HB   TRP   7          1HB       TRP   7  -4.456   9.654   9.654
   43    HD1  TRP   7           HD1      TRP   7  -6.840   8.151   8.151
   44    HE1  TRP   7           HE1      TRP   7  -9.169   7.851   7.851
   45    HE3  TRP   7           HE3      TRP   7  -6.117  10.836  10.836
   46    HZ2  TRP   7           HZ2      TRP   7 -10.532   8.686   8.686
   47    HZ3  TRP   7           HZ3      TRP   7  -7.942  11.111  11.111
   48    HH2  TRP   7           HH2      TRP   7 -10.128  10.035  10.035
   49    H    LYS   8           H        LYS   8  -4.112  13.112  13.112
   50    HA   LYS   8           HA       LYS   8  -1.431  12.913  12.913
   51   1HB   LYS   8          2HB       LYS   8  -2.920  15.314  15.314
   52   2HB   LYS   8          1HB       LYS   8  -1.196  15.343  15.343
   53   1HG   LYS   8          2HG       LYS   8  -1.862  14.473  14.473
   54   2HG   LYS   8          1HG       LYS   8  -3.507  14.943  14.943
   55   1HD   LYS   8          2HD       LYS   8  -2.997  17.208  17.208
   56   2HD   LYS   8          1HD       LYS   8  -1.294  16.921  16.921
   57   1HE   LYS   8          2HE       LYS   8  -0.985  16.026  16.026
   58   2HE   LYS   8          1HE       LYS   8  -2.670  16.411  16.411
   59   1HZ   LYS   8          1HZ       LYS   8  -0.751  18.442  18.442
   60   2HZ   LYS   8          3HZ       LYS   8  -0.962  18.117  18.117
   61   3HZ   LYS   8          2HZ       LYS   8  -2.266  18.693  18.693
   62    H    ILE   9           H        ILE   9  -0.110  11.940  11.940
   63    HA   ILE   9           HA       ILE   9  -0.519  11.356  11.356
   64    HB   ILE   9           HB       ILE   9   1.148  10.266  10.266
   65   1HG1  ILE   9          2HG1      ILE   9   2.454  11.744  11.744
   66   2HG1  ILE   9          1HG1      ILE   9   1.534  10.246  10.246
   67   1HG2  ILE   9          2HG2      ILE   9   2.442  13.001  13.001
   68   2HG2  ILE   9          1HG2      ILE   9   3.312  11.540  11.540
   69   3HG2  ILE   9          3HG2      ILE   9   1.902  12.052  12.052
   70   1HD1  ILE   9          1HD1      ILE   9   3.996  10.521  10.521
   71   2HD1  ILE   9          3HD1      ILE   9   4.062   9.961   9.961
   72   3HD1  ILE   9          2HD1      ILE   9   3.170   9.035   9.035
   73    H    ILE  10           H        ILE  10   0.469  12.152  12.152
   74    HA   ILE  10           HA       ILE  10   1.306  15.012  15.012
   75    HB   ILE  10           HB       ILE  10  -0.002  15.403  15.403
   76   1HG1  ILE  10          2HG1      ILE  10  -1.863  13.416  13.416
   77   2HG1  ILE  10          1HG1      ILE  10  -0.442  12.483  12.483
   78   1HG2  ILE  10          3HG2      ILE  10  -1.363  14.442  14.442
   79   2HG2  ILE  10          2HG2      ILE  10  -2.327  14.984  14.984
   80   3HG2  ILE  10          1HG2      ILE  10  -1.187  16.089  16.089
   81   1HD1  ILE  10          2HD1      ILE  10   0.662  14.083  14.083
   82   2HD1  ILE  10          1HD1      ILE  10  -0.985  13.972  13.972
   83   3HD1  ILE  10          3HD1      ILE  10  -0.038  12.506  12.506
   84    H    ARG  11           H        ARG  11   1.447  11.845  11.845
   85    HA   ARG  11           HA       ARG  11   4.080  12.602  12.602
   86   1HB   ARG  11          2HB       ARG  11   2.124  12.952  12.952
   87   2HB   ARG  11          1HB       ARG  11   2.096  11.190  11.190
   88   1HG   ARG  11          2HG       ARG  11   4.237  11.058  11.058
   89   2HG   ARG  11          1HG       ARG  11   4.712  12.636  12.636
   90   1HD   ARG  11          2HD       ARG  11   4.343  13.270  13.270
   91   2HD   ARG  11          1HD       ARG  11   2.678  13.397  13.397
   92    HE   ARG  11           HE       ARG  11   3.648  10.864  10.864
   93   1HH1  ARG  11          1HH2      ARG  11   0.994  10.404  10.404
   94   2HH1  ARG  11          2HH2      ARG  11   0.110  11.177  11.177
   95   1HH2  ARG  11          2HH1      ARG  11   2.739  13.236  13.236
   96   2HH2  ARG  11          1HH1      ARG  11   1.098  12.781  12.781
   97    H    SER  12           H        SER  12   5.113  10.513  10.513
   98    HA   SER  12           HA       SER  12   4.139   7.925   7.925
   99   1HB   SER  12          2HB       SER  12   5.617   7.456   7.456
  100   2HB   SER  12          1HB       SER  12   4.493   8.758   8.758
  101    HG   SER  12           HG       SER  12   7.009   8.888   8.888
  102    H    GLU  13           H        GLU  13   5.750   6.260   6.260
  103    HA   GLU  13           HA       GLU  13   8.359   7.081   7.081
  104   1HB   GLU  13          2HB       GLU  13   7.873   5.914   5.914
  105   2HB   GLU  13          1HB       GLU  13   7.030   7.444   7.444
  106   1HG   GLU  13          2HG       GLU  13   5.555   5.113   5.113
  107   2HG   GLU  13          1HG       GLU  13   5.818   5.070   5.070
  108    H    ASN  14           H        ASN  14   9.561   5.058   5.058
  109    HA   ASN  14           HA       ASN  14  10.417   2.928   2.928
  110   1HB   ASN  14          2HB       ASN  14   7.573   2.194   2.194
  111   2HB   ASN  14          1HB       ASN  14   8.859   1.123   1.123
  112   1HD2  ASN  14          2HD2      ASN  14   6.538   2.752   2.752
  113   2HD2  ASN  14          1HD2      ASN  14   6.131   2.628   2.628
  114    H    PHE  15           H        PHE  15   9.906   4.969   4.969
  115    HA   PHE  15           HA       PHE  15   9.200   3.500   3.500
  116   1HB   PHE  15          2HB       PHE  15   9.352   6.063   6.063
  117   2HB   PHE  15          1HB       PHE  15  11.079   5.865   5.865
  118    HD1  PHE  15           HD2      PHE  15  10.281   3.359   3.359
  119    HD2  PHE  15           HD1      PHE  15   9.419   7.560   7.560
  120    HE1  PHE  15           HE2      PHE  15   9.970   3.446   3.446
  121    HE2  PHE  15           HE1      PHE  15   9.101   7.625   7.625
  122    HZ   PHE  15           HZ       PHE  15   9.377   5.553   5.553
  123    H    GLU  16           H        GLU  16  12.456   4.654   4.654
  124    HA   GLU  16           HA       GLU  16  13.915   3.046   3.046
  125   1HB   GLU  16          2HB       GLU  16  14.646   4.946   4.946
  126   2HB   GLU  16          1HB       GLU  16  15.064   3.536   3.536
  127   1HG   GLU  16          2HG       GLU  16  16.679   2.803   2.803
  128   2HG   GLU  16          1HG       GLU  16  15.921   3.616   3.616
  129    H    GLU  17           H        GLU  17  12.417   2.255   2.255
  130    HA   GLU  17           HA       GLU  17  13.820  -0.153  -0.153
  131   1HB   GLU  17          2HB       GLU  17  10.983   0.678   0.678
  132   2HB   GLU  17          1HB       GLU  17  11.825  -0.683  -0.683
  133   1HG   GLU  17          2HG       GLU  17  13.685   1.170   1.170
  134   2HG   GLU  17          1HG       GLU  17  12.288   2.242   2.242
  135    H    LEU  18           H        LEU  18  10.970   0.531   0.531
  136    HA   LEU  18           HA       LEU  18  10.486  -2.256  -2.256
  137   1HB   LEU  18          2HB       LEU  18   8.877  -0.093  -0.093
  138   2HB   LEU  18          1HB       LEU  18   9.414  -0.089  -0.089
  139    HG   LEU  18           HG       LEU  18   8.746  -2.478  -2.478
  140   1HD1  LEU  18          3HD1      LEU  18   8.077  -2.008  -2.008
  141   2HD1  LEU  18          2HD1      LEU  18   7.062  -3.111  -3.111
  142   3HD1  LEU  18          1HD1      LEU  18   8.791  -3.426  -3.426
  143   1HD2  LEU  18          3HD2      LEU  18   7.153  -0.253  -0.253
  144   2HD2  LEU  18          2HD2      LEU  18   6.626  -1.873  -1.873
  145   3HD2  LEU  18          1HD2      LEU  18   6.256  -1.243  -1.243
  146    H    LEU  19           H        LEU  19  12.569   0.214   0.214
  147    HA   LEU  19           HA       LEU  19  12.765  -1.123  -1.123
  148   1HB   LEU  19          2HB       LEU  19  14.464   1.169   1.169
  149   2HB   LEU  19          1HB       LEU  19  14.223   0.682   0.682
  150    HG   LEU  19           HG       LEU  19  12.299   2.119   2.119
  151   1HD1  LEU  19          1HD1      LEU  19  13.291   2.546   2.546
  152   2HD1  LEU  19          3HD1      LEU  19  12.157   3.598   3.598
  153   3HD1  LEU  19          2HD1      LEU  19  13.810   3.423   3.423
  154   1HD2  LEU  19          1HD2      LEU  19  11.629   0.166   0.166
  155   2HD2  LEU  19          3HD2      LEU  19  10.621   0.799   0.799
  156   3HD2  LEU  19          2HD2      LEU  19  10.848   1.733   1.733
  157    H    LYS  20           H        LYS  20  14.268  -1.226  -1.226
  158    HA   LYS  20           HA       LYS  20  16.788  -2.368  -2.368
  159   1HB   LYS  20          2HB       LYS  20  15.814  -2.326  -2.326
  160   2HB   LYS  20          1HB       LYS  20  17.473  -2.490  -2.490
  161   1HG   LYS  20          2HG       LYS  20  16.294  -0.065  -0.065
  162   2HG   LYS  20          1HG       LYS  20  16.126  -0.098  -0.098
  163   1HD   LYS  20          2HD       LYS  20  18.714  -0.545  -0.545
  164   2HD   LYS  20          1HD       LYS  20  18.250   0.960   0.960
  165   1HE   LYS  20          2HE       LYS  20  17.936  -1.181  -1.181
  166   2HE   LYS  20          1HE       LYS  20  19.538  -1.306  -1.306
  167   1HZ   LYS  20          3HZ       LYS  20  19.767   1.132   1.132
  168   2HZ   LYS  20          2HZ       LYS  20  18.351   1.029   1.029
  169   3HZ   LYS  20          1HZ       LYS  20  19.732   0.145   0.145
  170    H    VAL  21           H        VAL  21  13.687  -3.355  -3.355
  171    HA   VAL  21           HA       VAL  21  14.420  -6.151  -6.151
  172    HB   VAL  21           HB       VAL  21  12.602  -5.001  -5.001
  173   1HG1  VAL  21          2HG1      VAL  21  11.748  -3.632  -3.632
  174   2HG1  VAL  21          1HG1      VAL  21  11.058  -5.085  -5.085
  175   3HG1  VAL  21          3HG1      VAL  21  10.480  -4.500  -4.500
  176   1HG2  VAL  21          3HG2      VAL  21  12.145  -7.453  -7.453
  177   2HG2  VAL  21          2HG2      VAL  21  12.343  -7.307  -7.307
  178   3HG2  VAL  21          1HG2      VAL  21  10.817  -6.848  -6.848
  179    H    LEU  22           H        LEU  22  12.741  -4.182  -4.182
  180    HA   LEU  22           HA       LEU  22  11.947  -6.268  -6.268
  181   1HB   LEU  22          2HB       LEU  22  12.150  -3.310  -3.310
  182   2HB   LEU  22          1HB       LEU  22  12.274  -4.028  -4.028
  183    HG   LEU  22           HG       LEU  22  10.117  -5.076  -5.076
  184   1HD1  LEU  22          3HD1      LEU  22  10.370  -5.635  -5.635
  185   2HD1  LEU  22          2HD1      LEU  22   9.964  -3.961  -3.961
  186   3HD1  LEU  22          1HD1      LEU  22   8.788  -4.998  -4.998
  187   1HD2  LEU  22          2HD2      LEU  22  10.455  -2.457  -2.457
  188   2HD2  LEU  22          1HD2      LEU  22   8.837  -3.143  -3.143
  189   3HD2  LEU  22          3HD2      LEU  22   9.605  -2.403  -2.403
  190    H    GLY  23           H        GLY  23  14.595  -3.936  -3.936
  191   1HA   GLY  23          2HA       GLY  23  15.972  -5.537  -5.537
  192   2HA   GLY  23          1HA       GLY  23  16.319  -3.855  -3.855
  193    H    VAL  24           H        VAL  24  18.511  -4.227  -4.227
  194    HA   VAL  24           HA       VAL  24  19.310  -5.242  -5.242
  195    HB   VAL  24           HB       VAL  24  21.078  -6.726  -6.726
  196   1HG1  VAL  24          3HG1      VAL  24  18.813  -7.525  -7.525
  197   2HG1  VAL  24          2HG1      VAL  24  18.288  -7.547  -7.547
  198   3HG1  VAL  24          1HG1      VAL  24  19.607  -8.593  -8.593
  199   1HG2  VAL  24          1HG2      VAL  24  19.477  -6.193  -6.193
  200   2HG2  VAL  24          3HG2      VAL  24  21.168  -5.775  -5.775
  201   3HG2  VAL  24          2HG2      VAL  24  20.686  -7.468  -7.468
  202    H    ASN  25           H        ASN  25  20.242  -3.765  -3.765
  203    HA   ASN  25           HA       ASN  25  22.855  -2.911  -2.911
  204   1HB   ASN  25          2HB       ASN  25  21.405  -2.831  -2.831
  205   2HB   ASN  25          1HB       ASN  25  21.192  -1.169  -1.169
  206   1HD2  ASN  25          2HD2      ASN  25  24.366  -0.243  -0.243
  207   2HD2  ASN  25          1HD2      ASN  25  22.785   0.211   0.211
  208    H    VAL  26           H        VAL  26  22.512  -0.005  -0.005
  209    HA   VAL  26           HA       VAL  26  21.219   0.857   0.857
  210    HB   VAL  26           HB       VAL  26  23.714   2.206   2.206
  211   1HG1  VAL  26          1HG1      VAL  26  22.085   2.924   2.924
  212   2HG1  VAL  26          3HG1      VAL  26  22.910   1.665   1.665
  213   3HG1  VAL  26          2HG1      VAL  26  23.827   3.020   3.020
  214   1HG2  VAL  26          3HG2      VAL  26  23.630  -0.310  -0.310
  215   2HG2  VAL  26          2HG2      VAL  26  24.363  -0.156  -0.156
  216   3HG2  VAL  26          1HG2      VAL  26  25.055   0.705   0.705
  217    H    MET  27           H        MET  27  22.650   1.987   1.987
  218    HA   MET  27           HA       MET  27  21.219   4.498   4.498
  219   1HB   MET  27          2HB       MET  27  23.283   3.752   3.752
  220   2HB   MET  27          1HB       MET  27  22.085   3.030   3.030
  221   1HG   MET  27          2HG       MET  27  20.956   5.217   5.217
  222   2HG   MET  27          1HG       MET  27  22.162   5.938   5.938
  223   1HE   MET  27          1HE       MET  27  24.399   6.331   6.331
  224   2HE   MET  27          3HE       MET  27  25.087   6.720   6.720
  225   3HE   MET  27          2HE       MET  27  23.682   7.602   7.602
  226    H    LEU  28           H        LEU  28  20.529   1.240   1.240
  227    HA   LEU  28           HA       LEU  28  18.323   1.508   1.508
  228   1HB   LEU  28          2HB       LEU  28  19.373  -0.472  -0.472
  229   2HB   LEU  28          1HB       LEU  28  17.679  -0.671  -0.671
  230    HG   LEU  28           HG       LEU  28  18.249  -0.863  -0.863
  231   1HD1  LEU  28          3HD1      LEU  28  21.037  -0.109  -0.109
  232   2HD1  LEU  28          2HD1      LEU  28  20.718  -0.841  -0.841
  233   3HD1  LEU  28          1HD1      LEU  28  20.028   0.733   0.733
  234   1HD2  LEU  28          2HD2      LEU  28  19.465  -2.568  -2.568
  235   2HD2  LEU  28          1HD2      LEU  28  18.590  -3.022  -3.022
  236   3HD2  LEU  28          3HD2      LEU  28  20.314  -2.665  -2.665
  237    H    ARG  29           H        ARG  29  18.478   1.822   1.822
  238    HA   ARG  29           HA       ARG  29  15.565   1.993   1.993
  239   1HB   ARG  29          2HB       ARG  29  17.722   2.666   2.666
  240   2HB   ARG  29          1HB       ARG  29  16.022   2.351   2.351
  241   1HG   ARG  29          2HG       ARG  29  16.441   0.145   0.145
  242   2HG   ARG  29          1HG       ARG  29  17.051   0.132   0.132
  243   1HD   ARG  29          2HD       ARG  29  18.714  -0.666  -0.666
  244   2HD   ARG  29          1HD       ARG  29  19.280   0.684   0.684
  245    HE   ARG  29           HE       ARG  29  18.016   1.646   1.646
  246   1HH1  ARG  29          2HH1      ARG  29  20.394  -0.650  -0.650
  247   2HH1  ARG  29          1HH1      ARG  29  21.638   0.319   0.319
  248   1HH2  ARG  29          1HH2      ARG  29  19.817   3.265   3.265
  249   2HH2  ARG  29          2HH2      ARG  29  21.312   2.537   2.537
  250    H    LYS  30           H        LYS  30  18.324   4.231   4.231
  251    HA   LYS  30           HA       LYS  30  16.790   6.542   6.542
  252   1HB   LYS  30          2HB       LYS  30  19.442   6.021   6.021
  253   2HB   LYS  30          1HB       LYS  30  19.257   6.930   6.930
  254   1HG   LYS  30          2HG       LYS  30  18.758   8.881   8.881
  255   2HG   LYS  30          1HG       LYS  30  17.875   8.060   8.060
  256   1HD   LYS  30          2HD       LYS  30  20.863   7.763   7.763
  257   2HD   LYS  30          1HD       LYS  30  20.164   9.179   9.179
  258   1HE   LYS  30          2HE       LYS  30  18.789   7.569   7.569
  259   2HE   LYS  30          1HE       LYS  30  19.798   6.275   6.275
  260   1HZ   LYS  30          1HZ       LYS  30  21.069   8.654   8.654
  261   2HZ   LYS  30          3HZ       LYS  30  20.454   7.454   7.454
  262   3HZ   LYS  30          2HZ       LYS  30  21.655   7.062   7.062
  263    H    ILE  31           H        ILE  31  17.050   4.850   4.850
  264    HA   ILE  31           HA       ILE  31  16.444   7.217   7.217
  265    HB   ILE  31           HB       ILE  31  16.454   4.251   4.251
  266   1HG1  ILE  31          2HG1      ILE  31  18.434   6.274   6.274
  267   2HG1  ILE  31          1HG1      ILE  31  18.624   5.640   5.640
  268   1HG2  ILE  31          1HG2      ILE  31  15.783   6.732   6.732
  269   2HG2  ILE  31          3HG2      ILE  31  16.733   5.503   5.503
  270   3HG2  ILE  31          2HG2      ILE  31  15.147   5.097   5.097
  271   1HD1  ILE  31          3HD1      ILE  31  18.312   3.308   3.308
  272   2HD1  ILE  31          2HD1      ILE  31  18.705   4.155   4.155
  273   3HD1  ILE  31          1HD1      ILE  31  19.867   4.121   4.121
  274    H    ALA  32           H        ALA  32  14.753   4.597   4.597
  275    HA   ALA  32           HA       ALA  32  12.194   5.204   5.204
  276   1HB   ALA  32          2HB       ALA  32  13.281   3.052   3.052
  277   2HB   ALA  32          1HB       ALA  32  11.811   3.629   3.629
  278   3HB   ALA  32          3HB       ALA  32  11.764   3.098   3.098
  279    H    VAL  33           H        VAL  33  13.965   6.168   6.168
  280    HA   VAL  33           HA       VAL  33  11.654   7.252   7.252
  281    HB   VAL  33           HB       VAL  33  14.544   7.983   7.983
  282   1HG1  VAL  33          1HG1      VAL  33  12.323   8.939   8.939
  283   2HG1  VAL  33          3HG1      VAL  33  12.518   7.488   7.488
  284   3HG1  VAL  33          2HG1      VAL  33  13.810   8.687   8.687
  285   1HG2  VAL  33          2HG2      VAL  33  13.372   5.338   5.338
  286   2HG2  VAL  33          1HG2      VAL  33  15.026   5.830   5.830
  287   3HG2  VAL  33          3HG2      VAL  33  13.799   5.874   5.874
  288    H    ALA  34           H        ALA  34  14.374   8.475   8.475
  289    HA   ALA  34           HA       ALA  34  13.629  11.244  11.244
  290   1HB   ALA  34          2HB       ALA  34  15.883  10.150  10.150
  291   2HB   ALA  34          1HB       ALA  34  15.105  10.037  10.037
  292   3HB   ALA  34          3HB       ALA  34  15.342  11.613  11.613
  293    H    ALA  35           H        ALA  35  12.996   8.624   8.624
  294    HA   ALA  35           HA       ALA  35  11.564  10.088  10.088
  295   1HB   ALA  35          3HB       ALA  35  11.442   7.206   7.206
  296   2HB   ALA  35          2HB       ALA  35  10.498   7.798   7.798
  297   3HB   ALA  35          1HB       ALA  35  12.260   7.845   7.845
  298    H    ALA  36           H        ALA  36  10.426   8.309   8.309
  299    HA   ALA  36           HA       ALA  36   7.670   9.249   9.249
  300   1HB   ALA  36          1HB       ALA  36   9.122   7.388   7.388
  301   2HB   ALA  36          3HB       ALA  36   7.612   8.082   8.082
  302   3HB   ALA  36          2HB       ALA  36   7.632   7.130   7.130
  303    H    SER  37           H        SER  37   9.379  11.500  11.500
  304    HA   SER  37           HA       SER  37   9.677  12.395  12.395
  305   1HB   SER  37          2HB       SER  37   9.927  14.612  14.612
  306   2HB   SER  37          1HB       SER  37  10.689  13.482  13.482
  307    HG   SER  37           HG       SER  37   9.405  14.647  14.647
  308    H    LYS  38           H        LYS  38   7.012  12.451  12.451
  309    HA   LYS  38           HA       LYS  38   5.036  12.706  12.706
  310   1HB   LYS  38          2HB       LYS  38   5.780  15.084  15.084
  311   2HB   LYS  38          1HB       LYS  38   4.084  14.840  14.840
  312   1HG   LYS  38          2HG       LYS  38   5.175  14.436  14.436
  313   2HG   LYS  38          1HG       LYS  38   6.383  15.532  15.532
  314   1HD   LYS  38          2HD       LYS  38   4.939  17.308  17.308
  315   2HD   LYS  38          1HD       LYS  38   3.549  16.296  16.296
  316   1HE   LYS  38          2HE       LYS  38   3.792  15.396  15.396
  317   2HE   LYS  38          1HE       LYS  38   4.782  16.829  16.829
  318   1HZ   LYS  38          3HZ       LYS  38   2.846  18.090  18.090
  319   2HZ   LYS  38          2HZ       LYS  38   1.935  16.679  16.679
  320   3HZ   LYS  38          1HZ       LYS  38   2.633  17.490  17.490
  321    HA   PRO  39           HA       PRO  39   3.975  10.672  10.672
  322   1HB   PRO  39          2HB       PRO  39   3.224   8.262   8.262
  323   2HB   PRO  39          1HB       PRO  39   4.872   8.640   8.640
  324   1HG   PRO  39          2HG       PRO  39   3.774   8.493   8.493
  325   2HG   PRO  39          1HG       PRO  39   5.424   8.194   8.194
  326   1HD   PRO  39          2HD       PRO  39   4.554  10.539  10.539
  327   2HD   PRO  39          1HD       PRO  39   6.046  10.377  10.377
  328    H    ALA  40           H        ALA  40   1.866  10.332  10.332
  329    HA   ALA  40           HA       ALA  40  -0.320  11.137  11.137
  330   1HB   ALA  40          1HB       ALA  40  -0.002  11.272  11.272
  331   2HB   ALA  40          3HB       ALA  40  -1.560  11.512  11.512
  332   3HB   ALA  40          2HB       ALA  40  -0.220  12.609  12.609
  333    H    VAL  41           H        VAL  41  -2.503  10.112  10.112
  334    HA   VAL  41           HA       VAL  41  -2.284   7.379   7.379
  335    HB   VAL  41           HB       VAL  41  -3.012   8.013   8.013
  336   1HG1  VAL  41          1HG1      VAL  41  -3.480   5.482   5.482
  337   2HG1  VAL  41          3HG1      VAL  41  -3.534   5.553   5.553
  338   3HG1  VAL  41          2HG1      VAL  41  -4.697   6.472   6.472
  339   1HG2  VAL  41          2HG2      VAL  41  -0.927   6.294   6.294
  340   2HG2  VAL  41          1HG2      VAL  41  -0.668   7.652   7.652
  341   3HG2  VAL  41          3HG2      VAL  41  -1.328   6.135   6.135
  342    H    GLU  42           H        GLU  42  -4.521   6.438   6.438
  343    HA   GLU  42           HA       GLU  42  -6.756   8.353   8.353
  344   1HB   GLU  42          2HB       GLU  42  -5.815   8.861   8.861
  345   2HB   GLU  42          1HB       GLU  42  -5.945   7.163   7.163
  346   1HG   GLU  42          2HG       GLU  42  -8.390   7.272   7.272
  347   2HG   GLU  42          1HG       GLU  42  -8.269   8.959   8.959
  348    H    ILE  43           H        ILE  43  -8.134   7.081   7.081
  349    HA   ILE  43           HA       ILE  43  -8.211   4.178   4.178
  350    HB   ILE  43           HB       ILE  43  -9.218   5.841   5.841
  351   1HG1  ILE  43          2HG1      ILE  43  -7.554   3.549   3.549
  352   2HG1  ILE  43          1HG1      ILE  43  -6.765   4.536   4.536
  353   1HG2  ILE  43          1HG2      ILE  43  -9.874   3.018   3.018
  354   2HG2  ILE  43          3HG2      ILE  43  -9.653   3.403   3.403
  355   3HG2  ILE  43          2HG2      ILE  43 -10.894   4.234   4.234
  356   1HD1  ILE  43          2HD1      ILE  43  -7.980   6.120   6.120
  357   2HD1  ILE  43          1HD1      ILE  43  -6.711   5.033   5.033
  358   3HD1  ILE  43          3HD1      ILE  43  -6.363   6.218   6.218
  359    H    LYS  44           H        LYS  44  -9.907   3.241   3.241
  360    HA   LYS  44           HA       LYS  44 -12.319   4.911   4.911
  361   1HB   LYS  44          2HB       LYS  44 -12.031   2.521   2.521
  362   2HB   LYS  44          1HB       LYS  44 -12.329   4.185   4.185
  363   1HG   LYS  44          2HG       LYS  44  -9.950   4.688   4.688
  364   2HG   LYS  44          1HG       LYS  44  -9.586   3.140   3.140
  365   1HD   LYS  44          2HD       LYS  44  -9.998   1.950   1.950
  366   2HD   LYS  44          1HD       LYS  44 -11.048   3.205   3.205
  367   1HE   LYS  44          2HE       LYS  44  -8.790   4.632   4.632
  368   2HE   LYS  44          1HE       LYS  44  -8.070   3.030   3.030
  369   1HZ   LYS  44          1HZ       LYS  44  -9.633   2.708   2.708
  370   2HZ   LYS  44          3HZ       LYS  44  -9.941   4.374   4.374
  371   3HZ   LYS  44          2HZ       LYS  44  -8.368   3.815   3.815
  372    H    GLN  45           H        GLN  45 -13.822   4.268   4.268
  373    HA   GLN  45           HA       GLN  45 -13.839   1.415   1.415
  374   1HB   GLN  45          2HB       GLN  45 -13.845   3.122   3.122
  375   2HB   GLN  45          1HB       GLN  45 -15.351   3.784   3.784
  376   1HG   GLN  45          2HG       GLN  45 -16.441   1.569   1.569
  377   2HG   GLN  45          1HG       GLN  45 -14.949   0.983   0.983
  378   1HE2  GLN  45          2HE2      GLN  45 -16.395   2.061   2.061
  379   2HE2  GLN  45          1HE2      GLN  45 -15.967   0.720   0.720
  380    H    GLU  46           H        GLU  46 -15.235   0.032   0.032
  381    HA   GLU  46           HA       GLU  46 -17.833   1.083   1.083
  382   1HB   GLU  46          2HB       GLU  46 -16.113  -1.166  -1.166
  383   2HB   GLU  46          1HB       GLU  46 -17.740  -0.791  -0.791
  384   1HG   GLU  46          2HG       GLU  46 -15.636   1.359   1.359
  385   2HG   GLU  46          1HG       GLU  46 -15.702   0.229   0.229
  386    H    GLY  47           H        GLY  47 -17.902   0.463   0.463
  387   1HA   GLY  47          2HA       GLY  47 -19.379  -0.855  -0.855
  388   2HA   GLY  47          1HA       GLY  47 -19.393  -2.094  -2.094
  389    H    ASP  48           H        ASP  48 -18.449  -3.931  -3.931
  390    HA   ASP  48           HA       ASP  48 -16.455  -3.863  -3.863
  391   1HB   ASP  48          2HB       ASP  48 -16.274  -6.354  -6.354
  392   2HB   ASP  48          1HB       ASP  48 -17.834  -5.804  -5.804
  393    H    THR  49           H        THR  49 -16.171  -3.177  -3.177
  394    HA   THR  49           HA       THR  49 -13.570  -4.537  -4.537
  395    HB   THR  49           HB       THR  49 -15.393  -3.004  -3.004
  396    HG1  THR  49           HG1      THR  49 -16.042  -4.952  -4.952
  397   1HG2  THR  49          1HG2      THR  49 -12.507  -3.551  -3.551
  398   2HG2  THR  49          3HG2      THR  49 -13.470  -4.082  -4.082
  399   3HG2  THR  49          2HG2      THR  49 -13.513  -2.394  -2.394
  400    H    PHE  50           H        PHE  50 -11.655  -3.391  -3.391
  401    HA   PHE  50           HA       PHE  50 -11.845  -0.430  -0.430
  402   1HB   PHE  50          2HB       PHE  50 -10.214  -2.268  -2.268
  403   2HB   PHE  50          1HB       PHE  50 -10.072  -0.507  -0.507
  404    HD1  PHE  50           HD1      PHE  50 -12.229  -3.357  -3.357
  405    HD2  PHE  50           HD2      PHE  50 -11.873   0.915   0.915
  406    HE1  PHE  50           HE1      PHE  50 -14.240  -3.198  -3.198
  407    HE2  PHE  50           HE2      PHE  50 -13.879   1.078   1.078
  408    HZ   PHE  50           HZ       PHE  50 -15.073  -0.986  -0.986
  409    H    TYR  51           H        TYR  51 -10.745   0.365   0.365
  410    HA   TYR  51           HA       TYR  51  -8.415  -1.098  -1.098
  411   1HB   TYR  51          2HB       TYR  51 -10.358  -0.400  -0.400
  412   2HB   TYR  51          1HB       TYR  51  -9.944   1.271   1.271
  413    HD1  TYR  51           HD1      TYR  51  -7.418   1.914   1.914
  414    HD2  TYR  51           HD2      TYR  51  -9.408  -1.452  -1.452
  415    HE1  TYR  51           HE1      TYR  51  -5.742   1.889   1.889
  416    HE2  TYR  51           HE2      TYR  51  -7.733  -1.466  -1.466
  417    HH   TYR  51           HH       TYR  51  -6.175   0.136   0.136
  418    H    ILE  52           H        ILE  52  -6.380   0.053   0.053
  419    HA   ILE  52           HA       ILE  52  -6.305   2.715   2.715
  420    HB   ILE  52           HB       ILE  52  -4.271   0.688   0.688
  421   1HG1  ILE  52          2HG1      ILE  52  -7.113   0.855   0.855
  422   2HG1  ILE  52          1HG1      ILE  52  -6.397  -0.529  -0.529
  423   1HG2  ILE  52          1HG2      ILE  52  -4.382   3.210   3.210
  424   2HG2  ILE  52          3HG2      ILE  52  -5.730   2.769   2.769
  425   3HG2  ILE  52          2HG2      ILE  52  -4.131   2.078   2.078
  426   1HD1  ILE  52          3HD1      ILE  52  -4.596  -0.324  -0.324
  427   2HD1  ILE  52          2HD1      ILE  52  -5.918   0.492   0.492
  428   3HD1  ILE  52          1HD1      ILE  52  -6.122  -1.166  -1.166
  429    H    LYS  53           H        LYS  53  -5.510   3.801   3.801
  430    HA   LYS  53           HA       LYS  53  -3.139   2.693   2.693
  431   1HB   LYS  53          2HB       LYS  53  -5.348   3.786   3.786
  432   2HB   LYS  53          1HB       LYS  53  -4.419   5.263   5.263
  433   1HG   LYS  53          2HG       LYS  53  -2.504   3.675   3.675
  434   2HG   LYS  53          1HG       LYS  53  -3.935   3.004   3.004
  435   1HD   LYS  53          2HD       LYS  53  -4.535   5.122   5.122
  436   2HD   LYS  53          1HD       LYS  53  -3.363   5.973   5.973
  437   1HE   LYS  53          2HE       LYS  53  -1.541   4.669   4.669
  438   2HE   LYS  53          1HE       LYS  53  -2.767   4.049   4.049
  439   1HZ   LYS  53          1HZ       LYS  53  -2.248   6.935   6.935
  440   2HZ   LYS  53          3HZ       LYS  53  -1.575   6.041   6.041
  441   3HZ   LYS  53          2HZ       LYS  53  -3.258   6.247   6.247
  442    H    THR  54           H        THR  54  -1.240   3.317   3.317
  443    HA   THR  54           HA       THR  54  -1.055   6.004   6.004
  444    HB   THR  54           HB       THR  54   0.983   3.757   3.757
  445    HG1  THR  54           HG1      THR  54  -1.149   4.368   4.368
  446   1HG2  THR  54          2HG2      THR  54   1.101   6.446   6.446
  447   2HG2  THR  54          1HG2      THR  54   0.892   5.500   5.500
  448   3HG2  THR  54          3HG2      THR  54   2.241   5.159   5.159
  449    H    SER  55           H        SER  55   0.513   7.511   7.511
  450    HA   SER  55           HA       SER  55   2.079   6.765   6.765
  451   1HB   SER  55          2HB       SER  55   1.364   9.212   9.212
  452   2HB   SER  55          1HB       SER  55   0.362   7.812   7.812
  453    HG   SER  55           HG       SER  55   0.035   9.797   9.797
  454    H    THR  56           H        THR  56   4.140   7.280   7.280
  455    HA   THR  56           HA       THR  56   4.764   9.432   9.432
  456    HB   THR  56           HB       THR  56   7.157   8.415   8.415
  457    HG1  THR  56           HG1      THR  56   7.197   6.665   6.665
  458   1HG2  THR  56          1HG2      THR  56   4.866   7.389   7.389
  459   2HG2  THR  56          3HG2      THR  56   6.289   6.352   6.352
  460   3HG2  THR  56          2HG2      THR  56   6.435   7.988   7.988
  461    H    THR  57           H        THR  57   6.159   8.212   8.212
  462    HA   THR  57           HA       THR  57   5.947  10.549  10.549
  463    HB   THR  57           HB       THR  57   7.383  11.676  11.676
  464    HG1  THR  57           HG1      THR  57   8.696  12.422  12.422
  465   1HG2  THR  57          3HG2      THR  57   8.307   9.547   9.547
  466   2HG2  THR  57          2HG2      THR  57   9.378   9.445   9.445
  467   3HG2  THR  57          1HG2      THR  57   9.520  10.797  10.797
  468    H    VAL  58           H        VAL  58   8.028   7.889   7.889
  469    HA   VAL  58           HA       VAL  58   8.436   7.204   7.204
  470    HB   VAL  58           HB       VAL  58  10.272   6.544   6.544
  471   1HG1  VAL  58          3HG1      VAL  58  10.240   5.993   5.993
  472   2HG1  VAL  58          2HG1      VAL  58  11.800   6.324   6.324
  473   3HG1  VAL  58          1HG1      VAL  58  10.813   4.980   4.980
  474   1HG2  VAL  58          2HG2      VAL  58   9.954   8.995   8.995
  475   2HG2  VAL  58          1HG2      VAL  58  10.974   8.689   8.689
  476   3HG2  VAL  58          3HG2      VAL  58  11.565   8.311   8.311
  477    H    ARG  59           H        ARG  59   7.005   6.172   6.172
  478    HA   ARG  59           HA       ARG  59   7.214   3.309   3.309
  479   1HB   ARG  59          2HB       ARG  59   7.698   3.705   3.705
  480   2HB   ARG  59          1HB       ARG  59   6.212   4.628   4.628
  481   1HG   ARG  59          2HG       ARG  59   4.882   2.751   2.751
  482   2HG   ARG  59          1HG       ARG  59   5.939   1.852   1.852
  483   1HD   ARG  59          2HD       ARG  59   5.991   0.944   0.944
  484   2HD   ARG  59          1HD       ARG  59   7.571   1.527   1.527
  485    HE   ARG  59           HE       ARG  59   5.842   3.360   3.360
  486   1HH1  ARG  59          2HH1      ARG  59   8.953   3.057   3.057
  487   2HH1  ARG  59          1HH1      ARG  59   9.627   2.968   2.968
  488   1HH2  ARG  59          1HH2      ARG  59   6.564   2.517   2.517
  489   2HH2  ARG  59          2HH2      ARG  59   8.275   2.663   2.663
  490    H    THR  60           H        THR  60   4.490   4.930   4.930
  491    HA   THR  60           HA       THR  60   2.234   5.108   5.108
  492    HB   THR  60           HB       THR  60   2.929   4.265   4.265
  493    HG1  THR  60           HG1      THR  60   3.611   6.336   6.336
  494   1HG2  THR  60          1HG2      THR  60   0.906   6.102   6.102
  495   2HG2  THR  60          3HG2      THR  60   1.178   6.070   6.070
  496   3HG2  THR  60          2HG2      THR  60   0.594   4.627   4.627
  497    H    THR  61           H        THR  61   1.863   3.223   3.223
  498    HA   THR  61           HA       THR  61   1.543   0.673   0.673
  499    HB   THR  61           HB       THR  61   1.314  -0.259  -0.259
  500    HG1  THR  61           HG1      THR  61   2.329   1.046   1.046
  501   1HG2  THR  61          1HG2      THR  61   3.292  -0.444  -0.444
  502   2HG2  THR  61          3HG2      THR  61   4.017   0.881   0.881
  503   3HG2  THR  61          2HG2      THR  61   3.655  -0.647  -0.647
  504    H    GLU  62           H        GLU  62  -0.358  -0.676  -0.676
  505    HA   GLU  62           HA       GLU  62  -2.609   0.783   0.783
  506   1HB   GLU  62          2HB       GLU  62  -4.050   0.878   0.878
  507   2HB   GLU  62          1HB       GLU  62  -2.525   1.622   1.622
  508   1HG   GLU  62          2HG       GLU  62  -2.030  -0.954  -0.954
  509   2HG   GLU  62          1HG       GLU  62  -3.775  -0.884  -0.884
  510    H    ILE  63           H        ILE  63  -3.706  -0.708  -0.708
  511    HA   ILE  63           HA       ILE  63  -3.643  -3.561  -3.561
  512    HB   ILE  63           HB       ILE  63  -3.978  -4.154  -4.154
  513   1HG1  ILE  63          2HG1      ILE  63  -3.482  -1.198  -1.198
  514   2HG1  ILE  63          1HG1      ILE  63  -5.059  -1.976  -1.976
  515   1HG2  ILE  63          1HG2      ILE  63  -1.680  -3.754  -3.754
  516   2HG2  ILE  63          3HG2      ILE  63  -1.592  -2.326  -2.326
  517   3HG2  ILE  63          2HG2      ILE  63  -1.714  -3.930  -3.930
  518   1HD1  ILE  63          1HD1      ILE  63  -3.689  -3.645  -3.645
  519   2HD1  ILE  63          3HD1      ILE  63  -2.661  -2.226  -2.226
  520   3HD1  ILE  63          2HD1      ILE  63  -4.369  -2.145  -2.145
  521    H    ASN  64           H        ASN  64  -5.696  -4.769  -4.769
  522    HA   ASN  64           HA       ASN  64  -8.043  -3.120  -3.120
  523   1HB   ASN  64          2HB       ASN  64  -9.208  -3.480  -3.480
  524   2HB   ASN  64          1HB       ASN  64  -7.608  -2.875  -2.875
  525   1HD2  ASN  64          2HD2      ASN  64  -8.603  -6.720  -6.720
  526   2HD2  ASN  64          1HD2      ASN  64  -9.524  -5.859  -5.859
  527    H    PHE  65           H        PHE  65  -9.573  -4.375  -4.375
  528    HA   PHE  65           HA       PHE  65  -9.735  -7.276  -7.276
  529   1HB   PHE  65          2HB       PHE  65  -8.982  -7.954  -7.954
  530   2HB   PHE  65          1HB       PHE  65  -7.710  -7.044  -7.044
  531    HD1  PHE  65           HD2      PHE  65  -7.255  -4.678  -4.678
  532    HD2  PHE  65           HD1      PHE  65 -10.106  -7.080  -7.080
  533    HE1  PHE  65           HE2      PHE  65  -7.276  -3.020  -3.020
  534    HE2  PHE  65           HE1      PHE  65 -10.140  -5.427  -5.427
  535    HZ   PHE  65           HZ       PHE  65  -8.727  -3.389  -3.389
  536    H    LYS  66           H        LYS  66 -10.929  -8.219  -8.219
  537    HA   LYS  66           HA       LYS  66 -13.217  -6.427  -6.427
  538   1HB   LYS  66          2HB       LYS  66 -14.651  -8.550  -8.550
  539   2HB   LYS  66          1HB       LYS  66 -14.166  -7.897  -7.897
  540   1HG   LYS  66          2HG       LYS  66 -12.203  -9.501  -9.501
  541   2HG   LYS  66          1HG       LYS  66 -12.939 -10.244 -10.244
  542   1HD   LYS  66          2HD       LYS  66 -13.855 -11.569 -11.569
  543   2HD   LYS  66          1HD       LYS  66 -15.085 -10.309 -10.309
  544   1HE   LYS  66          2HE       LYS  66 -14.245  -9.179  -9.179
  545   2HE   LYS  66          1HE       LYS  66 -12.740 -10.097 -10.097
  546   1HZ   LYS  66          1HZ       LYS  66 -14.240 -12.117 -12.117
  547   2HZ   LYS  66          3HZ       LYS  66 -15.441 -11.009 -11.009
  548   3HZ   LYS  66          2HZ       LYS  66 -13.994 -11.104 -11.104
  549    H    VAL  67           H        VAL  67 -14.137  -6.937  -6.937
  550    HA   VAL  67           HA       VAL  67 -12.082  -8.038  -8.038
  551    HB   VAL  67           HB       VAL  67 -14.712  -7.396  -7.396
  552   1HG1  VAL  67          1HG1      VAL  67 -11.807  -6.720  -6.720
  553   2HG1  VAL  67          3HG1      VAL  67 -13.106  -5.991  -5.991
  554   3HG1  VAL  67          2HG1      VAL  67 -12.868  -7.738  -7.738
  555   1HG2  VAL  67          2HG2      VAL  67 -13.241  -5.427  -5.427
  556   2HG2  VAL  67          1HG2      VAL  67 -14.970  -5.564  -5.564
  557   3HG2  VAL  67          3HG2      VAL  67 -13.905  -4.865  -4.865
  558    H    GLY  68           H        GLY  68 -12.034 -10.291 -10.291
  559   1HA   GLY  68          2HA       GLY  68 -13.399 -12.071 -12.071
  560   2HA   GLY  68          1HA       GLY  68 -14.580 -11.790 -11.790
  561    H    GLU  69           H        GLU  69 -12.371 -11.417 -11.417
  562    HA   GLU  69           HA       GLU  69 -11.554 -14.295 -14.295
  563   1HB   GLU  69          2HB       GLU  69 -12.535 -12.405 -12.405
  564   2HB   GLU  69          1HB       GLU  69 -11.746 -13.942 -13.942
  565   1HG   GLU  69          2HG       GLU  69 -14.183 -13.704 -13.704
  566   2HG   GLU  69          1HG       GLU  69 -14.279 -14.038 -14.038
  567    H    GLU  70           H        GLU  70  -9.540 -14.672 -14.672
  568    HA   GLU  70           HA       GLU  70  -7.577 -12.549 -12.549
  569   1HB   GLU  70          2HB       GLU  70  -5.952 -14.303 -14.303
  570   2HB   GLU  70          1HB       GLU  70  -6.976 -14.823 -14.823
  571   1HG   GLU  70          2HG       GLU  70  -8.151 -15.408 -15.408
  572   2HG   GLU  70          1HG       GLU  70  -6.594 -16.199 -16.199
  573    H    PHE  71           H        PHE  71  -5.884 -12.213 -12.213
  574    HA   PHE  71           HA       PHE  71  -6.794 -12.508 -12.508
  575   1HB   PHE  71          2HB       PHE  71  -6.869 -10.027 -10.027
  576   2HB   PHE  71          1HB       PHE  71  -8.176 -10.607 -10.607
  577    HD1  PHE  71           HD2      PHE  71  -7.870 -10.454 -10.454
  578    HD2  PHE  71           HD1      PHE  71  -5.353  -8.390  -8.390
  579    HE1  PHE  71           HE2      PHE  71  -7.112  -8.928  -8.928
  580    HE2  PHE  71           HE1      PHE  71  -4.595  -6.866  -6.866
  581    HZ   PHE  71           HZ       PHE  71  -5.472  -7.134  -7.134
  582    H    GLU  72           H        GLU  72  -5.251 -11.140 -11.140
  583    HA   GLU  72           HA       GLU  72  -2.518 -11.354 -11.354
  584   1HB   GLU  72          2HB       GLU  72  -2.999 -10.946 -10.946
  585   2HB   GLU  72          1HB       GLU  72  -1.641 -11.719 -11.719
  586   1HG   GLU  72          2HG       GLU  72  -3.138 -13.592 -13.592
  587   2HG   GLU  72          1HG       GLU  72  -4.445 -12.848 -12.848
  588    H    GLU  73           H        GLU  73  -1.166  -9.535  -9.535
  589    HA   GLU  73           HA       GLU  73  -1.966  -7.071  -7.071
  590   1HB   GLU  73          2HB       GLU  73  -2.102  -5.745  -5.745
  591   2HB   GLU  73          1HB       GLU  73  -3.432  -6.886  -6.886
  592   1HG   GLU  73          2HG       GLU  73  -2.766  -8.167  -8.167
  593   2HG   GLU  73          1HG       GLU  73  -1.055  -7.987  -7.987
  594    H    GLN  74           H        GLN  74  -0.456  -5.232  -5.232
  595    HA   GLN  74           HA       GLN  74   2.291  -6.419  -6.419
  596   1HB   GLN  74          2HB       GLN  74   1.111  -3.746  -3.746
  597   2HB   GLN  74          1HB       GLN  74   2.775  -3.777  -3.777
  598   1HG   GLN  74          2HG       GLN  74   3.162  -5.635  -5.635
  599   2HG   GLN  74          1HG       GLN  74   1.632  -5.109  -5.109
  600   1HE2  GLN  74          2HE2      GLN  74   4.967  -2.869  -2.869
  601   2HE2  GLN  74          1HE2      GLN  74   5.012  -4.319  -4.319
  602    H    THR  75           H        THR  75   3.899  -5.588  -5.588
  603    HA   THR  75           HA       THR  75   2.609  -5.207  -5.207
  604    HB   THR  75           HB       THR  75   4.345  -7.024  -7.024
  605    HG1  THR  75           HG1      THR  75   3.726  -6.186  -6.186
  606   1HG2  THR  75          1HG2      THR  75   5.895  -4.796  -4.796
  607   2HG2  THR  75          3HG2      THR  75   6.632  -5.424  -5.424
  608   3HG2  THR  75          2HG2      THR  75   6.383  -6.485  -6.485
  609    H    VAL  76           H        VAL  76   5.126  -3.946  -3.946
  610    HA   VAL  76           HA       VAL  76   4.465  -1.193  -1.193
  611    HB   VAL  76           HB       VAL  76   4.339  -1.788  -1.788
  612   1HG1  VAL  76          1HG1      VAL  76   6.884  -3.013  -3.013
  613   2HG1  VAL  76          3HG1      VAL  76   7.083  -1.833  -1.833
  614   3HG1  VAL  76          2HG1      VAL  76   5.904  -3.132  -3.132
  615   1HG2  VAL  76          2HG2      VAL  76   4.930   0.533   0.533
  616   2HG2  VAL  76          1HG2      VAL  76   5.561   0.143   0.143
  617   3HG2  VAL  76          3HG2      VAL  76   6.632   0.116   0.116
  618    H    ASP  77           H        ASP  77   7.058  -3.506  -3.506
  619    HA   ASP  77           HA       ASP  77   9.041  -1.420  -1.420
  620   1HB   ASP  77          2HB       ASP  77   9.320  -3.822  -3.822
  621   2HB   ASP  77          1HB       ASP  77   9.710  -4.269  -4.269
  622    H    GLY  78           H        GLY  78   7.605  -4.258  -4.258
  623   1HA   GLY  78          2HA       GLY  78   6.801  -3.402  -3.402
  624   2HA   GLY  78          1HA       GLY  78   8.546  -3.304  -3.304
  625    H    ARG  79           H        ARG  79   6.647  -5.737  -5.737
  626    HA   ARG  79           HA       ARG  79   7.613  -7.791  -7.791
  627   1HB   ARG  79          2HB       ARG  79   7.729  -7.709  -7.709
  628   2HB   ARG  79          1HB       ARG  79   7.574  -9.255  -9.255
  629   1HG   ARG  79          2HG       ARG  79   9.572  -7.962  -7.962
  630   2HG   ARG  79          1HG       ARG  79   9.897  -7.489  -7.489
  631   1HD   ARG  79          2HD       ARG  79   9.460 -10.354 -10.354
  632   2HD   ARG  79          1HD       ARG  79  11.048  -9.616  -9.616
  633    HE   ARG  79           HE       ARG  79   9.145  -9.679  -9.679
  634   1HH1  ARG  79          2HH1      ARG  79  11.295 -11.805 -11.805
  635   2HH1  ARG  79          1HH1      ARG  79  12.399 -11.829 -11.829
  636   1HH2  ARG  79          1HH2      ARG  79  10.922  -9.135  -9.135
  637   2HH2  ARG  79          2HH2      ARG  79  12.187 -10.317 -10.317
  638    HA   PRO  80           HA       PRO  80   3.341  -8.944  -8.944
  639   1HB   PRO  80          2HB       PRO  80   3.555 -11.559 -11.559
  640   2HB   PRO  80          1HB       PRO  80   3.754 -10.166 -10.166
  641   1HG   PRO  80          2HG       PRO  80   5.832 -11.987 -11.987
  642   2HG   PRO  80          1HG       PRO  80   5.861 -11.034 -11.034
  643   1HD   PRO  80          2HD       PRO  80   7.172 -10.368 -10.368
  644   2HD   PRO  80          1HD       PRO  80   6.915  -9.283  -9.283
  645    H    CYS  81           H        CYS  81   1.892  -9.803  -9.803
  646    HA   CYS  81           HA       CYS  81   2.519 -12.106 -12.106
  647   1HB   CYS  81          2HB       CYS  81   2.208 -10.838 -10.838
  648   2HB   CYS  81          1HB       CYS  81   3.713 -10.462 -10.462
  649    HG   CYS  81           HG       CYS  81   1.256  -8.581  -8.581
  650    H    LYS  82           H        LYS  82   0.635 -13.015 -13.015
  651    HA   LYS  82           HA       LYS  82  -1.893 -11.838 -11.838
  652   1HB   LYS  82          2HB       LYS  82  -1.481 -14.243 -14.243
  653   2HB   LYS  82          1HB       LYS  82  -1.291 -14.454 -14.454
  654   1HG   LYS  82          2HG       LYS  82  -3.680 -13.393 -13.393
  655   2HG   LYS  82          1HG       LYS  82  -3.774 -13.881 -13.881
  656   1HD   LYS  82          2HD       LYS  82  -2.739 -15.920 -15.920
  657   2HD   LYS  82          1HD       LYS  82  -4.453 -15.530 -15.530
  658   1HE   LYS  82          2HE       LYS  82  -4.639 -15.883 -15.883
  659   2HE   LYS  82          1HE       LYS  82  -2.983 -16.489 -16.489
  660   1HZ   LYS  82          1HZ       LYS  82  -5.167 -17.589 -17.589
  661   2HZ   LYS  82          3HZ       LYS  82  -4.723 -18.234 -18.234
  662   3HZ   LYS  82          2HZ       LYS  82  -3.612 -18.236 -18.236
  663    H    SER  83           H        SER  83  -2.914 -10.436 -10.436
  664    HA   SER  83           HA       SER  83  -2.344 -10.481 -10.481
  665   1HB   SER  83          2HB       SER  83  -2.054  -8.302  -8.302
  666   2HB   SER  83          1HB       SER  83  -3.392  -8.443  -8.443
  667    HG   SER  83           HG       SER  83  -3.840  -7.137  -7.137
  668    H    LEU  84           H        LEU  84  -4.278  -9.929  -9.929
  669    HA   LEU  84           HA       LEU  84  -6.894 -10.851 -10.851
  670   1HB   LEU  84          2HB       LEU  84  -5.839 -12.936 -12.936
  671   2HB   LEU  84          1HB       LEU  84  -5.520 -12.158 -12.158
  672    HG   LEU  84           HG       LEU  84  -7.941 -11.873 -11.873
  673   1HD1  LEU  84          2HD1      LEU  84  -8.599 -11.711 -11.711
  674   2HD1  LEU  84          1HD1      LEU  84  -8.261 -13.430 -13.430
  675   3HD1  LEU  84          3HD1      LEU  84  -9.561 -12.894 -12.894
  676   1HD2  LEU  84          1HD2      LEU  84  -6.781 -13.972 -13.972
  677   2HD2  LEU  84          3HD2      LEU  84  -8.492 -14.217 -14.217
  678   3HD2  LEU  84          2HD2      LEU  84  -7.271 -14.709 -14.709
  679    H    VAL  85           H        VAL  85  -8.643 -10.095 -10.095
  680    HA   VAL  85           HA       VAL  85  -7.682  -8.344  -8.344
  681    HB   VAL  85           HB       VAL  85  -9.467  -7.309  -7.309
  682   1HG1  VAL  85          1HG1      VAL  85  -8.803  -6.381  -6.381
  683   2HG1  VAL  85          3HG1      VAL  85  -8.261  -5.217  -5.217
  684   3HG1  VAL  85          2HG1      VAL  85  -9.952  -5.713  -5.713
  685   1HG2  VAL  85          1HG2      VAL  85  -6.512  -7.006  -7.006
  686   2HG2  VAL  85          3HG2      VAL  85  -7.292  -7.551  -7.551
  687   3HG2  VAL  85          2HG2      VAL  85  -7.403  -5.860  -5.860
  688    H    LYS  86           H        LYS  86  -8.968  -8.398  -8.398
  689    HA   LYS  86           HA       LYS  86 -11.827  -9.175  -9.175
  690   1HB   LYS  86          2HB       LYS  86 -11.418 -10.019 -10.019
  691   2HB   LYS  86          1HB       LYS  86 -11.125 -11.075 -11.075
  692   1HG   LYS  86          2HG       LYS  86  -8.726 -10.468 -10.468
  693   2HG   LYS  86          1HG       LYS  86  -9.033  -9.412  -9.412
  694   1HD   LYS  86          2HD       LYS  86  -8.217 -11.500 -11.500
  695   2HD   LYS  86          1HD       LYS  86  -9.947 -11.434 -11.434
  696   1HE   LYS  86          2HE       LYS  86 -10.452 -12.909 -12.909
  697   2HE   LYS  86          1HE       LYS  86  -8.813 -12.784 -12.784
  698   1HZ   LYS  86          3HZ       LYS  86  -9.264 -13.786 -13.786
  699   2HZ   LYS  86          2HZ       LYS  86  -9.460 -14.826 -14.826
  700   3HZ   LYS  86          1HZ       LYS  86  -7.961 -14.079 -14.079
  701    H    TRP  87           H        TRP  87 -13.196  -8.222  -8.222
  702    HA   TRP  87           HA       TRP  87 -12.276  -5.494  -5.494
  703   1HB   TRP  87          2HB       TRP  87 -14.859  -6.984  -6.984
  704   2HB   TRP  87          1HB       TRP  87 -14.591  -5.383  -5.383
  705    HD1  TRP  87           HD1      TRP  87 -15.609  -7.142  -7.142
  706    HE1  TRP  87           HE1      TRP  87 -15.877  -5.496  -5.496
  707    HE3  TRP  87           HE3      TRP  87 -13.386  -3.031  -3.031
  708    HZ2  TRP  87           HZ2      TRP  87 -15.228  -2.784  -2.784
  709    HZ3  TRP  87           HZ3      TRP  87 -13.191  -0.932  -0.932
  710    HH2  TRP  87           HH2      TRP  87 -14.111  -0.811  -0.811
  711    H    GLU  88           H        GLU  88 -12.732  -4.646  -4.646
  712    HA   GLU  88           HA       GLU  88 -12.064  -6.612  -6.612
  713   1HB   GLU  88          2HB       GLU  88 -10.095  -5.141  -5.141
  714   2HB   GLU  88          1HB       GLU  88 -10.932  -3.819  -3.819
  715   1HG   GLU  88          2HG       GLU  88  -9.396  -4.673  -4.673
  716   2HG   GLU  88          1HG       GLU  88 -10.986  -5.270  -5.270
  717    H    SER  89           H        SER  89 -13.108  -3.351  -3.351
  718    HA   SER  89           HA       SER  89 -15.143  -3.461  -3.461
  719   1HB   SER  89          2HB       SER  89 -14.685  -1.192  -1.192
  720   2HB   SER  89          1HB       SER  89 -13.105  -1.963  -1.963
  721    HG   SER  89           HG       SER  89 -13.853   0.164   0.164
  722    H    GLU  90           H        GLU  90 -16.145  -0.812  -0.812
  723    HA   GLU  90           HA       GLU  90 -17.704  -1.749  -1.749
  724   1HB   GLU  90          2HB       GLU  90 -17.675   1.051   1.051
  725   2HB   GLU  90          1HB       GLU  90 -18.967   0.285   0.285
  726   1HG   GLU  90          2HG       GLU  90 -18.735  -1.505  -1.505
  727   2HG   GLU  90          1HG       GLU  90 -18.234  -0.042  -0.042
  728    H    ASN  91           H        ASN  91 -14.891   0.287   0.287
  729    HA   ASN  91           HA       ASN  91 -14.726   0.562   0.562
  730   1HB   ASN  91          2HB       ASN  91 -14.189   2.879   2.879
  731   2HB   ASN  91          1HB       ASN  91 -14.227   2.903   2.903
  732   1HD2  ASN  91          2HD2      ASN  91 -17.574   3.813   3.813
  733   2HD2  ASN  91          1HD2      ASN  91 -16.000   4.051   4.051
  734    H    LYS  92           H        LYS  92 -13.219  -1.051  -1.051
  735    HA   LYS  92           HA       LYS  92 -10.523  -0.024  -0.024
  736   1HB   LYS  92          2HB       LYS  92 -10.883   0.575   0.575
  737   2HB   LYS  92          1HB       LYS  92 -11.434  -1.055  -1.055
  738   1HG   LYS  92          2HG       LYS  92  -8.873  -1.292  -1.292
  739   2HG   LYS  92          1HG       LYS  92  -8.753  -0.028  -0.028
  740   1HD   LYS  92          2HD       LYS  92 -10.204  -1.932  -1.932
  741   2HD   LYS  92          1HD       LYS  92  -9.155  -2.933  -2.933
  742   1HE   LYS  92          2HE       LYS  92  -7.213  -1.499  -1.499
  743   2HE   LYS  92          1HE       LYS  92  -8.328  -0.822  -0.822
  744   1HZ   LYS  92          1HZ       LYS  92  -8.780  -3.109  -3.109
  745   2HZ   LYS  92          3HZ       LYS  92  -7.586  -3.679  -3.679
  746   3HZ   LYS  92          2HZ       LYS  92  -7.160  -2.650  -2.650
  747    H    MET  93           H        MET  93  -9.868  -1.575  -1.575
  748    HA   MET  93           HA       MET  93 -10.429  -4.426  -4.426
  749   1HB   MET  93          2HB       MET  93  -9.931  -4.753  -4.753
  750   2HB   MET  93          1HB       MET  93 -11.517  -4.194  -4.194
  751   1HG   MET  93          2HG       MET  93 -11.160  -2.039  -2.039
  752   2HG   MET  93          1HG       MET  93  -9.414  -2.147  -2.147
  753   1HE   MET  93          2HE       MET  93 -12.105  -4.264  -4.264
  754   2HE   MET  93          1HE       MET  93 -12.462  -2.921  -2.921
  755   3HE   MET  93          3HE       MET  93 -11.789  -4.425  -4.425
  756    H    VAL  94           H        VAL  94  -8.802  -5.954  -5.954
  757    HA   VAL  94           HA       VAL  94  -6.041  -4.844  -4.844
  758    HB   VAL  94           HB       VAL  94  -6.797  -7.673  -7.673
  759   1HG1  VAL  94          3HG1      VAL  94  -4.544  -5.788  -5.788
  760   2HG1  VAL  94          2HG1      VAL  94  -4.869  -7.060  -7.060
  761   3HG1  VAL  94          1HG1      VAL  94  -4.491  -7.475  -7.475
  762   1HG2  VAL  94          1HG2      VAL  94  -7.161  -5.186  -5.186
  763   2HG2  VAL  94          3HG2      VAL  94  -8.293  -6.517  -6.517
  764   3HG2  VAL  94          2HG2      VAL  94  -6.857  -6.752  -6.752
  765    H    CYS  95           H        CYS  95  -4.379  -6.469  -6.469
  766    HA   CYS  95           HA       CYS  95  -5.542  -7.897  -7.897
  767   1HB   CYS  95          2HB       CYS  95  -5.092  -5.583  -5.583
  768   2HB   CYS  95          1HB       CYS  95  -3.411  -5.758  -5.758
  769    HG   CYS  95           HG       CYS  95  -3.224  -7.744  -7.744
  770    H    GLU  96           H        GLU  96  -4.330  -9.581  -9.581
  771    HA   GLU  96           HA       GLU  96  -1.741 -10.098 -10.098
  772   1HB   GLU  96          2HB       GLU  96  -3.553 -12.117 -12.117
  773   2HB   GLU  96          1HB       GLU  96  -2.156 -12.460 -12.460
  774   1HG   GLU  96          2HG       GLU  96  -4.240 -10.776 -10.776
  775   2HG   GLU  96          1HG       GLU  96  -4.731 -12.433 -12.433
  776    H    GLN  97           H        GLN  97  -0.103 -11.242 -11.242
  777    HA   GLN  97           HA       GLN  97  -0.610 -10.998 -10.998
  778   1HB   GLN  97          2HB       GLN  97   0.058  -8.682  -8.682
  779   2HB   GLN  97          1HB       GLN  97   1.676  -9.342  -9.342
  780   1HG   GLN  97          2HG       GLN  97   0.924  -9.872  -9.872
  781   2HG   GLN  97          1HG       GLN  97  -0.399  -8.752  -8.752
  782   1HE2  GLN  97          2HE2      GLN  97   1.631  -5.965  -5.965
  783   2HE2  GLN  97          1HE2      GLN  97   0.082  -6.661  -6.661
  784    H    LYS  98           H        LYS  98   0.694 -12.312 -12.312
  785    HA   LYS  98           HA       LYS  98   3.271 -13.238 -13.238
  786   1HB   LYS  98          2HB       LYS  98   2.688 -15.600 -15.600
  787   2HB   LYS  98          1HB       LYS  98   1.652 -14.942 -14.942
  788   1HG   LYS  98          2HG       LYS  98  -0.212 -14.955 -14.955
  789   2HG   LYS  98          1HG       LYS  98   0.693 -14.549 -14.549
  790   1HD   LYS  98          2HD       LYS  98   1.566 -16.854 -16.854
  791   2HD   LYS  98          1HD       LYS  98   0.666 -17.264 -17.264
  792   1HE   LYS  98          2HE       LYS  98  -0.814 -16.069 -16.069
  793   2HE   LYS  98          1HE       LYS  98  -0.361 -17.772 -17.772
  794   1HZ   LYS  98          2HZ       LYS  98  -1.359 -17.847 -17.847
  795   2HZ   LYS  98          1HZ       LYS  98  -2.136 -16.402 -16.402
  796   3HZ   LYS  98          3HZ       LYS  98  -2.415 -17.818 -17.818
  797    H    LEU  99           H        LEU  99   4.759 -13.913 -13.913
  798    HA   LEU  99           HA       LEU  99   4.465 -12.536 -12.536
  799   1HB   LEU  99          2HB       LEU  99   6.223 -14.874 -14.874
  800   2HB   LEU  99          1HB       LEU  99   6.373 -13.973 -13.973
  801    HG   LEU  99           HG       LEU  99   6.334 -12.391 -12.391
  802   1HD1  LEU  99          1HD1      LEU  99   8.634 -14.143 -14.143
  803   2HD1  LEU  99          3HD1      LEU  99   8.824 -12.790 -12.790
  804   3HD1  LEU  99          2HD1      LEU  99   7.826 -14.173 -14.173
  805   1HD2  LEU  99          3HD2      LEU  99   6.512 -11.403 -11.403
  806   2HD2  LEU  99          2HD2      LEU  99   7.907 -11.027 -11.027
  807   3HD2  LEU  99          1HD2      LEU  99   8.025 -12.280 -12.280
  808    H    LEU 100           H        LEU 100   4.523 -13.582 -13.582
  809    HA   LEU 100           HA       LEU 100   2.543 -15.786 -15.786
  810   1HB   LEU 100          2HB       LEU 100   3.456 -13.670 -13.670
  811   2HB   LEU 100          1HB       LEU 100   2.511 -15.071 -15.071
  812    HG   LEU 100           HG       LEU 100   1.624 -13.276 -13.276
  813   1HD1  LEU 100          3HD1      LEU 100   1.384 -12.928 -12.928
  814   2HD1  LEU 100          2HD1      LEU 100   0.001 -12.495 -12.495
  815   3HD1  LEU 100          1HD1      LEU 100   1.557 -11.707 -11.707
  816   1HD2  LEU 100          3HD2      LEU 100   0.469 -15.509 -15.509
  817   2HD2  LEU 100          2HD2      LEU 100   0.343 -15.211 -15.211
  818   3HD2  LEU 100          1HD2      LEU 100  -0.620 -14.260 -14.260
  819    H    LYS 101           H        LYS 101   5.871 -15.324 -15.324
  820    HA   LYS 101           HA       LYS 101   6.295 -17.930 -17.930
  821   1HB   LYS 101          2HB       LYS 101   6.615 -15.622 -15.622
  822   2HB   LYS 101          1HB       LYS 101   8.253 -15.970 -15.970
  823   1HG   LYS 101          2HG       LYS 101   6.684 -18.302 -18.302
  824   2HG   LYS 101          1HG       LYS 101   7.151 -17.127 -17.127
  825   1HD   LYS 101          2HD       LYS 101   9.513 -17.268 -17.268
  826   2HD   LYS 101          1HD       LYS 101   8.923 -18.761 -18.761
  827   1HE   LYS 101          2HE       LYS 101   8.863 -19.878 -19.878
  828   2HE   LYS 101          1HE       LYS 101   8.407 -18.438 -18.438
  829   1HZ   LYS 101          2HZ       LYS 101  10.748 -17.640 -17.640
  830   2HZ   LYS 101          1HZ       LYS 101  11.092 -19.243 -19.243
  831   3HZ   LYS 101          3HZ       LYS 101  10.587 -18.895 -18.895
  832    H    GLY 102           H        GLY 102   7.886 -19.012 -19.012
  833   1HA   GLY 102          2HA       GLY 102   9.627 -19.397 -19.397
  834   2HA   GLY 102          1HA       GLY 102  10.183 -17.757 -17.757
  835    H    GLU 103           H        GLU 103  10.605 -17.611 -17.611
  836    HA   GLU 103           HA       GLU 103   8.523 -16.230 -16.230
  837   1HB   GLU 103          2HB       GLU 103   7.626 -18.561 -18.561
  838   2HB   GLU 103          1HB       GLU 103   9.089 -19.010 -19.010
  839   1HG   GLU 103          2HG       GLU 103   8.569 -17.636 -17.636
  840   2HG   GLU 103          1HG       GLU 103   7.428 -16.669 -16.669
  841    H    GLY 104           H        GLY 104   9.370 -15.131 -15.131
  842   1HA   GLY 104          2HA       GLY 104  11.871 -15.989 -15.989
  843   2HA   GLY 104          1HA       GLY 104  11.977 -14.488 -14.488
  844    HA   PRO 105           HA       PRO 105  10.243 -12.485 -12.485
  845   1HB   PRO 105          2HB       PRO 105   9.405 -10.146 -10.146
  846   2HB   PRO 105          1HB       PRO 105  11.108 -10.512 -10.512
  847   1HG   PRO 105          2HG       PRO 105   9.676 -10.460 -10.460
  848   2HG   PRO 105          1HG       PRO 105  11.408 -10.292 -10.292
  849   1HD   PRO 105          2HD       PRO 105  10.060 -12.637 -12.637
  850   2HD   PRO 105          1HD       PRO 105  11.762 -12.511 -12.511
  851    H    LYS 106           H        LYS 106   8.074 -11.079 -11.079
  852    HA   LYS 106           HA       LYS 106   5.789 -12.331 -12.331
  853   1HB   LYS 106          2HB       LYS 106   6.124 -13.531 -13.531
  854   2HB   LYS 106          1HB       LYS 106   6.119 -12.001 -12.001
  855   1HG   LYS 106          2HG       LYS 106   3.833 -11.614 -11.614
  856   2HG   LYS 106          1HG       LYS 106   3.799 -12.843 -12.843
  857   1HD   LYS 106          2HD       LYS 106   3.544 -14.559 -14.559
  858   2HD   LYS 106          1HD       LYS 106   4.598 -13.807 -13.807
  859   1HE   LYS 106          2HE       LYS 106   2.193 -13.931 -13.931
  860   2HE   LYS 106          1HE       LYS 106   2.836 -12.290 -12.290
  861   1HZ   LYS 106          3HZ       LYS 106   1.296 -13.533 -13.533
  862   2HZ   LYS 106          2HZ       LYS 106   0.627 -12.500 -12.500
  863   3HZ   LYS 106          1HZ       LYS 106   1.809 -11.919 -11.919
  864    H    THR 107           H        THR 107   4.119 -10.845 -10.845
  865    HA   THR 107           HA       THR 107   4.496  -8.123  -8.123
  866    HB   THR 107           HB       THR 107   3.116  -7.645  -7.645
  867    HG1  THR 107           HG1      THR 107   3.568  -9.908  -9.908
  868   1HG2  THR 107          2HG2      THR 107   5.990  -7.532  -7.532
  869   2HG2  THR 107          1HG2      THR 107   5.569  -7.161  -7.161
  870   3HG2  THR 107          3HG2      THR 107   4.872  -6.216  -6.216
  871    H    SER 108           H        SER 108   2.719  -7.019  -7.019
  872    HA   SER 108           HA       SER 108  -0.009  -7.906  -7.906
  873   1HB   SER 108          2HB       SER 108  -0.355  -8.116  -8.116
  874   2HB   SER 108          1HB       SER 108   0.262  -9.504  -9.504
  875    HG   SER 108           HG       SER 108   1.710  -9.295  -9.295
  876    H    TRP 109           H        TRP 109  -1.347  -6.074  -6.074
  877    HA   TRP 109           HA       TRP 109  -0.250  -3.861  -3.861
  878   1HB   TRP 109          2HB       TRP 109  -0.913  -2.218  -2.218
  879   2HB   TRP 109          1HB       TRP 109   0.494  -3.209  -3.209
  880    HD1  TRP 109           HD1      TRP 109   0.363  -4.819  -4.819
  881    HE1  TRP 109           HE1      TRP 109  -1.418  -5.287  -5.287
  882    HE3  TRP 109           HE3      TRP 109  -3.612  -2.313  -2.313
  883    HZ2  TRP 109           HZ2      TRP 109  -4.156  -4.678  -4.678
  884    HZ3  TRP 109           HZ3      TRP 109  -5.791  -2.283  -2.283
  885    HH2  TRP 109           HH2      TRP 109  -6.071  -3.456  -3.456
  886    H    THR 110           H        THR 110  -1.954  -2.027  -2.027
  887    HA   THR 110           HA       THR 110  -4.712  -3.177  -3.177
  888    HB   THR 110           HB       THR 110  -5.125  -2.494  -2.494
  889    HG1  THR 110           HG1      THR 110  -2.572  -1.270  -1.270
  890   1HG2  THR 110          3HG2      THR 110  -3.260  -4.407  -4.407
  891   2HG2  THR 110          2HG2      THR 110  -2.338  -3.333  -3.333
  892   3HG2  THR 110          1HG2      THR 110  -3.854  -4.033  -4.033
  893    H    MET 111           H        MET 111  -6.318  -1.334  -1.334
  894    HA   MET 111           HA       MET 111  -5.500   1.391   1.391
  895   1HB   MET 111          2HB       MET 111  -7.020   1.566   1.566
  896   2HB   MET 111          1HB       MET 111  -5.621   0.534   0.534
  897   1HG   MET 111          2HG       MET 111  -6.924  -1.455  -1.455
  898   2HG   MET 111          1HG       MET 111  -8.286  -0.560  -0.560
  899   1HE   MET 111          3HE       MET 111  -5.752  -0.414  -0.414
  900   2HE   MET 111          2HE       MET 111  -6.574  -0.656  -0.656
  901   3HE   MET 111          1HE       MET 111  -6.430   0.967   0.967
  902    H    GLU 112           H        GLU 112  -6.892   2.771   2.771
  903    HA   GLU 112           HA       GLU 112  -9.575   1.701   1.701
  904   1HB   GLU 112          2HB       GLU 112  -9.303   2.836   2.836
  905   2HB   GLU 112          1HB       GLU 112  -8.176   1.502   1.502
  906   1HG   GLU 112          2HG       GLU 112  -6.438   3.113   3.113
  907   2HG   GLU 112          1HG       GLU 112  -7.562   4.439   4.439
  908    H    LEU 113           H        LEU 113 -11.176   3.340   3.340
  909    HA   LEU 113           HA       LEU 113 -10.503   5.914   5.914
  910   1HB   LEU 113          2HB       LEU 113 -12.398   4.009   4.009
  911   2HB   LEU 113          1HB       LEU 113 -13.346   5.128   5.128
  912    HG   LEU 113           HG       LEU 113 -13.365   5.583   5.583
  913   1HD1  LEU 113          2HD1      LEU 113 -12.877   7.461   7.461
  914   2HD1  LEU 113          1HD1      LEU 113 -12.290   8.090   8.090
  915   3HD1  LEU 113          3HD1      LEU 113 -13.970   7.589   7.589
  916   1HD2  LEU 113          2HD2      LEU 113 -10.864   4.991   4.991
  917   2HD2  LEU 113          1HD2      LEU 113 -11.455   6.363   6.363
  918   3HD2  LEU 113          3HD2      LEU 113 -10.567   6.635   6.635
  919    H    THR 114           H        THR 114 -11.209   7.848   7.848
  920    HA   THR 114           HA       THR 114 -11.809   7.450   7.450
  921    HB   THR 114           HB       THR 114 -11.168   9.724   9.724
  922    HG1  THR 114           HG1      THR 114 -11.259  11.192  11.192
  923   1HG2  THR 114          3HG2      THR 114  -9.311   8.147   8.147
  924   2HG2  THR 114          2HG2      THR 114  -9.413   8.659   8.659
  925   3HG2  THR 114          1HG2      THR 114  -8.944   9.816   9.816
  926    H    ASN 115           H        ASN 115 -13.510   8.795   8.795
  927    HA   ASN 115           HA       ASN 115 -16.037   8.469   8.469
  928   1HB   ASN 115          2HB       ASN 115 -16.897   9.913   9.913
  929   2HB   ASN 115          1HB       ASN 115 -15.821   8.647   8.647
  930   1HD2  ASN 115          2HD2      ASN 115 -14.766  11.881  11.881
  931   2HD2  ASN 115          1HD2      ASN 115 -16.189  10.956  10.956
  932    H    ASP 116           H        ASP 116 -13.698  11.032  11.032
  933    HA   ASP 116           HA       ASP 116 -15.647  12.973  12.973
  934   1HB   ASP 116          2HB       ASP 116 -12.613  13.057  13.057
  935   2HB   ASP 116          1HB       ASP 116 -13.678  14.409  14.409
  936    H    GLY 117           H        GLY 117 -13.384  10.593  10.593
  937   1HA   GLY 117          2HA       GLY 117 -14.098   9.763   9.763
  938   2HA   GLY 117          1HA       GLY 117 -14.057  11.457  11.457
  939    H    GLU 118           H        GLU 118 -11.563  11.388  11.388
  940    HA   GLU 118           HA       GLU 118  -9.522  11.520  11.520
  941   1HB   GLU 118          2HB       GLU 118  -9.312  10.828  10.828
  942   2HB   GLU 118          1HB       GLU 118  -7.951  11.270  11.270
  943   1HG   GLU 118          2HG       GLU 118  -9.134  13.434  13.434
  944   2HG   GLU 118          1HG       GLU 118 -10.336  12.999  12.999
  945    H    LEU 119           H        LEU 119  -7.562   9.920   9.920
  946    HA   LEU 119           HA       LEU 119  -8.439   7.108   7.108
  947   1HB   LEU 119          2HB       LEU 119  -9.068   7.815   7.815
  948   2HB   LEU 119          1HB       LEU 119  -7.371   8.144   8.144
  949    HG   LEU 119           HG       LEU 119  -8.308   5.433   5.433
  950   1HD1  LEU 119          1HD1      LEU 119  -8.425   6.685   6.685
  951   2HD1  LEU 119          3HD1      LEU 119  -8.061   4.965   4.965
  952   3HD1  LEU 119          2HD1      LEU 119  -9.577   5.602   5.602
  953   1HD2  LEU 119          2HD2      LEU 119  -5.828   6.638   6.638
  954   2HD2  LEU 119          1HD2      LEU 119  -5.988   5.400   5.400
  955   3HD2  LEU 119          3HD2      LEU 119  -6.218   4.979   4.979
  956    H    ILE 120           H        ILE 120  -6.847   6.324   6.324
  957    HA   ILE 120           HA       ILE 120  -4.031   7.130   7.130
  958    HB   ILE 120           HB       ILE 120  -4.677   7.681   7.681
  959   1HG1  ILE 120          2HG1      ILE 120  -2.900   5.225   5.225
  960   2HG1  ILE 120          1HG1      ILE 120  -2.358   6.809   6.809
  961   1HG2  ILE 120          1HG2      ILE 120  -5.297   4.723   4.723
  962   2HG2  ILE 120          3HG2      ILE 120  -5.273   5.852   5.852
  963   3HG2  ILE 120          2HG2      ILE 120  -6.468   6.040   6.040
  964   1HD1  ILE 120          3HD1      ILE 120  -3.075   7.742   7.742
  965   2HD1  ILE 120          2HD1      ILE 120  -3.360   6.085   6.085
  966   3HD1  ILE 120          1HD1      ILE 120  -1.733   6.602   6.602
  967    H    LEU 121           H        LEU 121  -2.485   5.443   5.443
  968    HA   LEU 121           HA       LEU 121  -3.659   2.706   2.706
  969   1HB   LEU 121          2HB       LEU 121  -3.435   3.744   3.744
  970   2HB   LEU 121          1HB       LEU 121  -1.730   4.062   4.062
  971    HG   LEU 121           HG       LEU 121  -2.344   1.258   1.258
  972   1HD1  LEU 121          3HD1      LEU 121  -4.127   1.662   1.662
  973   2HD1  LEU 121          2HD1      LEU 121  -2.920   2.300   2.300
  974   3HD1  LEU 121          1HD1      LEU 121  -2.865   0.605   0.605
  975   1HD2  LEU 121          2HD2      LEU 121  -0.483   2.878   2.878
  976   2HD2  LEU 121          1HD2      LEU 121  -0.098   1.793   1.793
  977   3HD2  LEU 121          3HD2      LEU 121  -0.591   1.132   1.132
  978    H    THR 122           H        THR 122  -2.356   1.079   1.079
  979    HA   THR 122           HA       THR 122   0.355   1.871   1.871
  980    HB   THR 122           HB       THR 122  -0.574  -0.467  -0.467
  981    HG1  THR 122           HG1      THR 122  -2.342   1.750   1.750
  982   1HG2  THR 122          1HG2      THR 122   0.146   2.368   2.368
  983   2HG2  THR 122          3HG2      THR 122  -0.483   1.295   1.295
  984   3HG2  THR 122          2HG2      THR 122   1.002   0.878   0.878
  985    H    MET 123           H        MET 123   1.786  -0.180  -0.180
  986    HA   MET 123           HA       MET 123   1.070  -2.218  -2.218
  987   1HB   MET 123          2HB       MET 123   3.587  -0.540  -0.540
  988   2HB   MET 123          1HB       MET 123   3.093  -1.839  -1.839
  989   1HG   MET 123          2HG       MET 123   0.963  -0.491  -0.491
  990   2HG   MET 123          1HG       MET 123   1.771   0.850   0.850
  991   1HE   MET 123          1HE       MET 123   0.956  -0.963  -0.963
  992   2HE   MET 123          3HE       MET 123   2.138  -0.648  -0.648
  993   3HE   MET 123          2HE       MET 123   2.462  -1.876  -1.876
  994    H    THR 124           H        THR 124   2.773  -3.939  -3.939
  995    HA   THR 124           HA       THR 124   4.527  -4.069  -4.069
  996    HB   THR 124           HB       THR 124   2.633  -6.336  -6.336
  997    HG1  THR 124           HG1      THR 124   1.359  -5.473  -5.473
  998   1HG2  THR 124          2HG2      THR 124   4.746  -6.673  -6.673
  999   2HG2  THR 124          1HG2      THR 124   4.166  -5.477  -5.477
 1000   3HG2  THR 124          3HG2      THR 124   3.286  -6.989  -6.989
 1001    H    ALA 125           H        ALA 125   6.146  -5.653  -5.653
 1002    HA   ALA 125           HA       ALA 125   6.228  -7.374  -7.374
 1003   1HB   ALA 125          2HB       ALA 125   6.997  -5.083  -5.083
 1004   2HB   ALA 125          1HB       ALA 125   8.368  -5.258  -5.258
 1005   3HB   ALA 125          3HB       ALA 125   8.162  -6.384  -6.384
 1006    H    ASP 126           H        ASP 126   6.543  -9.098  -9.098
 1007    HA   ASP 126           HA       ASP 126   7.878 -10.666 -10.666
 1008   1HB   ASP 126          2HB       ASP 126   9.809  -8.935  -8.935
 1009   2HB   ASP 126          1HB       ASP 126  10.247  -9.098  -9.098
 1010    H    ASP 127           H        ASP 127   9.216  -7.698  -7.698
 1011    HA   ASP 127           HA       ASP 127   7.450  -8.025  -8.025
 1012   1HB   ASP 127          2HB       ASP 127  10.374  -8.609  -8.609
 1013   2HB   ASP 127          1HB       ASP 127   9.738  -7.707  -7.707
 1014    H    VAL 128           H        VAL 128   8.074  -6.064  -6.064
 1015    HA   VAL 128           HA       VAL 128   8.668  -3.708  -3.708
 1016    HB   VAL 128           HB       VAL 128   9.541  -2.580  -2.580
 1017   1HG1  VAL 128          1HG1      VAL 128  11.046  -4.080  -4.080
 1018   2HG1  VAL 128          3HG1      VAL 128  10.719  -5.368  -5.368
 1019   3HG1  VAL 128          2HG1      VAL 128  11.548  -3.902  -3.902
 1020   1HG2  VAL 128          1HG2      VAL 128   8.303  -4.919  -4.919
 1021   2HG2  VAL 128          3HG2      VAL 128   8.517  -3.270  -3.270
 1022   3HG2  VAL 128          2HG2      VAL 128   9.860  -4.410  -4.410
 1023    H    VAL 129           H        VAL 129   7.647  -1.683  -1.683
 1024    HA   VAL 129           HA       VAL 129   5.116  -2.359  -2.359
 1025    HB   VAL 129           HB       VAL 129   5.297  -1.565  -1.565
 1026   1HG1  VAL 129          2HG1      VAL 129   3.240  -0.442  -0.442
 1027   2HG1  VAL 129          1HG1      VAL 129   2.826  -0.760  -0.760
 1028   3HG1  VAL 129          3HG1      VAL 129   4.109   0.385   0.385
 1029   1HG2  VAL 129          3HG2      VAL 129   3.793  -3.441  -3.441
 1030   2HG2  VAL 129          2HG2      VAL 129   4.500  -3.700  -3.700
 1031   3HG2  VAL 129          1HG2      VAL 129   2.958  -2.859  -2.859
 1032    H    CYS 130           H        CYS 130   4.984  -0.923  -0.923
 1033    HA   CYS 130           HA       CYS 130   6.210   1.774   1.774
 1034   1HB   CYS 130          2HB       CYS 130   6.594   0.153   0.153
 1035   2HB   CYS 130          1HB       CYS 130   5.032   0.770   0.770
 1036    HG   CYS 130           HG       CYS 130   7.177   2.269   2.269
 1037    H    THR 131           H        THR 131   4.859   3.403   3.403
 1038    HA   THR 131           HA       THR 131   1.963   3.155   3.155
 1039    HB   THR 131           HB       THR 131   3.232   4.584   4.584
 1040    HG1  THR 131           HG1      THR 131   2.209   2.911   2.911
 1041   1HG2  THR 131          1HG2      THR 131   0.345   4.192   4.192
 1042   2HG2  THR 131          3HG2      THR 131   0.851   4.790   4.790
 1043   3HG2  THR 131          2HG2      THR 131   1.211   5.723   5.723
 1044    H    ARG 132           H        ARG 132   0.970   4.978   4.978
 1045    HA   ARG 132           HA       ARG 132   2.455   7.506   7.506
 1046   1HB   ARG 132          2HB       ARG 132   1.389   5.878   5.878
 1047   2HB   ARG 132          1HB       ARG 132   1.857   7.572   7.572
 1048   1HG   ARG 132          2HG       ARG 132   3.924   6.793   6.793
 1049   2HG   ARG 132          1HG       ARG 132   4.061   6.444   6.444
 1050   1HD   ARG 132          2HD       ARG 132   4.453   4.315   4.315
 1051   2HD   ARG 132          1HD       ARG 132   2.696   4.242   4.242
 1052    HE   ARG 132           HE       ARG 132   2.917   4.316   4.316
 1053   1HH1  ARG 132          2HH1      ARG 132   4.671   6.638   6.638
 1054   2HH1  ARG 132          1HH1      ARG 132   6.151   5.938   5.938
 1055   1HH2  ARG 132          1HH2      ARG 132   5.340   2.731   2.731
 1056   2HH2  ARG 132          2HH2      ARG 132   6.529   3.726   3.726
 1057    H    VAL 133           H        VAL 133   0.918   9.001   9.001
 1058    HA   VAL 133           HA       VAL 133  -1.916   8.274   8.274
 1059    HB   VAL 133           HB       VAL 133  -0.578  10.903  10.903
 1060   1HG1  VAL 133          3HG1      VAL 133  -3.376   9.876   9.876
 1061   2HG1  VAL 133          2HG1      VAL 133  -2.797  10.902  10.902
 1062   3HG1  VAL 133          1HG1      VAL 133  -2.803  11.508  11.508
 1063   1HG2  VAL 133          3HG2      VAL 133  -1.166   8.417   8.417
 1064   2HG2  VAL 133          2HG2      VAL 133   0.310   9.381   9.381
 1065   3HG2  VAL 133          1HG2      VAL 133  -1.119   9.986   9.986
 1066    H    TYR 134           H        TYR 134  -3.491   8.996   8.996
 1067    HA   TYR 134           HA       TYR 134  -2.520  10.825  10.825
 1068   1HB   TYR 134          2HB       TYR 134  -4.020   8.234   8.234
 1069   2HB   TYR 134          1HB       TYR 134  -4.277   9.481   9.481
 1070    HD1  TYR 134           HD2      TYR 134  -2.437  10.263  10.263
 1071    HD2  TYR 134           HD1      TYR 134  -1.891   7.072   7.072
 1072    HE1  TYR 134           HE2      TYR 134  -0.332   9.611   9.611
 1073    HE2  TYR 134           HE1      TYR 134   0.207   6.414   6.414
 1074    HH   TYR 134           HH       TYR 134   1.860   8.343   8.343
 1075    H    VAL 135           H        VAL 135  -3.711  12.607  12.607
 1076    HA   VAL 135           HA       VAL 135  -6.489  12.532  12.532
 1077    HB   VAL 135           HB       VAL 135  -4.378  14.334  14.334
 1078   1HG1  VAL 135          2HG1      VAL 135  -4.954  15.427  15.427
 1079   2HG1  VAL 135          1HG1      VAL 135  -6.539  15.802  15.802
 1080   3HG1  VAL 135          3HG1      VAL 135  -5.085  16.490  16.490
 1081   1HG2  VAL 135          1HG2      VAL 135  -6.574  13.641  13.641
 1082   2HG2  VAL 135          3HG2      VAL 135  -5.861  15.225  15.225
 1083   3HG2  VAL 135          2HG2      VAL 135  -7.244  15.076  15.076
 1084    H    ARG 136           H        ARG 136  -8.204  13.083  13.083
 1085    HA   ARG 136           HA       ARG 136  -7.930  12.568  12.568
 1086   1HB   ARG 136          2HB       ARG 136  -9.992  13.588  13.588
 1087   2HB   ARG 136          1HB       ARG 136  -9.984  14.497  14.497
 1088   1HG   ARG 136          2HG       ARG 136 -10.435  12.640  12.640
 1089   2HG   ARG 136          1HG       ARG 136  -9.737  11.522  11.522
 1090   1HD   ARG 136          2HD       ARG 136 -12.400  12.955  12.955
 1091   2HD   ARG 136          1HD       ARG 136 -12.133  11.218  11.218
 1092    HE   ARG 136           HE       ARG 136 -10.779  11.941  11.941
 1093   1HH1  ARG 136          2HH1      ARG 136 -13.426  10.305  10.305
 1094   2HH1  ARG 136          1HH1      ARG 136 -14.437  11.113  11.113
 1095   1HH2  ARG 136          1HH2      ARG 136 -12.317  13.838  13.838
 1096   2HH2  ARG 136          2HH2      ARG 136 -13.808  13.115  13.115
 1097    H    GLU 137           HN       GLU 137  -7.055  13.561  13.561
 1098    HA   GLU 137           HA       GLU 137  -5.794  15.137  15.137
 1099   1HB   GLU 137          2HB       GLU 137  -8.306  15.671  15.671
 1100   2HB   GLU 137          1HB       GLU 137  -7.944  17.050  17.050
 1101   1HG   GLU 137          2HG       GLU 137  -6.012  17.521  17.521
 1102   2HG   GLU 137          1HG       GLU 137  -6.887  16.439  16.439

  Start of MODEL   16
    1   1H    PRO   1          1H        PRO   1 -15.994   7.704   7.704
    2   2H    PRO   1          2H        PRO   1 -15.468   6.868   6.868
    3    HA   PRO   1           HA       PRO   1 -16.047   4.931   4.931
    4   1HB   PRO   1          2HB       PRO   1 -18.750   5.373   5.373
    5   2HB   PRO   1          1HB       PRO   1 -18.192   4.523   4.523
    6   1HG   PRO   1          2HG       PRO   1 -19.440   7.095   7.095
    7   2HG   PRO   1          1HG       PRO   1 -18.878   6.242   6.242
    8   1HD   PRO   1          1HD       PRO   1 -17.709   8.539   8.539
    9   2HD   PRO   1          2HD       PRO   1 -17.155   7.682   7.682
   10    H    ASN   2           H        ASN   2 -14.800   6.738   6.738
   11    HA   ASN   2           HA       ASN   2 -15.587   5.557   5.557
   12   1HB   ASN   2          2HB       ASN   2 -16.129   8.433   8.433
   13   2HB   ASN   2          1HB       ASN   2 -15.640   8.009   8.009
   14   1HD2  ASN   2          2HD2      ASN   2 -18.701   6.374   6.374
   15   2HD2  ASN   2          1HD2      ASN   2 -17.092   6.625   6.625
   16    H    PHE   3           H        PHE   3 -13.698   5.089   5.089
   17    HA   PHE   3           HA       PHE   3 -11.261   6.623   6.623
   18   1HB   PHE   3          2HB       PHE   3 -11.671   4.004   4.004
   19   2HB   PHE   3          1HB       PHE   3 -10.107   4.738   4.738
   20    HD1  PHE   3           HD1      PHE   3 -13.187   3.934   3.934
   21    HD2  PHE   3           HD2      PHE   3  -8.899   3.801   3.801
   22    HE1  PHE   3           HE1      PHE   3 -13.071   2.797   2.797
   23    HE2  PHE   3           HE2      PHE   3  -8.794   2.653   2.653
   24    HZ   PHE   3           HZ       PHE   3 -10.881   2.143   2.143
   25    H    SER   4           H        SER   4 -13.635   6.676   6.676
   26    HA   SER   4           HA       SER   4 -12.039   6.889   6.889
   27   1HB   SER   4          2HB       SER   4 -14.425   6.312   6.312
   28   2HB   SER   4          1HB       SER   4 -14.836   7.904   7.904
   29    HG   SER   4           HG       SER   4 -14.835   8.455   8.455
   30    H    GLY   5           H        GLY   5 -10.699   8.492   8.492
   31   1HA   GLY   5          2HA       GLY   5 -11.270  11.149  11.149
   32   2HA   GLY   5          1HA       GLY   5 -10.801  11.094  11.094
   33    H    ASN   6           H        ASN   6  -9.015  12.511  12.511
   34    HA   ASN   6           HA       ASN   6  -6.867  10.835  10.835
   35   1HB   ASN   6          2HB       ASN   6  -7.369  13.801  13.801
   36   2HB   ASN   6          1HB       ASN   6  -5.719  13.218  13.218
   37   1HD2  ASN   6          2HD2      ASN   6  -6.687  11.654  11.654
   38   2HD2  ASN   6          1HD2      ASN   6  -5.969  11.137  11.137
   39    H    TRP   7           H        TRP   7  -4.616  11.330  11.330
   40    HA   TRP   7           HA       TRP   7  -4.932  11.901  11.901
   41   1HB   TRP   7          2HB       TRP   7  -4.014   9.234   9.234
   42   2HB   TRP   7          1HB       TRP   7  -3.860   9.725   9.725
   43    HD1  TRP   7           HD1      TRP   7  -6.325   8.384   8.384
   44    HE1  TRP   7           HE1      TRP   7  -8.665   8.200   8.200
   45    HE3  TRP   7           HE3      TRP   7  -5.441  10.960  10.960
   46    HZ2  TRP   7           HZ2      TRP   7  -9.972   9.078   9.078
   47    HZ3  TRP   7           HZ3      TRP   7  -7.241  11.314  11.314
   48    HH2  TRP   7           HH2      TRP   7  -9.486  10.370  10.370
   49    H    LYS   8           H        LYS   8  -3.348  13.202  13.202
   50    HA   LYS   8           HA       LYS   8  -0.682  12.883  12.883
   51   1HB   LYS   8          2HB       LYS   8  -2.132  15.288  15.288
   52   2HB   LYS   8          1HB       LYS   8  -0.371  15.279  15.279
   53   1HG   LYS   8          2HG       LYS   8  -1.024  14.353  14.353
   54   2HG   LYS   8          1HG       LYS   8  -2.396  15.414  15.414
   55   1HD   LYS   8          2HD       LYS   8   0.472  16.290  16.290
   56   2HD   LYS   8          1HD       LYS   8  -0.389  16.520  16.520
   57   1HE   LYS   8          2HE       LYS   8  -1.597  17.456  17.456
   58   2HE   LYS   8          1HE       LYS   8  -0.422  18.456  18.456
   59   1HZ   LYS   8          2HZ       LYS   8  -1.817  18.323  18.323
   60   2HZ   LYS   8          1HZ       LYS   8  -2.959  17.398  17.398
   61   3HZ   LYS   8          3HZ       LYS   8  -2.664  19.006  19.006
   62    H    ILE   9           H        ILE   9   0.655  11.834  11.834
   63    HA   ILE   9           HA       ILE   9   0.196  11.187  11.187
   64    HB   ILE   9           HB       ILE   9   1.747   9.968   9.968
   65   1HG1  ILE   9          2HG1      ILE   9   3.245  11.305  11.305
   66   2HG1  ILE   9          1HG1      ILE   9   2.150   9.934   9.934
   67   1HG2  ILE   9          2HG2      ILE   9   2.946  12.662  12.662
   68   2HG2  ILE   9          1HG2      ILE   9   4.098  11.334  11.334
   69   3HG2  ILE   9          3HG2      ILE   9   2.879  11.328  11.328
   70   1HD1  ILE   9          1HD1      ILE   9   4.246   9.562   9.562
   71   2HD1  ILE   9          3HD1      ILE   9   4.853   9.708   9.708
   72   3HD1  ILE   9          2HD1      ILE   9   3.682   8.452   8.452
   73    H    ILE  10           H        ILE  10   1.319  11.863  11.863
   74    HA   ILE  10           HA       ILE  10   2.334  14.666  14.666
   75    HB   ILE  10           HB       ILE  10   1.147  15.085  15.085
   76   1HG1  ILE  10          2HG1      ILE  10  -0.839  13.213  13.213
   77   2HG1  ILE  10          1HG1      ILE  10   0.510  12.207  12.207
   78   1HG2  ILE  10          3HG2      ILE  10   0.148  15.457  15.457
   79   2HG2  ILE  10          2HG2      ILE  10  -0.877  14.072  14.072
   80   3HG2  ILE  10          1HG2      ILE  10  -0.947  15.520  15.520
   81   1HD1  ILE  10          3HD1      ILE  10   1.873  13.360  13.360
   82   2HD1  ILE  10          2HD1      ILE  10   0.329  13.956  13.956
   83   3HD1  ILE  10          1HD1      ILE  10   0.634  12.221  12.221
   84    H    ARG  11           H        ARG  11   2.342  11.474  11.474
   85    HA   ARG  11           HA       ARG  11   5.065  12.039  12.039
   86   1HB   ARG  11          2HB       ARG  11   2.651  11.475  11.475
   87   2HB   ARG  11          1HB       ARG  11   4.175  10.725  10.725
   88   1HG   ARG  11          2HG       ARG  11   5.245  12.806  12.806
   89   2HG   ARG  11          1HG       ARG  11   4.027  13.668  13.668
   90   1HD   ARG  11          2HD       ARG  11   2.346  13.199  13.199
   91   2HD   ARG  11          1HD       ARG  11   3.571  12.353  12.353
   92    HE   ARG  11           HE       ARG  11   4.481  14.453  14.453
   93   1HH1  ARG  11          2HH1      ARG  11   4.904  15.839  15.839
   94   2HH1  ARG  11          1HH1      ARG  11   3.685  17.069  17.069
   95   1HH2  ARG  11          1HH2      ARG  11   1.740  15.555  15.555
   96   2HH2  ARG  11          2HH2      ARG  11   1.893  16.908  16.908
   97    H    SER  12           H        SER  12   6.049   9.898   9.898
   98    HA   SER  12           HA       SER  12   4.872   7.378   7.378
   99   1HB   SER  12          2HB       SER  12   6.029   6.825   6.825
  100   2HB   SER  12          1HB       SER  12   5.090   8.292   8.292
  101    HG   SER  12           HG       SER  12   7.872   8.000   8.000
  102    H    GLU  13           H        GLU  13   6.158   5.756   5.756
  103    HA   GLU  13           HA       GLU  13   8.997   6.419   6.419
  104   1HB   GLU  13          2HB       GLU  13   8.614   5.205   5.205
  105   2HB   GLU  13          1HB       GLU  13   7.889   6.805   6.805
  106   1HG   GLU  13          2HG       GLU  13   6.182   4.569   4.569
  107   2HG   GLU  13          1HG       GLU  13   6.517   4.590   4.590
  108    H    ASN  14           H        ASN  14  10.190   4.351   4.351
  109    HA   ASN  14           HA       ASN  14  10.928   2.189   2.189
  110   1HB   ASN  14          2HB       ASN  14   8.044   1.573   1.573
  111   2HB   ASN  14          1HB       ASN  14   9.305   0.448   0.448
  112   1HD2  ASN  14          2HD2      ASN  14   7.091   2.067   2.067
  113   2HD2  ASN  14          1HD2      ASN  14   6.650   2.005   2.005
  114    H    PHE  15           H        PHE  15  10.620   4.290   4.290
  115    HA   PHE  15           HA       PHE  15   9.661   3.068   3.068
  116   1HB   PHE  15          2HB       PHE  15  10.263   5.557   5.557
  117   2HB   PHE  15          1HB       PHE  15  11.930   5.063   5.063
  118    HD1  PHE  15           HD2      PHE  15  12.238   3.499   3.499
  119    HD2  PHE  15           HD1      PHE  15   8.948   6.177   6.177
  120    HE1  PHE  15           HE2      PHE  15  11.732   3.486   3.486
  121    HE2  PHE  15           HE1      PHE  15   8.453   6.151   6.151
  122    HZ   PHE  15           HZ       PHE  15   9.839   4.796   4.796
  123    H    GLU  16           H        GLU  16  13.046   3.651   3.651
  124    HA   GLU  16           HA       GLU  16  14.188   1.894   1.894
  125   1HB   GLU  16          2HB       GLU  16  16.195   1.938   1.938
  126   2HB   GLU  16          1HB       GLU  16  15.566   3.541   3.541
  127   1HG   GLU  16          2HG       GLU  16  14.604   3.808   3.808
  128   2HG   GLU  16          1HG       GLU  16  14.641   2.077   2.077
  129    H    GLU  17           H        GLU  17  12.731   1.276   1.276
  130    HA   GLU  17           HA       GLU  17  13.889  -1.282  -1.282
  131   1HB   GLU  17          2HB       GLU  17  11.192  -0.153  -0.153
  132   2HB   GLU  17          1HB       GLU  17  11.939  -1.580  -1.580
  133   1HG   GLU  17          2HG       GLU  17  13.988   0.080   0.080
  134   2HG   GLU  17          1HG       GLU  17  12.707   1.291   1.291
  135    H    LEU  18           H        LEU  18  10.993  -0.293  -0.293
  136    HA   LEU  18           HA       LEU  18  10.252  -3.024  -3.024
  137   1HB   LEU  18          2HB       LEU  18   8.562  -1.207  -1.207
  138   2HB   LEU  18          1HB       LEU  18   9.232  -0.386  -0.386
  139    HG   LEU  18           HG       LEU  18   8.724  -2.427  -2.427
  140   1HD1  LEU  18          1HD1      LEU  18   7.953  -3.393  -3.393
  141   2HD1  LEU  18          3HD1      LEU  18   6.790  -3.760  -3.760
  142   3HD1  LEU  18          2HD1      LEU  18   8.461  -4.303  -4.303
  143   1HD2  LEU  18          1HD2      LEU  18   7.106  -0.371  -0.371
  144   2HD2  LEU  18          3HD2      LEU  18   6.581  -1.701  -1.701
  145   3HD2  LEU  18          2HD2      LEU  18   6.135  -1.679  -1.679
  146    H    LEU  19           H        LEU  19  12.455  -0.710  -0.710
  147    HA   LEU  19           HA       LEU  19  12.331  -1.756  -1.756
  148   1HB   LEU  19          2HB       LEU  19  13.958   0.391   0.391
  149   2HB   LEU  19          1HB       LEU  19  14.295  -0.109  -0.109
  150    HG   LEU  19           HG       LEU  19  12.583   1.914   1.914
  151   1HD1  LEU  19          3HD1      LEU  19  12.744   0.134   0.134
  152   2HD1  LEU  19          2HD1      LEU  19  11.646   1.514   1.514
  153   3HD1  LEU  19          1HD1      LEU  19  13.384   1.760   1.760
  154   1HD2  LEU  19          2HD2      LEU  19  10.817  -0.487  -0.487
  155   2HD2  LEU  19          1HD2      LEU  19  10.845   0.405   0.405
  156   3HD2  LEU  19          3HD2      LEU  19  10.280   1.191   1.191
  157    H    LYS  20           H        LYS  20  14.052  -2.266  -2.266
  158    HA   LYS  20           HA       LYS  20  16.348  -3.588  -3.588
  159   1HB   LYS  20          2HB       LYS  20  15.558  -3.737  -3.737
  160   2HB   LYS  20          1HB       LYS  20  17.154  -4.005  -4.005
  161   1HG   LYS  20          2HG       LYS  20  16.234  -1.389  -1.389
  162   2HG   LYS  20          1HG       LYS  20  16.053  -1.567  -1.567
  163   1HD   LYS  20          2HD       LYS  20  18.593  -2.183  -2.183
  164   2HD   LYS  20          1HD       LYS  20  18.287  -0.680  -0.680
  165   1HE   LYS  20          2HE       LYS  20  17.960  -3.304  -3.304
  166   2HE   LYS  20          1HE       LYS  20  19.577  -2.637  -2.637
  167   1HZ   LYS  20          1HZ       LYS  20  18.707  -0.534  -0.534
  168   2HZ   LYS  20          3HZ       LYS  20  17.277  -1.357  -1.357
  169   3HZ   LYS  20          2HZ       LYS  20  18.751  -1.841  -1.841
  170    H    VAL  21           H        VAL  21  13.247  -4.373  -4.373
  171    HA   VAL  21           HA       VAL  21  13.717  -7.248  -7.248
  172    HB   VAL  21           HB       VAL  21  12.101  -6.038  -6.038
  173   1HG1  VAL  21          1HG1      VAL  21  11.277  -4.459  -4.459
  174   2HG1  VAL  21          3HG1      VAL  21  10.403  -5.785  -5.785
  175   3HG1  VAL  21          2HG1      VAL  21   9.984  -5.262  -5.262
  176   1HG2  VAL  21          3HG2      VAL  21  11.323  -8.304  -8.304
  177   2HG2  VAL  21          2HG2      VAL  21  11.619  -8.308  -8.308
  178   3HG2  VAL  21          1HG2      VAL  21  10.109  -7.656  -7.656
  179    H    LEU  22           H        LEU  22  12.113  -4.946  -4.946
  180    HA   LEU  22           HA       LEU  22  11.022  -6.797  -6.797
  181   1HB   LEU  22          2HB       LEU  22  11.491  -3.885  -3.885
  182   2HB   LEU  22          1HB       LEU  22  11.471  -4.458  -4.458
  183    HG   LEU  22           HG       LEU  22   9.242  -5.350  -5.350
  184   1HD1  LEU  22          3HD1      LEU  22   9.581  -6.113  -6.113
  185   2HD1  LEU  22          2HD1      LEU  22   9.337  -4.444  -4.444
  186   3HD1  LEU  22          1HD1      LEU  22   8.037  -5.320  -5.320
  187   1HD2  LEU  22          2HD2      LEU  22   9.626  -2.848  -2.848
  188   2HD2  LEU  22          1HD2      LEU  22   8.046  -3.294  -3.294
  189   3HD2  LEU  22          3HD2      LEU  22   9.295  -2.669  -2.669
  190    H    GLY  23           H        GLY  23  13.847  -4.696  -4.696
  191   1HA   GLY  23          2HA       GLY  23  14.988  -6.248  -6.248
  192   2HA   GLY  23          1HA       GLY  23  15.476  -4.620  -4.620
  193    H    VAL  24           H        VAL  24  17.655  -5.144  -5.144
  194    HA   VAL  24           HA       VAL  24  18.482  -6.399  -6.399
  195    HB   VAL  24           HB       VAL  24  20.099  -7.925  -7.925
  196   1HG1  VAL  24          1HG1      VAL  24  17.807  -8.634  -8.634
  197   2HG1  VAL  24          3HG1      VAL  24  17.234  -8.457  -8.457
  198   3HG1  VAL  24          2HG1      VAL  24  18.481  -9.645  -9.645
  199   1HG2  VAL  24          1HG2      VAL  24  18.549  -6.943  -6.943
  200   2HG2  VAL  24          3HG2      VAL  24  20.295  -6.909  -6.909
  201   3HG2  VAL  24          2HG2      VAL  24  19.472  -8.446  -8.446
  202    H    ASN  25           H        ASN  25  19.438  -4.794  -4.794
  203    HA   ASN  25           HA       ASN  25  22.107  -4.144  -4.144
  204   1HB   ASN  25          2HB       ASN  25  20.534  -3.762  -3.762
  205   2HB   ASN  25          1HB       ASN  25  20.573  -2.134  -2.134
  206   1HD2  ASN  25          2HD2      ASN  25  23.834  -1.549  -1.549
  207   2HD2  ASN  25          1HD2      ASN  25  22.376  -0.909  -0.909
  208    H    VAL  26           H        VAL  26  22.183  -1.301  -1.301
  209    HA   VAL  26           HA       VAL  26  20.884  -0.466  -0.466
  210    HB   VAL  26           HB       VAL  26  23.535   0.651   0.651
  211   1HG1  VAL  26          1HG1      VAL  26  21.872   1.327   1.327
  212   2HG1  VAL  26          3HG1      VAL  26  22.768   0.050   0.050
  213   3HG1  VAL  26          2HG1      VAL  26  23.624   1.443   1.443
  214   1HG2  VAL  26          2HG2      VAL  26  23.019  -2.038  -2.038
  215   2HG2  VAL  26          1HG2      VAL  26  24.180  -1.605  -1.605
  216   3HG2  VAL  26          3HG2      VAL  26  24.474  -1.133  -1.133
  217    H    MET  27           H        MET  27  22.435   0.713   0.713
  218    HA   MET  27           HA       MET  27  21.342   3.378   3.378
  219   1HB   MET  27          2HB       MET  27  23.254   2.301   2.301
  220   2HB   MET  27          1HB       MET  27  21.903   2.211   2.211
  221   1HG   MET  27          2HG       MET  27  21.615   4.527   4.527
  222   2HG   MET  27          1HG       MET  27  22.399   4.758   4.758
  223   1HE   MET  27          1HE       MET  27  23.468   6.497   6.497
  224   2HE   MET  27          3HE       MET  27  25.119   5.950   5.950
  225   3HE   MET  27          2HE       MET  27  24.747   6.790   6.790
  226    H    LEU  28           H        LEU  28  20.122   0.331   0.331
  227    HA   LEU  28           HA       LEU  28  18.022   1.226   1.226
  228   1HB   LEU  28          2HB       LEU  28  18.866  -1.219  -1.219
  229   2HB   LEU  28          1HB       LEU  28  17.119  -1.101  -1.101
  230    HG   LEU  28           HG       LEU  28  18.107  -2.245  -2.245
  231   1HD1  LEU  28          3HD1      LEU  28  16.565   0.238   0.238
  232   2HD1  LEU  28          2HD1      LEU  28  17.446  -0.111  -0.111
  233   3HD1  LEU  28          1HD1      LEU  28  16.318  -1.296  -1.296
  234   1HD2  LEU  28          1HD2      LEU  28  20.326  -1.095  -1.095
  235   2HD2  LEU  28          3HD2      LEU  28  19.665  -1.103  -1.103
  236   3HD2  LEU  28          2HD2      LEU  28  19.576   0.361   0.361
  237    H    ARG  29           H        ARG  29  18.269   1.044   1.044
  238    HA   ARG  29           HA       ARG  29  15.376   1.471   1.471
  239   1HB   ARG  29          2HB       ARG  29  17.540   1.554   1.554
  240   2HB   ARG  29          1HB       ARG  29  15.811   1.327   1.327
  241   1HG   ARG  29          2HG       ARG  29  16.050  -0.898  -0.898
  242   2HG   ARG  29          1HG       ARG  29  16.700  -0.668  -0.668
  243   1HD   ARG  29          2HD       ARG  29  18.255  -1.893  -1.893
  244   2HD   ARG  29          1HD       ARG  29  18.945  -0.427  -0.427
  245    HE   ARG  29           HE       ARG  29  17.662   0.032   0.032
  246   1HH1  ARG  29          2HH1      ARG  29  20.049  -2.126  -2.126
  247   2HH1  ARG  29          1HH1      ARG  29  21.321  -1.206  -1.206
  248   1HH2  ARG  29          1HH2      ARG  29  19.496   1.743   1.743
  249   2HH2  ARG  29          2HH2      ARG  29  21.007   0.986   0.986
  250    H    LYS  30           H        LYS  30  18.377   3.302   3.302
  251    HA   LYS  30           HA       LYS  30  17.125   5.627   5.627
  252   1HB   LYS  30          2HB       LYS  30  19.630   5.011   5.011
  253   2HB   LYS  30          1HB       LYS  30  19.647   5.713   5.713
  254   1HG   LYS  30          2HG       LYS  30  19.025   7.858   7.858
  255   2HG   LYS  30          1HG       LYS  30  18.521   7.215   7.215
  256   1HD   LYS  30          2HD       LYS  30  20.588   7.967   7.967
  257   2HD   LYS  30          1HD       LYS  30  21.098   6.405   6.405
  258   1HE   LYS  30          2HE       LYS  30  21.864   7.341   7.341
  259   2HE   LYS  30          1HE       LYS  30  20.901   8.804   8.804
  260   1HZ   LYS  30          2HZ       LYS  30  23.073   8.081   8.081
  261   2HZ   LYS  30          1HZ       LYS  30  23.368   8.982   8.982
  262   3HZ   LYS  30          3HZ       LYS  30  22.328   9.593   9.593
  263    H    ILE  31           H        ILE  31  17.612   4.595   4.595
  264    HA   ILE  31           HA       ILE  31  16.921   7.187   7.187
  265    HB   ILE  31           HB       ILE  31  16.970   4.410   4.410
  266   1HG1  ILE  31          2HG1      ILE  31  19.000   6.638   6.638
  267   2HG1  ILE  31          1HG1      ILE  31  19.136   5.399   5.399
  268   1HG2  ILE  31          1HG2      ILE  31  16.469   7.164   7.164
  269   2HG2  ILE  31          3HG2      ILE  31  17.340   6.005   6.005
  270   3HG2  ILE  31          2HG2      ILE  31  15.709   5.635   5.635
  271   1HD1  ILE  31          3HD1      ILE  31  18.752   4.652   4.652
  272   2HD1  ILE  31          2HD1      ILE  31  20.358   4.981   4.981
  273   3HD1  ILE  31          1HD1      ILE  31  19.391   3.664   3.664
  274    H    ALA  32           H        ALA  32  15.181   4.354   4.354
  275    HA   ALA  32           HA       ALA  32  12.694   5.096   5.096
  276   1HB   ALA  32          2HB       ALA  32  13.733   2.800   2.800
  277   2HB   ALA  32          1HB       ALA  32  12.156   3.240   3.240
  278   3HB   ALA  32          3HB       ALA  32  12.333   2.903   2.903
  279    H    VAL  33           H        VAL  33  14.255   5.782   5.782
  280    HA   VAL  33           HA       VAL  33  11.795   6.586   6.586
  281    HB   VAL  33           HB       VAL  33  14.600   7.399   7.399
  282   1HG1  VAL  33          3HG1      VAL  33  11.960   6.927   6.927
  283   2HG1  VAL  33          2HG1      VAL  33  13.466   6.892   6.892
  284   3HG1  VAL  33          1HG1      VAL  33  12.994   8.355   8.355
  285   1HG2  VAL  33          2HG2      VAL  33  13.605   4.674   4.674
  286   2HG2  VAL  33          1HG2      VAL  33  15.219   5.227   5.227
  287   3HG2  VAL  33          3HG2      VAL  33  13.985   5.025   5.025
  288    H    ALA  34           H        ALA  34  14.572   8.103   8.103
  289    HA   ALA  34           HA       ALA  34  13.721  10.823  10.823
  290   1HB   ALA  34          3HB       ALA  34  15.707   9.414   9.414
  291   2HB   ALA  34          2HB       ALA  34  15.255  11.066  11.066
  292   3HB   ALA  34          1HB       ALA  34  15.970  10.722  10.722
  293    H    ALA  35           H        ALA  35  13.282   8.424   8.424
  294    HA   ALA  35           HA       ALA  35  11.905  10.057  10.057
  295   1HB   ALA  35          1HB       ALA  35  12.188   7.130   7.130
  296   2HB   ALA  35          3HB       ALA  35  10.866   7.632   7.632
  297   3HB   ALA  35          2HB       ALA  35  12.532   8.023   8.023
  298    H    ALA  36           H        ALA  36  10.769   7.959   7.959
  299    HA   ALA  36           HA       ALA  36   7.975   8.752   8.752
  300   1HB   ALA  36          3HB       ALA  36   9.463   6.928   6.928
  301   2HB   ALA  36          2HB       ALA  36   7.756   7.307   7.307
  302   3HB   ALA  36          1HB       ALA  36   8.289   6.491   6.491
  303    H    SER  37           H        SER  37   9.664  11.017  11.017
  304    HA   SER  37           HA       SER  37   9.646  11.642  11.642
  305   1HB   SER  37          2HB       SER  37  10.854  12.821  12.821
  306   2HB   SER  37          1HB       SER  37   9.376  13.776  13.776
  307    HG   SER  37           HG       SER  37  11.422  14.126  14.126
  308    H    LYS  38           H        LYS  38   7.324  11.949  11.949
  309    HA   LYS  38           HA       LYS  38   5.142  12.282  12.282
  310   1HB   LYS  38          2HB       LYS  38   6.076  14.536  14.536
  311   2HB   LYS  38          1HB       LYS  38   4.360  14.373  14.373
  312   1HG   LYS  38          2HG       LYS  38   5.148  14.172  14.172
  313   2HG   LYS  38          1HG       LYS  38   6.656  14.874  14.874
  314   1HD   LYS  38          2HD       LYS  38   4.045  16.168  16.168
  315   2HD   LYS  38          1HD       LYS  38   4.744  16.457  16.457
  316   1HE   LYS  38          2HE       LYS  38   6.546  17.617  17.617
  317   2HE   LYS  38          1HE       LYS  38   6.560  16.702  16.702
  318   1HZ   LYS  38          2HZ       LYS  38   4.415  18.623  18.623
  319   2HZ   LYS  38          1HZ       LYS  38   5.799  19.066  19.066
  320   3HZ   LYS  38          3HZ       LYS  38   4.725  17.916  17.916
  321    HA   PRO  39           HA       PRO  39   4.307  10.097  10.097
  322   1HB   PRO  39          2HB       PRO  39   3.514   7.720   7.720
  323   2HB   PRO  39          1HB       PRO  39   5.172   8.081   8.081
  324   1HG   PRO  39          2HG       PRO  39   4.015   7.980   7.980
  325   2HG   PRO  39          1HG       PRO  39   5.686   7.714   7.714
  326   1HD   PRO  39          2HD       PRO  39   4.697  10.068  10.068
  327   2HD   PRO  39          1HD       PRO  39   6.244   9.905   9.905
  328    H    ALA  40           H        ALA  40   2.250  10.258  10.258
  329    HA   ALA  40           HA       ALA  40   0.051  11.022  11.022
  330   1HB   ALA  40          1HB       ALA  40   0.696  12.002  12.002
  331   2HB   ALA  40          3HB       ALA  40  -0.297  10.666  10.666
  332   3HB   ALA  40          2HB       ALA  40  -0.994  11.884  11.884
  333    H    VAL  41           H        VAL  41  -2.162  10.038  10.038
  334    HA   VAL  41           HA       VAL  41  -2.152   7.272   7.272
  335    HB   VAL  41           HB       VAL  41  -2.443   8.016   8.016
  336   1HG1  VAL  41          3HG1      VAL  41  -3.461   5.489   5.489
  337   2HG1  VAL  41          2HG1      VAL  41  -3.345   5.736   5.736
  338   3HG1  VAL  41          1HG1      VAL  41  -4.456   6.715   6.715
  339   1HG2  VAL  41          1HG2      VAL  41  -0.864   6.013   6.013
  340   2HG2  VAL  41          3HG2      VAL  41  -0.258   7.294   7.294
  341   3HG2  VAL  41          2HG2      VAL  41  -1.040   5.877   5.877
  342    H    GLU  42           H        GLU  42  -4.110   6.907   6.907
  343    HA   GLU  42           HA       GLU  42  -6.382   8.695   8.695
  344   1HB   GLU  42          2HB       GLU  42  -5.505   9.231   9.231
  345   2HB   GLU  42          1HB       GLU  42  -5.764   7.560   7.560
  346   1HG   GLU  42          2HG       GLU  42  -8.221   7.926   7.926
  347   2HG   GLU  42          1HG       GLU  42  -7.830   9.646   9.646
  348    H    ILE  43           H        ILE  43  -7.782   7.454   7.454
  349    HA   ILE  43           HA       ILE  43  -8.020   4.573   4.573
  350    HB   ILE  43           HB       ILE  43  -8.871   6.224   6.224
  351   1HG1  ILE  43          2HG1      ILE  43  -7.211   3.849   3.849
  352   2HG1  ILE  43          1HG1      ILE  43  -6.456   4.979   4.979
  353   1HG2  ILE  43          2HG2      ILE  43  -9.603   3.422   3.422
  354   2HG2  ILE  43          1HG2      ILE  43  -9.334   3.792   3.792
  355   3HG2  ILE  43          3HG2      ILE  43 -10.584   4.650   4.650
  356   1HD1  ILE  43          2HD1      ILE  43  -7.627   6.382   6.382
  357   2HD1  ILE  43          1HD1      ILE  43  -6.470   5.164   5.164
  358   3HD1  ILE  43          3HD1      ILE  43  -5.970   6.416   6.416
  359    H    LYS  44           H        LYS  44  -9.855   3.720   3.720
  360    HA   LYS  44           HA       LYS  44 -12.159   5.566   5.566
  361   1HB   LYS  44          2HB       LYS  44 -12.102   3.148   3.148
  362   2HB   LYS  44          1HB       LYS  44 -12.337   4.824   4.824
  363   1HG   LYS  44          2HG       LYS  44  -9.942   5.209   5.209
  364   2HG   LYS  44          1HG       LYS  44  -9.617   3.645   3.645
  365   1HD   LYS  44          2HD       LYS  44 -10.188   2.468   2.468
  366   2HD   LYS  44          1HD       LYS  44 -11.195   3.777   3.777
  367   1HE   LYS  44          2HE       LYS  44  -9.223   5.130   5.130
  368   2HE   LYS  44          1HE       LYS  44  -8.176   3.909   3.909
  369   1HZ   LYS  44          1HZ       LYS  44  -9.115   2.338   2.338
  370   2HZ   LYS  44          3HZ       LYS  44  -9.794   3.687   3.687
  371   3HZ   LYS  44          2HZ       LYS  44  -8.107   3.562   3.562
  372    H    GLN  45           H        GLN  45 -13.821   5.029   5.029
  373    HA   GLN  45           HA       GLN  45 -13.944   2.232   2.232
  374   1HB   GLN  45          2HB       GLN  45 -13.973   4.026   4.026
  375   2HB   GLN  45          1HB       GLN  45 -15.424   4.706   4.706
  376   1HG   GLN  45          2HG       GLN  45 -16.691   2.693   2.693
  377   2HG   GLN  45          1HG       GLN  45 -15.246   1.884   1.884
  378   1HE2  GLN  45          2HE2      GLN  45 -16.207   2.972   2.972
  379   2HE2  GLN  45          1HE2      GLN  45 -15.920   1.648   1.648
  380    H    GLU  46           H        GLU  46 -15.263   0.863   0.863
  381    HA   GLU  46           HA       GLU  46 -17.825   1.925   1.925
  382   1HB   GLU  46          2HB       GLU  46 -15.819  -0.002  -0.002
  383   2HB   GLU  46          1HB       GLU  46 -17.517  -0.397  -0.397
  384   1HG   GLU  46          2HG       GLU  46 -17.888   1.471   1.471
  385   2HG   GLU  46          1HG       GLU  46 -16.603   2.401   2.401
  386    H    GLY  47           H        GLY  47 -17.875   1.352   1.352
  387   1HA   GLY  47          2HA       GLY  47 -19.396   0.122   0.122
  388   2HA   GLY  47          1HA       GLY  47 -19.497  -1.122  -1.122
  389    H    ASP  48           H        ASP  48 -18.610  -3.002  -3.002
  390    HA   ASP  48           HA       ASP  48 -16.564  -3.009  -3.009
  391   1HB   ASP  48          2HB       ASP  48 -16.515  -5.512  -5.512
  392   2HB   ASP  48          1HB       ASP  48 -18.028  -4.885  -4.885
  393    H    THR  49           H        THR  49 -16.347  -2.345  -2.345
  394    HA   THR  49           HA       THR  49 -13.827  -3.829  -3.829
  395    HB   THR  49           HB       THR  49 -15.653  -2.210  -2.210
  396    HG1  THR  49           HG1      THR  49 -16.369  -4.183  -4.183
  397   1HG2  THR  49          3HG2      THR  49 -13.332  -1.671  -1.671
  398   2HG2  THR  49          2HG2      THR  49 -12.964  -3.393  -3.393
  399   3HG2  THR  49          1HG2      THR  49 -14.118  -2.667  -2.667
  400    H    PHE  50           H        PHE  50 -11.854  -2.769  -2.769
  401    HA   PHE  50           HA       PHE  50 -11.870   0.187   0.187
  402   1HB   PHE  50          2HB       PHE  50 -10.341  -1.755  -1.755
  403   2HB   PHE  50          1HB       PHE  50 -10.076  -0.008  -0.008
  404    HD1  PHE  50           HD2      PHE  50 -11.996   1.537   1.537
  405    HD2  PHE  50           HD1      PHE  50 -12.189  -2.703  -2.703
  406    HE1  PHE  50           HE2      PHE  50 -13.949   1.839   1.839
  407    HE2  PHE  50           HE1      PHE  50 -14.143  -2.404  -2.404
  408    HZ   PHE  50           HZ       PHE  50 -15.035  -0.138  -0.138
  409    H    TYR  51           H        TYR  51 -10.732   0.925   0.925
  410    HA   TYR  51           HA       TYR  51  -8.504  -0.677  -0.677
  411   1HB   TYR  51          2HB       TYR  51 -10.354   0.067   0.067
  412   2HB   TYR  51          1HB       TYR  51  -9.987   1.736   1.736
  413    HD1  TYR  51           HD1      TYR  51  -7.505   2.473   2.473
  414    HD2  TYR  51           HD2      TYR  51  -9.301  -0.922  -0.922
  415    HE1  TYR  51           HE1      TYR  51  -5.781   2.539   2.539
  416    HE2  TYR  51           HE2      TYR  51  -7.570  -0.854  -0.854
  417    HH   TYR  51           HH       TYR  51  -6.037   0.953   0.953
  418    H    ILE  52           H        ILE  52  -6.405   0.377   0.377
  419    HA   ILE  52           HA       ILE  52  -6.187   3.040   3.040
  420    HB   ILE  52           HB       ILE  52  -4.248   0.928   0.928
  421   1HG1  ILE  52          2HG1      ILE  52  -7.062   1.286   1.286
  422   2HG1  ILE  52          1HG1      ILE  52  -6.418  -0.165  -0.165
  423   1HG2  ILE  52          3HG2      ILE  52  -4.310   3.518   3.518
  424   2HG2  ILE  52          2HG2      ILE  52  -5.523   3.055   3.055
  425   3HG2  ILE  52          1HG2      ILE  52  -3.895   2.384   2.384
  426   1HD1  ILE  52          3HD1      ILE  52  -4.601   0.369   0.369
  427   2HD1  ILE  52          2HD1      ILE  52  -6.167   0.743   0.743
  428   3HD1  ILE  52          1HD1      ILE  52  -5.871  -0.855  -0.855
  429    H    LYS  53           H        LYS  53  -5.235   4.182   4.182
  430    HA   LYS  53           HA       LYS  53  -2.961   2.940   2.940
  431   1HB   LYS  53          2HB       LYS  53  -4.775   4.064   4.064
  432   2HB   LYS  53          1HB       LYS  53  -4.398   5.573   5.573
  433   1HG   LYS  53          2HG       LYS  53  -1.932   4.573   4.573
  434   2HG   LYS  53          1HG       LYS  53  -3.095   4.363   4.363
  435   1HD   LYS  53          2HD       LYS  53  -3.795   6.764   6.764
  436   2HD   LYS  53          1HD       LYS  53  -2.443   6.931   6.931
  437   1HE   LYS  53          2HE       LYS  53  -0.844   6.440   6.440
  438   2HE   LYS  53          1HE       LYS  53  -2.121   5.976   5.976
  439   1HZ   LYS  53          3HZ       LYS  53  -1.926   8.686   8.686
  440   2HZ   LYS  53          2HZ       LYS  53  -1.192   8.270   8.270
  441   3HZ   LYS  53          1HZ       LYS  53  -2.881   8.188   8.188
  442    H    THR  54           H        THR  54  -1.081   3.269   3.269
  443    HA   THR  54           HA       THR  54  -0.709   5.906   5.906
  444    HB   THR  54           HB       THR  54   1.120   3.491   3.491
  445    HG1  THR  54           HG1      THR  54  -0.842   2.807   2.807
  446   1HG2  THR  54          3HG2      THR  54   1.302   6.136   6.136
  447   2HG2  THR  54          2HG2      THR  54   0.907   5.126   5.126
  448   3HG2  THR  54          1HG2      THR  54   2.333   4.767   4.767
  449    H    SER  55           H        SER  55   1.002   7.265   7.265
  450    HA   SER  55           HA       SER  55   2.696   6.395   6.395
  451   1HB   SER  55          2HB       SER  55   1.731   9.175   9.175
  452   2HB   SER  55          1HB       SER  55   1.931   7.949   7.949
  453    HG   SER  55           HG       SER  55  -0.016   7.045   7.045
  454    H    THR  56           H        THR  56   4.742   6.748   6.748
  455    HA   THR  56           HA       THR  56   5.363   8.833   8.833
  456    HB   THR  56           HB       THR  56   7.601   7.213   7.213
  457    HG1  THR  56           HG1      THR  56   5.449   5.866   5.866
  458   1HG2  THR  56          1HG2      THR  56   6.942   8.543   8.543
  459   2HG2  THR  56          3HG2      THR  56   6.622   6.871   6.871
  460   3HG2  THR  56          2HG2      THR  56   8.221   7.334   7.334
  461    H    THR  57           H        THR  57   8.088   9.218   9.218
  462    HA   THR  57           HA       THR  57   7.768  11.326  11.326
  463    HB   THR  57           HB       THR  57   9.636  11.247  11.247
  464    HG1  THR  57           HG1      THR  57  11.309  11.677  11.677
  465   1HG2  THR  57          3HG2      THR  57   9.959   8.753   8.753
  466   2HG2  THR  57          2HG2      THR  57  10.757   9.012   9.012
  467   3HG2  THR  57          1HG2      THR  57  11.456   9.681   9.681
  468    H    VAL  58           H        VAL  58   8.957   7.989   7.989
  469    HA   VAL  58           HA       VAL  58   8.587   8.333   8.333
  470    HB   VAL  58           HB       VAL  58  10.747   6.699   6.699
  471   1HG1  VAL  58          1HG1      VAL  58   9.874   7.241   7.241
  472   2HG1  VAL  58          3HG1      VAL  58  11.610   7.138   7.138
  473   3HG1  VAL  58          2HG1      VAL  58  10.564   5.775   5.775
  474   1HG2  VAL  58          3HG2      VAL  58  10.589   9.561   9.561
  475   2HG2  VAL  58          2HG2      VAL  58  11.859   8.640   8.640
  476   3HG2  VAL  58          1HG2      VAL  58  11.894   8.845   8.845
  477    H    ARG  59           H        ARG  59   7.676   6.527   6.527
  478    HA   ARG  59           HA       ARG  59   7.152   4.085   4.085
  479   1HB   ARG  59          2HB       ARG  59   8.286   3.893   3.893
  480   2HB   ARG  59          1HB       ARG  59   6.788   4.466   4.466
  481   1HG   ARG  59          2HG       ARG  59   5.608   2.543   2.543
  482   2HG   ARG  59          1HG       ARG  59   6.678   2.165   2.165
  483   1HD   ARG  59          2HD       ARG  59   7.569   0.637   0.637
  484   2HD   ARG  59          1HD       ARG  59   8.430   2.028   2.028
  485    HE   ARG  59           HE       ARG  59   6.154   0.653   0.653
  486   1HH1  ARG  59          2HH1      ARG  59   5.269   3.327   3.327
  487   2HH1  ARG  59          1HH1      ARG  59   6.196   3.914   3.914
  488   1HH2  ARG  59          1HH2      ARG  59   8.616   1.444   1.444
  489   2HH2  ARG  59          2HH2      ARG  59   8.091   2.848   2.848
  490    H    THR  60           H        THR  60   4.954   3.024   3.024
  491    HA   THR  60           HA       THR  60   2.765   4.741   4.741
  492    HB   THR  60           HB       THR  60   2.800   3.916   3.916
  493    HG1  THR  60           HG1      THR  60   3.329   6.123   6.123
  494   1HG2  THR  60          1HG2      THR  60   0.627   4.406   4.406
  495   2HG2  THR  60          3HG2      THR  60   1.225   6.024   6.024
  496   3HG2  THR  60          2HG2      THR  60   0.983   5.532   5.532
  497    H    THR  61           H        THR  61   2.195   2.931   2.931
  498    HA   THR  61           HA       THR  61   1.719   0.324   0.324
  499    HB   THR  61           HB       THR  61   0.999  -0.257  -0.257
  500    HG1  THR  61           HG1      THR  61   1.838   1.189   1.189
  501   1HG2  THR  61          1HG2      THR  61   3.814   0.540   0.540
  502   2HG2  THR  61          3HG2      THR  61   3.428  -0.376  -0.376
  503   3HG2  THR  61          2HG2      THR  61   3.081  -1.058  -1.058
  504    H    GLU  62           H        GLU  62  -0.394  -0.792  -0.792
  505    HA   GLU  62           HA       GLU  62  -2.733   0.907   0.907
  506   1HB   GLU  62          2HB       GLU  62  -1.892   0.174   0.174
  507   2HB   GLU  62          1HB       GLU  62  -3.569  -0.226  -0.226
  508   1HG   GLU  62          2HG       GLU  62  -4.043   2.059   2.059
  509   2HG   GLU  62          1HG       GLU  62  -2.339   2.494   2.494
  510    H    ILE  63           H        ILE  63  -4.054  -0.394  -0.394
  511    HA   ILE  63           HA       ILE  63  -3.996  -3.342  -3.342
  512    HB   ILE  63           HB       ILE  63  -4.458  -3.652  -3.652
  513   1HG1  ILE  63          2HG1      ILE  63  -3.835  -0.686  -0.686
  514   2HG1  ILE  63          1HG1      ILE  63  -5.452  -1.371  -1.371
  515   1HG2  ILE  63          1HG2      ILE  63  -2.115  -3.572  -3.572
  516   2HG2  ILE  63          3HG2      ILE  63  -1.978  -1.966  -1.966
  517   3HG2  ILE  63          2HG2      ILE  63  -2.199  -3.376  -3.376
  518   1HD1  ILE  63          2HD1      ILE  63  -3.390  -2.628  -2.628
  519   2HD1  ILE  63          1HD1      ILE  63  -3.765  -0.951  -0.951
  520   3HD1  ILE  63          3HD1      ILE  63  -5.046  -2.162  -2.162
  521    H    ASN  64           H        ASN  64  -6.107  -4.414  -4.414
  522    HA   ASN  64           HA       ASN  64  -8.447  -2.693  -2.693
  523   1HB   ASN  64          2HB       ASN  64  -9.581  -3.564  -3.564
  524   2HB   ASN  64          1HB       ASN  64  -8.205  -2.525  -2.525
  525   1HD2  ASN  64          2HD2      ASN  64  -6.131  -5.219  -5.219
  526   2HD2  ASN  64          1HD2      ASN  64  -6.053  -3.759  -3.759
  527    H    PHE  65           H        PHE  65  -9.910  -3.880  -3.880
  528    HA   PHE  65           HA       PHE  65 -10.224  -6.768  -6.768
  529   1HB   PHE  65          2HB       PHE  65  -9.422  -7.479  -7.479
  530   2HB   PHE  65          1HB       PHE  65  -8.131  -6.658  -6.658
  531    HD1  PHE  65           HD2      PHE  65  -7.506  -4.309  -4.309
  532    HD2  PHE  65           HD1      PHE  65 -10.395  -6.545  -6.545
  533    HE1  PHE  65           HE2      PHE  65  -7.333  -2.665  -2.665
  534    HE2  PHE  65           HE1      PHE  65 -10.232  -4.907  -4.907
  535    HZ   PHE  65           HZ       PHE  65  -8.700  -2.963  -2.963
  536    H    LYS  66           H        LYS  66 -11.388  -7.648  -7.648
  537    HA   LYS  66           HA       LYS  66 -13.537  -5.723  -5.723
  538   1HB   LYS  66          2HB       LYS  66 -15.103  -7.738  -7.738
  539   2HB   LYS  66          1HB       LYS  66 -14.616  -7.148  -7.148
  540   1HG   LYS  66          2HG       LYS  66 -12.867  -8.884  -8.884
  541   2HG   LYS  66          1HG       LYS  66 -13.345  -9.471  -9.471
  542   1HD   LYS  66          2HD       LYS  66 -14.635 -10.896 -10.896
  543   2HD   LYS  66          1HD       LYS  66 -15.751  -9.532  -9.532
  544   1HE   LYS  66          2HE       LYS  66 -14.369  -8.753  -8.753
  545   2HE   LYS  66          1HE       LYS  66 -13.996 -10.472 -10.472
  546   1HZ   LYS  66          2HZ       LYS  66 -16.504 -10.779 -10.779
  547   2HZ   LYS  66          1HZ       LYS  66 -16.624  -9.139  -9.139
  548   3HZ   LYS  66          3HZ       LYS  66 -15.940 -10.249 -10.249
  549    H    VAL  67           H        VAL  67 -14.418  -6.196  -6.196
  550    HA   VAL  67           HA       VAL  67 -12.346  -7.390  -7.390
  551    HB   VAL  67           HB       VAL  67 -14.888  -6.637  -6.637
  552   1HG1  VAL  67          2HG1      VAL  67 -11.978  -5.859  -5.859
  553   2HG1  VAL  67          1HG1      VAL  67 -13.280  -5.454  -5.454
  554   3HG1  VAL  67          3HG1      VAL  67 -12.825  -7.138  -7.138
  555   1HG2  VAL  67          3HG2      VAL  67 -13.402  -4.715  -4.715
  556   2HG2  VAL  67          2HG2      VAL  67 -15.126  -4.797  -4.797
  557   3HG2  VAL  67          1HG2      VAL  67 -14.007  -4.143  -4.143
  558    H    GLY  68           H        GLY  68 -12.413  -9.639  -9.639
  559   1HA   GLY  68          2HA       GLY  68 -13.780 -11.370 -11.370
  560   2HA   GLY  68          1HA       GLY  68 -15.011 -11.027 -11.027
  561    H    GLU  69           H        GLU  69 -12.855 -10.731 -10.731
  562    HA   GLU  69           HA       GLU  69 -12.216 -13.648 -13.648
  563   1HB   GLU  69          2HB       GLU  69 -12.922 -11.714 -11.714
  564   2HB   GLU  69          1HB       GLU  69 -12.604 -13.439 -13.439
  565   1HG   GLU  69          2HG       GLU  69 -14.527 -13.737 -13.737
  566   2HG   GLU  69          1HG       GLU  69 -14.962 -12.084 -12.084
  567    H    GLU  70           H        GLU  70 -10.284 -14.118 -14.118
  568    HA   GLU  70           HA       GLU  70  -8.160 -12.134 -12.134
  569   1HB   GLU  70          2HB       GLU  70  -7.908 -14.865 -14.865
  570   2HB   GLU  70          1HB       GLU  70  -6.625 -13.904 -13.904
  571   1HG   GLU  70          2HG       GLU  70  -7.678 -14.125 -14.125
  572   2HG   GLU  70          1HG       GLU  70  -9.016 -15.026 -15.026
  573    H    PHE  71           H        PHE  71  -6.537 -11.808 -11.808
  574    HA   PHE  71           HA       PHE  71  -7.534 -12.005 -12.005
  575   1HB   PHE  71          2HB       PHE  71  -7.495  -9.519  -9.519
  576   2HB   PHE  71          1HB       PHE  71  -8.796 -10.049 -10.049
  577    HD1  PHE  71           HD2      PHE  71  -8.394  -9.962  -9.962
  578    HD2  PHE  71           HD1      PHE  71  -5.871  -7.980  -7.980
  579    HE1  PHE  71           HE2      PHE  71  -7.495  -8.511  -8.511
  580    HE2  PHE  71           HE1      PHE  71  -4.972  -6.529  -6.529
  581    HZ   PHE  71           HZ       PHE  71  -5.782  -6.791  -6.791
  582    H    GLU  72           H        GLU  72  -5.955 -10.719 -10.719
  583    HA   GLU  72           HA       GLU  72  -3.214 -11.087 -11.087
  584   1HB   GLU  72          2HB       GLU  72  -3.728 -10.596 -10.596
  585   2HB   GLU  72          1HB       GLU  72  -2.401 -11.458 -11.458
  586   1HG   GLU  72          2HG       GLU  72  -3.982 -13.261 -13.261
  587   2HG   GLU  72          1HG       GLU  72  -5.266 -12.428 -12.428
  588    H    GLU  73           H        GLU  73  -1.788  -9.346  -9.346
  589    HA   GLU  73           HA       GLU  73  -2.453  -6.816  -6.816
  590   1HB   GLU  73          2HB       GLU  73  -2.512  -5.529  -5.529
  591   2HB   GLU  73          1HB       GLU  73  -3.908  -6.583  -6.583
  592   1HG   GLU  73          2HG       GLU  73  -3.286  -8.003  -8.003
  593   2HG   GLU  73          1HG       GLU  73  -1.564  -7.785  -7.785
  594    H    GLN  74           H        GLN  74  -0.837  -5.084  -5.084
  595    HA   GLN  74           HA       GLN  74   1.836  -6.427  -6.427
  596   1HB   GLN  74          2HB       GLN  74   0.890  -3.592  -3.592
  597   2HB   GLN  74          1HB       GLN  74   2.595  -3.941  -3.941
  598   1HG   GLN  74          2HG       GLN  74   2.121  -5.811  -5.811
  599   2HG   GLN  74          1HG       GLN  74   0.882  -4.649  -4.649
  600   1HE2  GLN  74          2HE2      GLN  74   4.839  -3.567  -3.567
  601   2HE2  GLN  74          1HE2      GLN  74   4.402  -4.825  -4.825
  602    H    THR  75           H        THR  75   3.489  -5.753  -5.753
  603    HA   THR  75           HA       THR  75   2.278  -5.314  -5.314
  604    HB   THR  75           HB       THR  75   3.916  -7.193  -7.193
  605    HG1  THR  75           HG1      THR  75   3.472  -6.265  -6.265
  606   1HG2  THR  75          2HG2      THR  75   5.507  -5.038  -5.038
  607   2HG2  THR  75          1HG2      THR  75   6.315  -5.707  -5.707
  608   3HG2  THR  75          3HG2      THR  75   5.911  -6.752  -6.752
  609    H    VAL  76           H        VAL  76   5.047  -4.150  -4.150
  610    HA   VAL  76           HA       VAL  76   4.407  -1.377  -1.377
  611    HB   VAL  76           HB       VAL  76   5.945  -2.268  -2.268
  612   1HG1  VAL  76          3HG1      VAL  76   4.819   0.377   0.377
  613   2HG1  VAL  76          2HG1      VAL  76   5.319   0.090   0.090
  614   3HG1  VAL  76          1HG1      VAL  76   6.501  -0.010  -0.010
  615   1HG2  VAL  76          3HG2      VAL  76   3.522  -3.008  -3.008
  616   2HG2  VAL  76          2HG2      VAL  76   3.925  -1.925  -1.925
  617   3HG2  VAL  76          1HG2      VAL  76   3.078  -1.304  -1.304
  618    H    ASP  77           H        ASP  77   6.872  -3.811  -3.811
  619    HA   ASP  77           HA       ASP  77   8.992  -1.855  -1.855
  620   1HB   ASP  77          2HB       ASP  77   9.100  -4.237  -4.237
  621   2HB   ASP  77          1HB       ASP  77   9.488  -4.751  -4.751
  622    H    GLY  78           H        GLY  78   7.247  -4.495  -4.495
  623   1HA   GLY  78          2HA       GLY  78   6.652  -3.657  -3.657
  624   2HA   GLY  78          1HA       GLY  78   8.405  -3.668  -3.668
  625    H    ARG  79           H        ARG  79   6.277  -5.962  -5.962
  626    HA   ARG  79           HA       ARG  79   7.153  -8.083  -8.083
  627   1HB   ARG  79          2HB       ARG  79   7.327  -7.959  -7.959
  628   2HB   ARG  79          1HB       ARG  79   6.990  -9.510  -9.510
  629   1HG   ARG  79          2HG       ARG  79   9.165  -8.025  -8.025
  630   2HG   ARG  79          1HG       ARG  79   9.509  -8.434  -8.434
  631   1HD   ARG  79          2HD       ARG  79   8.395 -10.515 -10.515
  632   2HD   ARG  79          1HD       ARG  79  10.123 -10.163 -10.163
  633    HE   ARG  79           HE       ARG  79   8.951 -10.698 -10.698
  634   1HH1  ARG  79          1HH2      ARG  79  11.748 -11.210 -11.210
  635   2HH1  ARG  79          2HH2      ARG  79  11.868 -12.900 -12.900
  636   1HH2  ARG  79          2HH1      ARG  79   8.571 -13.185 -13.185
  637   2HH2  ARG  79          1HH1      ARG  79  10.070 -14.017 -14.017
  638    HA   PRO  80           HA       PRO  80   2.806  -8.950  -8.950
  639   1HB   PRO  80          2HB       PRO  80   2.851 -11.550 -11.550
  640   2HB   PRO  80          1HB       PRO  80   3.120 -10.141 -10.141
  641   1HG   PRO  80          2HG       PRO  80   5.094 -12.120 -12.120
  642   2HG   PRO  80          1HG       PRO  80   5.168 -11.115 -11.115
  643   1HD   PRO  80          2HD       PRO  80   6.532 -10.625 -10.625
  644   2HD   PRO  80          1HD       PRO  80   6.353  -9.483  -9.483
  645    H    CYS  81           H        CYS  81   1.313  -9.769  -9.769
  646    HA   CYS  81           HA       CYS  81   1.822 -12.149 -12.149
  647   1HB   CYS  81          2HB       CYS  81   1.606 -10.918 -10.918
  648   2HB   CYS  81          1HB       CYS  81   3.120 -10.607 -10.607
  649    HG   CYS  81           HG       CYS  81   0.732  -8.588  -8.588
  650    H    LYS  82           H        LYS  82  -0.100 -12.965 -12.965
  651    HA   LYS  82           HA       LYS  82  -2.572 -11.630 -11.630
  652   1HB   LYS  82          2HB       LYS  82  -2.285 -14.049 -14.049
  653   2HB   LYS  82          1HB       LYS  82  -2.109 -14.309 -14.309
  654   1HG   LYS  82          2HG       LYS  82  -4.427 -13.115 -13.115
  655   2HG   LYS  82          1HG       LYS  82  -4.551 -13.535 -13.535
  656   1HD   LYS  82          2HD       LYS  82  -3.678 -15.683 -15.683
  657   2HD   LYS  82          1HD       LYS  82  -5.376 -15.210 -15.210
  658   1HE   LYS  82          2HE       LYS  82  -5.283 -15.427 -15.427
  659   2HE   LYS  82          1HE       LYS  82  -3.799 -16.338 -16.338
  660   1HZ   LYS  82          3HZ       LYS  82  -5.066 -17.786 -17.786
  661   2HZ   LYS  82          2HZ       LYS  82  -6.488 -16.952 -16.952
  662   3HZ   LYS  82          1HZ       LYS  82  -5.645 -17.840 -17.840
  663    H    SER  83           H        SER  83  -3.463 -10.184 -10.184
  664    HA   SER  83           HA       SER  83  -2.866 -10.353 -10.353
  665   1HB   SER  83          2HB       SER  83  -2.419  -8.184  -8.184
  666   2HB   SER  83          1HB       SER  83  -3.759  -8.191  -8.191
  667    HG   SER  83           HG       SER  83  -4.092  -6.903  -6.903
  668    H    LEU  84           H        LEU  84  -4.708  -9.750  -9.750
  669    HA   LEU  84           HA       LEU  84  -7.415 -10.397 -10.397
  670   1HB   LEU  84          2HB       LEU  84  -6.593 -12.602 -12.602
  671   2HB   LEU  84          1HB       LEU  84  -6.052 -11.934 -11.934
  672    HG   LEU  84           HG       LEU  84  -8.363 -11.437 -11.437
  673   1HD1  LEU  84          1HD1      LEU  84  -8.866 -11.631 -11.631
  674   2HD1  LEU  84          3HD1      LEU  84  -9.763 -12.948 -12.948
  675   3HD1  LEU  84          2HD1      LEU  84 -10.031 -11.288 -11.288
  676   1HD2  LEU  84          2HD2      LEU  84  -7.229 -13.820 -13.820
  677   2HD2  LEU  84          1HD2      LEU  84  -8.924 -13.616 -13.616
  678   3HD2  LEU  84          3HD2      LEU  84  -8.499 -14.245 -14.245
  679    H    VAL  85           H        VAL  85  -9.055  -9.559  -9.559
  680    HA   VAL  85           HA       VAL  85  -7.942  -7.969  -7.969
  681    HB   VAL  85           HB       VAL  85  -9.766  -6.721  -6.721
  682   1HG1  VAL  85          2HG1      VAL  85  -9.676  -5.831  -5.831
  683   2HG1  VAL  85          1HG1      VAL  85  -7.982  -5.438  -5.438
  684   3HG1  VAL  85          3HG1      VAL  85  -9.248  -4.664  -4.664
  685   1HG2  VAL  85          3HG2      VAL  85  -6.767  -6.788  -6.788
  686   2HG2  VAL  85          2HG2      VAL  85  -7.779  -7.030  -7.030
  687   3HG2  VAL  85          1HG2      VAL  85  -7.584  -5.416  -5.416
  688    H    LYS  86           H        LYS  86  -9.184  -8.153  -8.153
  689    HA   LYS  86           HA       LYS  86 -12.100  -8.698  -8.698
  690   1HB   LYS  86          2HB       LYS  86 -11.722  -9.618  -9.618
  691   2HB   LYS  86          1HB       LYS  86 -11.524 -10.661 -10.661
  692   1HG   LYS  86          2HG       LYS  86  -9.068 -10.113 -10.113
  693   2HG   LYS  86          1HG       LYS  86  -9.333  -9.226  -9.226
  694   1HD   LYS  86          2HD       LYS  86  -8.842 -11.240 -11.240
  695   2HD   LYS  86          1HD       LYS  86 -10.541 -11.574 -11.574
  696   1HE   LYS  86          2HE       LYS  86 -10.060 -13.002 -13.002
  697   2HE   LYS  86          1HE       LYS  86  -8.633 -12.091 -12.091
  698   1HZ   LYS  86          3HZ       LYS  86  -8.820 -13.816 -13.816
  699   2HZ   LYS  86          2HZ       LYS  86  -8.055 -14.243 -14.243
  700   3HZ   LYS  86          1HZ       LYS  86  -7.443 -12.969 -12.969
  701    H    TRP  87           H        TRP  87 -13.418  -7.635  -7.635
  702    HA   TRP  87           HA       TRP  87 -12.329  -5.002  -5.002
  703   1HB   TRP  87          2HB       TRP  87 -14.974  -6.383  -6.383
  704   2HB   TRP  87          1HB       TRP  87 -14.617  -4.822  -4.822
  705    HD1  TRP  87           HD1      TRP  87 -15.823  -6.418  -6.418
  706    HE1  TRP  87           HE1      TRP  87 -16.092  -4.685  -4.685
  707    HE3  TRP  87           HE3      TRP  87 -13.347  -2.495  -2.495
  708    HZ2  TRP  87           HZ2      TRP  87 -15.350  -1.972  -1.972
  709    HZ3  TRP  87           HZ3      TRP  87 -13.119  -0.349  -0.349
  710    HH2  TRP  87           HH2      TRP  87 -14.116  -0.091  -0.091
  711    H    GLU  88           H        GLU  88 -12.800  -4.208  -4.208
  712    HA   GLU  88           HA       GLU  88 -12.137  -6.257  -6.257
  713   1HB   GLU  88          2HB       GLU  88 -10.119  -4.864  -4.864
  714   2HB   GLU  88          1HB       GLU  88 -10.855  -3.531  -3.531
  715   1HG   GLU  88          2HG       GLU  88  -9.381  -4.468  -4.468
  716   2HG   GLU  88          1HG       GLU  88 -10.950  -5.148  -5.148
  717    H    SER  89           H        SER  89 -13.025  -2.920  -2.920
  718    HA   SER  89           HA       SER  89 -15.005  -2.983  -2.983
  719   1HB   SER  89          2HB       SER  89 -14.422  -0.692  -0.692
  720   2HB   SER  89          1HB       SER  89 -12.945  -1.650  -1.650
  721    HG   SER  89           HG       SER  89 -13.063   0.483   0.483
  722    H    GLU  90           H        GLU  90 -15.854  -0.242  -0.242
  723    HA   GLU  90           HA       GLU  90 -17.514  -0.995  -0.995
  724   1HB   GLU  90          2HB       GLU  90 -17.326   1.759   1.759
  725   2HB   GLU  90          1HB       GLU  90 -18.685   1.062   1.062
  726   1HG   GLU  90          2HG       GLU  90 -18.386  -0.772  -0.772
  727   2HG   GLU  90          1HG       GLU  90 -17.879   0.699   0.699
  728    H    ASN  91           H        ASN  91 -14.540   0.775   0.775
  729    HA   ASN  91           HA       ASN  91 -14.474   1.222   1.222
  730   1HB   ASN  91          2HB       ASN  91 -13.646   3.409   3.409
  731   2HB   ASN  91          1HB       ASN  91 -13.874   3.513   3.513
  732   1HD2  ASN  91          2HD2      ASN  91 -16.938   4.488   4.488
  733   2HD2  ASN  91          1HD2      ASN  91 -15.305   4.523   4.523
  734    H    LYS  92           H        LYS  92 -13.015  -0.586  -0.586
  735    HA   LYS  92           HA       LYS  92 -10.281   0.268   0.268
  736   1HB   LYS  92          2HB       LYS  92 -10.616   0.820   0.820
  737   2HB   LYS  92          1HB       LYS  92 -11.042  -0.862  -0.862
  738   1HG   LYS  92          2HG       LYS  92  -8.712  -1.322  -1.322
  739   2HG   LYS  92          1HG       LYS  92  -8.380   0.327   0.327
  740   1HD   LYS  92          2HD       LYS  92  -9.123  -0.362  -0.362
  741   2HD   LYS  92          1HD       LYS  92  -9.153  -2.027  -2.027
  742   1HE   LYS  92          2HE       LYS  92  -6.688  -0.398  -0.398
  743   2HE   LYS  92          1HE       LYS  92  -6.972  -1.031  -1.031
  744   1HZ   LYS  92          3HZ       LYS  92  -7.127  -2.729  -2.729
  745   2HZ   LYS  92          2HZ       LYS  92  -5.681  -2.502  -2.502
  746   3HZ   LYS  92          1HZ       LYS  92  -7.020  -3.224  -3.224
  747    H    MET  93           H        MET  93  -9.687  -1.320  -1.320
  748    HA   MET  93           HA       MET  93 -10.437  -4.131  -4.131
  749   1HB   MET  93          2HB       MET  93 -10.399  -4.663  -4.663
  750   2HB   MET  93          1HB       MET  93 -11.582  -3.417  -3.417
  751   1HG   MET  93          2HG       MET  93  -9.244  -1.996  -1.996
  752   2HG   MET  93          1HG       MET  93  -9.208  -3.290  -3.290
  753   1HE   MET  93          2HE       MET  93 -11.084  -4.088  -4.088
  754   2HE   MET  93          1HE       MET  93 -12.673  -3.589  -3.589
  755   3HE   MET  93          3HE       MET  93 -12.089  -3.051  -3.051
  756    H    VAL  94           H        VAL  94  -8.890  -5.752  -5.752
  757    HA   VAL  94           HA       VAL  94  -6.080  -4.790  -4.790
  758    HB   VAL  94           HB       VAL  94  -6.962  -7.599  -7.599
  759   1HG1  VAL  94          1HG1      VAL  94  -4.600  -5.858  -5.858
  760   2HG1  VAL  94          3HG1      VAL  94  -4.974  -7.083  -7.083
  761   3HG1  VAL  94          2HG1      VAL  94  -4.662  -7.555  -7.555
  762   1HG2  VAL  94          3HG2      VAL  94  -7.218  -5.148  -5.148
  763   2HG2  VAL  94          2HG2      VAL  94  -8.361  -6.474  -6.474
  764   3HG2  VAL  94          1HG2      VAL  94  -6.890  -6.720  -6.720
  765    H    CYS  95           H        CYS  95  -4.527  -6.473  -6.473
  766    HA   CYS  95           HA       CYS  95  -5.792  -7.759  -7.759
  767   1HB   CYS  95          2HB       CYS  95  -5.259  -5.433  -5.433
  768   2HB   CYS  95          1HB       CYS  95  -3.578  -5.706  -5.706
  769    HG   CYS  95           HG       CYS  95  -4.737  -6.481  -6.481
  770    H    GLU  96           H        GLU  96  -4.713  -9.536  -9.536
  771    HA   GLU  96           HA       GLU  96  -2.099 -10.170 -10.170
  772   1HB   GLU  96          2HB       GLU  96  -4.009 -12.080 -12.080
  773   2HB   GLU  96          1HB       GLU  96  -2.621 -12.504 -12.504
  774   1HG   GLU  96          2HG       GLU  96  -4.609 -10.764 -10.764
  775   2HG   GLU  96          1HG       GLU  96  -5.196 -12.376 -12.376
  776    H    GLN  97           H        GLN  97  -0.544 -11.350 -11.350
  777    HA   GLN  97           HA       GLN  97  -1.092 -10.975 -10.975
  778   1HB   GLN  97          2HB       GLN  97  -0.270  -8.742  -8.742
  779   2HB   GLN  97          1HB       GLN  97   1.302  -9.484  -9.484
  780   1HG   GLN  97          2HG       GLN  97   0.409  -9.892  -9.892
  781   2HG   GLN  97          1HG       GLN  97  -0.768  -8.646  -8.646
  782   1HE2  GLN  97          2HE2      GLN  97   1.552  -6.000  -6.000
  783   2HE2  GLN  97          1HE2      GLN  97  -0.051  -6.464  -6.464
  784    H    LYS  98           H        LYS  98   0.079 -12.348 -12.348
  785    HA   LYS  98           HA       LYS  98   2.633 -13.446 -13.446
  786   1HB   LYS  98          2HB       LYS  98   1.880 -15.748 -15.748
  787   2HB   LYS  98          1HB       LYS  98   0.960 -15.084 -15.084
  788   1HG   LYS  98          2HG       LYS  98  -0.964 -14.887 -14.887
  789   2HG   LYS  98          1HG       LYS  98  -0.101 -14.496 -14.496
  790   1HD   LYS  98          2HD       LYS  98   0.720 -17.037 -17.037
  791   2HD   LYS  98          1HD       LYS  98  -0.833 -17.156 -17.156
  792   1HE   LYS  98          2HE       LYS  98  -1.901 -16.068 -16.068
  793   2HE   LYS  98          1HE       LYS  98  -0.348 -16.193 -16.193
  794   1HZ   LYS  98          2HZ       LYS  98  -1.685 -18.535 -18.535
  795   2HZ   LYS  98          1HZ       LYS  98  -1.982 -18.057 -18.057
  796   3HZ   LYS  98          3HZ       LYS  98  -0.419 -18.520 -18.520
  797    H    LEU  99           H        LEU  99   4.052 -14.103 -14.103
  798    HA   LEU  99           HA       LEU  99   3.794 -12.654 -12.654
  799   1HB   LEU  99          2HB       LEU  99   5.410 -15.116 -15.116
  800   2HB   LEU  99          1HB       LEU  99   5.572 -14.226 -14.226
  801    HG   LEU  99           HG       LEU  99   5.714 -12.637 -12.637
  802   1HD1  LEU  99          2HD1      LEU  99   7.106 -14.898 -14.898
  803   2HD1  LEU  99          1HD1      LEU  99   8.206 -14.009 -14.009
  804   3HD1  LEU  99          3HD1      LEU  99   7.812 -13.376 -13.376
  805   1HD2  LEU  99          3HD2      LEU  99   5.923 -11.817 -11.817
  806   2HD2  LEU  99          2HD2      LEU  99   7.186 -11.299 -11.299
  807   3HD2  LEU  99          1HD2      LEU  99   7.495 -12.618 -12.618
  808    H    LEU 100           H        LEU 100   3.765 -13.655 -13.655
  809    HA   LEU 100           HA       LEU 100   1.547 -15.600 -15.600
  810   1HB   LEU 100          2HB       LEU 100   2.846 -13.670 -13.670
  811   2HB   LEU 100          1HB       LEU 100   1.797 -14.965 -14.965
  812    HG   LEU 100           HG       LEU 100   0.997 -12.924 -12.924
  813   1HD1  LEU 100          3HD1      LEU 100   0.888 -12.919 -12.919
  814   2HD1  LEU 100          2HD1      LEU 100  -0.589 -12.420 -12.420
  815   3HD1  LEU 100          1HD1      LEU 100   0.922 -11.564 -11.564
  816   1HD2  LEU 100          1HD2      LEU 100  -0.287 -15.306 -15.306
  817   2HD2  LEU 100          3HD2      LEU 100  -0.444 -14.693 -14.693
  818   3HD2  LEU 100          2HD2      LEU 100  -1.309 -13.906 -13.906
  819    H    LYS 101           H        LYS 101   4.951 -15.535 -15.535
  820    HA   LYS 101           HA       LYS 101   5.058 -18.298 -18.298
  821   1HB   LYS 101          2HB       LYS 101   6.841 -17.794 -17.794
  822   2HB   LYS 101          1HB       LYS 101   5.281 -17.102 -17.102
  823   1HG   LYS 101          2HG       LYS 101   6.007 -14.956 -14.956
  824   2HG   LYS 101          1HG       LYS 101   7.002 -15.361 -15.361
  825   1HD   LYS 101          2HD       LYS 101   8.820 -16.003 -16.003
  826   2HD   LYS 101          1HD       LYS 101   7.815 -16.364 -16.364
  827   1HE   LYS 101          2HE       LYS 101   7.771 -13.543 -13.543
  828   2HE   LYS 101          1HE       LYS 101   9.297 -14.100 -14.100
  829   1HZ   LYS 101          3HZ       LYS 101   7.855 -15.038 -15.038
  830   2HZ   LYS 101          2HZ       LYS 101   6.629 -14.025 -14.025
  831   3HZ   LYS 101          1HZ       LYS 101   8.088 -13.358 -13.358
  832    H    GLY 102           H        GLY 102   7.119 -19.295 -19.295
  833   1HA   GLY 102          2HA       GLY 102   8.936 -19.634 -19.634
  834   2HA   GLY 102          1HA       GLY 102   9.300 -17.923 -17.923
  835    H    GLU 103           H        GLU 103   9.887 -17.968 -17.968
  836    HA   GLU 103           HA       GLU 103   7.819 -16.887 -16.887
  837   1HB   GLU 103          2HB       GLU 103   7.121 -19.305 -19.305
  838   2HB   GLU 103          1HB       GLU 103   8.659 -19.687 -19.687
  839   1HG   GLU 103          2HG       GLU 103   8.129 -18.401 -18.401
  840   2HG   GLU 103          1HG       GLU 103   6.767 -17.623 -17.623
  841    H    GLY 104           H        GLY 104   8.740 -15.834 -15.834
  842   1HA   GLY 104          2HA       GLY 104  11.287 -16.657 -16.657
  843   2HA   GLY 104          1HA       GLY 104  11.395 -15.181 -15.181
  844    HA   PRO 105           HA       PRO 105   9.812 -13.058 -13.058
  845   1HB   PRO 105          2HB       PRO 105   8.989 -10.730 -10.730
  846   2HB   PRO 105          1HB       PRO 105  10.693 -11.130 -11.130
  847   1HG   PRO 105          2HG       PRO 105   9.169 -11.100 -11.100
  848   2HG   PRO 105          1HG       PRO 105  10.916 -10.979 -10.979
  849   1HD   PRO 105          2HD       PRO 105   9.454 -13.306 -13.306
  850   2HD   PRO 105          1HD       PRO 105  11.181 -13.216 -13.216
  851    H    LYS 106           H        LYS 106   7.704 -11.582 -11.582
  852    HA   LYS 106           HA       LYS 106   5.326 -12.746 -12.746
  853   1HB   LYS 106          2HB       LYS 106   5.724 -14.019 -14.019
  854   2HB   LYS 106          1HB       LYS 106   5.765 -12.512 -12.512
  855   1HG   LYS 106          2HG       LYS 106   3.491 -12.155 -12.155
  856   2HG   LYS 106          1HG       LYS 106   3.382 -13.084 -13.084
  857   1HD   LYS 106          2HD       LYS 106   3.737 -15.173 -15.173
  858   2HD   LYS 106          1HD       LYS 106   3.856 -14.251 -14.251
  859   1HE   LYS 106          2HE       LYS 106   1.433 -14.444 -14.444
  860   2HE   LYS 106          1HE       LYS 106   1.597 -15.132 -15.132
  861   1HZ   LYS 106          2HZ       LYS 106   2.047 -12.758 -12.758
  862   2HZ   LYS 106          1HZ       LYS 106   1.426 -12.285 -12.285
  863   3HZ   LYS 106          3HZ       LYS 106   0.447 -13.144 -13.144
  864    H    THR 107           H        THR 107   3.730 -11.172 -11.172
  865    HA   THR 107           HA       THR 107   4.246  -8.512  -8.512
  866    HB   THR 107           HB       THR 107   2.829  -7.896  -7.896
  867    HG1  THR 107           HG1      THR 107   3.153 -10.157 -10.157
  868   1HG2  THR 107          2HG2      THR 107   5.056  -7.029  -7.029
  869   2HG2  THR 107          1HG2      THR 107   5.820  -8.142  -8.142
  870   3HG2  THR 107          3HG2      THR 107   4.793  -6.840  -6.840
  871    H    SER 108           H        SER 108   2.539  -7.338  -7.338
  872    HA   SER 108           HA       SER 108  -0.238  -8.093  -8.093
  873   1HB   SER 108          2HB       SER 108  -0.473  -8.300  -8.300
  874   2HB   SER 108          1HB       SER 108  -0.060  -9.715  -9.715
  875    HG   SER 108           HG       SER 108   1.373  -9.493  -9.493
  876    H    TRP 109           H        TRP 109  -1.487  -6.204  -6.204
  877    HA   TRP 109           HA       TRP 109  -0.243  -4.088  -4.088
  878   1HB   TRP 109          2HB       TRP 109  -0.828  -2.369  -2.369
  879   2HB   TRP 109          1HB       TRP 109   0.502  -3.438  -3.438
  880    HD1  TRP 109           HD1      TRP 109   0.188  -5.051  -5.051
  881    HE1  TRP 109           HE1      TRP 109  -1.648  -5.320  -5.320
  882    HE3  TRP 109           HE3      TRP 109  -3.497  -2.174  -2.174
  883    HZ2  TRP 109           HZ2      TRP 109  -4.320  -4.435  -4.435
  884    HZ3  TRP 109           HZ3      TRP 109  -5.669  -1.905  -1.905
  885    HH2  TRP 109           HH2      TRP 109  -6.090  -3.030  -3.030
  886    H    THR 110           H        THR 110  -1.857  -2.165  -2.165
  887    HA   THR 110           HA       THR 110  -4.662  -3.167  -3.167
  888    HB   THR 110           HB       THR 110  -5.027  -2.545  -2.545
  889    HG1  THR 110           HG1      THR 110  -3.856  -1.095  -1.095
  890   1HG2  THR 110          2HG2      THR 110  -3.263  -4.523  -4.523
  891   2HG2  THR 110          1HG2      THR 110  -2.267  -3.515  -3.515
  892   3HG2  THR 110          3HG2      THR 110  -3.802  -4.150  -4.150
  893    H    MET 111           H        MET 111  -6.174  -1.292  -1.292
  894    HA   MET 111           HA       MET 111  -5.186   1.405   1.405
  895   1HB   MET 111          2HB       MET 111  -6.834   1.687   1.687
  896   2HB   MET 111          1HB       MET 111  -5.556   0.536   0.536
  897   1HG   MET 111          2HG       MET 111  -6.975  -1.313  -1.313
  898   2HG   MET 111          1HG       MET 111  -8.130  -0.416  -0.416
  899   1HE   MET 111          1HE       MET 111  -6.175   0.442   0.442
  900   2HE   MET 111          3HE       MET 111  -6.825  -1.078  -1.078
  901   3HE   MET 111          2HE       MET 111  -7.328   0.458   0.458
  902    H    GLU 112           H        GLU 112  -6.456   2.911   2.911
  903    HA   GLU 112           HA       GLU 112  -9.074   1.965   1.965
  904   1HB   GLU 112          2HB       GLU 112  -7.237   1.874   1.874
  905   2HB   GLU 112          1HB       GLU 112  -7.049   3.617   3.617
  906   1HG   GLU 112          2HG       GLU 112  -9.063   4.089   4.089
  907   2HG   GLU 112          1HG       GLU 112  -9.800   2.572   2.572
  908    H    LEU 113           H        LEU 113 -10.631   3.624   3.624
  909    HA   LEU 113           HA       LEU 113  -9.950   6.192   6.192
  910   1HB   LEU 113          2HB       LEU 113 -11.903   4.342   4.342
  911   2HB   LEU 113          1HB       LEU 113 -12.798   5.466   5.466
  912    HG   LEU 113           HG       LEU 113 -12.873   5.977   5.977
  913   1HD1  LEU 113          3HD1      LEU 113 -12.286   7.788   7.788
  914   2HD1  LEU 113          2HD1      LEU 113 -11.689   8.435   8.435
  915   3HD1  LEU 113          1HD1      LEU 113 -13.386   7.991   7.991
  916   1HD2  LEU 113          2HD2      LEU 113 -10.397   5.316   5.316
  917   2HD2  LEU 113          1HD2      LEU 113 -10.971   6.728   6.728
  918   3HD2  LEU 113          3HD2      LEU 113 -10.033   6.935   6.935
  919    H    THR 114           H        THR 114 -10.546   8.120   8.120
  920    HA   THR 114           HA       THR 114 -11.104   7.688   7.688
  921    HB   THR 114           HB       THR 114 -10.381   9.937   9.937
  922    HG1  THR 114           HG1      THR 114 -10.455  11.427  11.427
  923   1HG2  THR 114          2HG2      THR 114  -8.665   8.160   8.160
  924   2HG2  THR 114          1HG2      THR 114  -8.629   9.074   9.074
  925   3HG2  THR 114          3HG2      THR 114  -8.162   9.850   9.850
  926    H    ASN 115           H        ASN 115 -12.732   9.074   9.074
  927    HA   ASN 115           HA       ASN 115 -15.295   8.869   8.869
  928   1HB   ASN 115          2HB       ASN 115 -14.458  10.712  10.712
  929   2HB   ASN 115          1HB       ASN 115 -16.101  10.182  10.182
  930   1HD2  ASN 115          2HD2      ASN 115 -13.707   7.808   7.808
  931   2HD2  ASN 115          1HD2      ASN 115 -13.264   9.386   9.386
  932    H    ASP 116           H        ASP 116 -12.859  11.340  11.340
  933    HA   ASP 116           HA       ASP 116 -14.747  13.381  13.381
  934   1HB   ASP 116          2HB       ASP 116 -11.722  13.281  13.281
  935   2HB   ASP 116          1HB       ASP 116 -12.617  14.662  14.662
  936    H    GLY 117           H        GLY 117 -12.604  10.941  10.941
  937   1HA   GLY 117          2HA       GLY 117 -13.403  10.193  10.193
  938   2HA   GLY 117          1HA       GLY 117 -13.290  11.893  11.893
  939    H    GLU 118           H        GLU 118 -10.762  11.691  11.691
  940    HA   GLU 118           HA       GLU 118  -8.757  11.758  11.758
  941   1HB   GLU 118          2HB       GLU 118  -8.528  11.006  11.006
  942   2HB   GLU 118          1HB       GLU 118  -7.160  11.381  11.381
  943   1HG   GLU 118          2HG       GLU 118  -8.136  13.624  13.624
  944   2HG   GLU 118          1HG       GLU 118  -9.452  13.249  13.249
  945    H    LEU 119           H        LEU 119  -6.869  10.071  10.071
  946    HA   LEU 119           HA       LEU 119  -7.871   7.297   7.297
  947   1HB   LEU 119          2HB       LEU 119  -8.513   8.074   8.074
  948   2HB   LEU 119          1HB       LEU 119  -6.811   8.336   8.336
  949    HG   LEU 119           HG       LEU 119  -7.851   5.647   5.647
  950   1HD1  LEU 119          3HD1      LEU 119  -7.945   6.957   6.957
  951   2HD1  LEU 119          2HD1      LEU 119  -7.683   5.217   5.217
  952   3HD1  LEU 119          1HD1      LEU 119  -9.148   5.933   5.933
  953   1HD2  LEU 119          1HD2      LEU 119  -5.344   6.757   6.757
  954   2HD2  LEU 119          3HD2      LEU 119  -5.526   5.529   5.529
  955   3HD2  LEU 119          2HD2      LEU 119  -5.819   5.116   5.116
  956    H    ILE 120           H        ILE 120  -6.307   6.422   6.422
  957    HA   ILE 120           HA       ILE 120  -3.461   7.110   7.110
  958    HB   ILE 120           HB       ILE 120  -4.082   7.499   7.499
  959   1HG1  ILE 120          2HG1      ILE 120  -2.497   4.922   4.922
  960   2HG1  ILE 120          1HG1      ILE 120  -1.825   6.448   6.448
  961   1HG2  ILE 120          1HG2      ILE 120  -5.299   4.804   4.804
  962   2HG2  ILE 120          3HG2      ILE 120  -4.561   5.146   5.146
  963   3HG2  ILE 120          2HG2      ILE 120  -5.852   6.180   6.180
  964   1HD1  ILE 120          2HD1      ILE 120  -2.579   7.411   7.411
  965   2HD1  ILE 120          1HD1      ILE 120  -2.718   5.727   5.727
  966   3HD1  ILE 120          3HD1      ILE 120  -1.159   6.365   6.365
  967    H    LEU 121           H        LEU 121  -1.933   5.265   5.265
  968    HA   LEU 121           HA       LEU 121  -3.248   2.653   2.653
  969   1HB   LEU 121          2HB       LEU 121  -2.969   3.853   3.853
  970   2HB   LEU 121          1HB       LEU 121  -1.243   4.008   4.008
  971    HG   LEU 121           HG       LEU 121  -1.955   1.247   1.247
  972   1HD1  LEU 121          3HD1      LEU 121  -3.231   2.631   2.631
  973   2HD1  LEU 121          2HD1      LEU 121  -2.504   1.050   1.050
  974   3HD1  LEU 121          1HD1      LEU 121  -3.780   1.227   1.227
  975   1HD2  LEU 121          3HD2      LEU 121   0.188   2.557   2.557
  976   2HD2  LEU 121          2HD2      LEU 121  -0.128   0.907   0.907
  977   3HD2  LEU 121          1HD2      LEU 121  -0.531   2.267   2.267
  978    H    THR 122           H        THR 122  -2.083   0.981   0.981
  979    HA   THR 122           HA       THR 122   0.706   1.581   1.581
  980    HB   THR 122           HB       THR 122  -0.263  -0.758  -0.758
  981    HG1  THR 122           HG1      THR 122  -2.049   0.244   0.244
  982   1HG2  THR 122          1HG2      THR 122   0.265   2.080   2.080
  983   2HG2  THR 122          3HG2      THR 122  -0.036   0.742   0.742
  984   3HG2  THR 122          2HG2      THR 122   1.380   0.715   0.715
  985    H    MET 123           H        MET 123   2.092  -0.464  -0.464
  986    HA   MET 123           HA       MET 123   1.244  -2.412  -2.412
  987   1HB   MET 123          2HB       MET 123   3.825  -0.825  -0.825
  988   2HB   MET 123          1HB       MET 123   3.322  -2.094  -2.094
  989   1HG   MET 123          2HG       MET 123   1.169  -0.596  -0.596
  990   2HG   MET 123          1HG       MET 123   2.235   0.682   0.682
  991   1HE   MET 123          2HE       MET 123   0.637  -0.640  -0.640
  992   2HE   MET 123          1HE       MET 123   1.598  -0.568  -0.568
  993   3HE   MET 123          3HE       MET 123   1.688  -1.988  -1.988
  994    H    THR 124           H        THR 124   2.768  -4.258  -4.258
  995    HA   THR 124           HA       THR 124   4.570  -4.549  -4.549
  996    HB   THR 124           HB       THR 124   2.553  -6.699  -6.699
  997    HG1  THR 124           HG1      THR 124   2.326  -4.706  -4.706
  998   1HG2  THR 124          1HG2      THR 124   4.643  -7.194  -7.194
  999   2HG2  THR 124          3HG2      THR 124   4.168  -5.981  -5.981
 1000   3HG2  THR 124          2HG2      THR 124   3.185  -7.428  -7.428
 1001    H    ALA 125           H        ALA 125   6.098  -6.211  -6.211
 1002    HA   ALA 125           HA       ALA 125   6.026  -7.878  -7.878
 1003   1HB   ALA 125          1HB       ALA 125   7.960  -5.578  -5.578
 1004   2HB   ALA 125          3HB       ALA 125   8.306  -6.962  -6.962
 1005   3HB   ALA 125          2HB       ALA 125   6.907  -5.942  -5.942
 1006    H    ASP 126           H        ASP 126   6.286  -9.648  -9.648
 1007    HA   ASP 126           HA       ASP 126   7.558 -11.309 -11.309
 1008   1HB   ASP 126          2HB       ASP 126   9.551  -9.663  -9.663
 1009   2HB   ASP 126          1HB       ASP 126  10.033  -9.900  -9.900
 1010    H    ASP 127           H        ASP 127   9.116  -8.454  -8.454
 1011    HA   ASP 127           HA       ASP 127   7.399  -8.706  -8.706
 1012   1HB   ASP 127          2HB       ASP 127  10.277  -9.482  -9.482
 1013   2HB   ASP 127          1HB       ASP 127   9.740  -8.562  -8.562
 1014    H    VAL 128           H        VAL 128   8.096  -6.752  -6.752
 1015    HA   VAL 128           HA       VAL 128   8.889  -4.471  -4.471
 1016    HB   VAL 128           HB       VAL 128   9.763  -3.359  -3.359
 1017   1HG1  VAL 128          3HG1      VAL 128  10.719  -6.209  -6.209
 1018   2HG1  VAL 128          2HG1      VAL 128  11.582  -5.017  -5.017
 1019   3HG1  VAL 128          1HG1      VAL 128  11.364  -4.753  -4.753
 1020   1HG2  VAL 128          2HG2      VAL 128   8.323  -5.576  -5.576
 1021   2HG2  VAL 128          1HG2      VAL 128   8.654  -3.943  -3.943
 1022   3HG2  VAL 128          3HG2      VAL 128   9.897  -5.188  -5.188
 1023    H    VAL 129           H        VAL 129   7.942  -2.364  -2.364
 1024    HA   VAL 129           HA       VAL 129   5.346  -2.862  -2.862
 1025    HB   VAL 129           HB       VAL 129   5.652  -2.145  -2.145
 1026   1HG1  VAL 129          3HG1      VAL 129   3.470  -1.005  -1.005
 1027   2HG1  VAL 129          2HG1      VAL 129   3.304  -1.160  -1.160
 1028   3HG1  VAL 129          1HG1      VAL 129   4.553  -0.116  -0.116
 1029   1HG2  VAL 129          1HG2      VAL 129   4.114  -3.985  -3.985
 1030   2HG2  VAL 129          3HG2      VAL 129   4.719  -4.208  -4.208
 1031   3HG2  VAL 129          2HG2      VAL 129   3.215  -3.330  -3.330
 1032    H    CYS 130           H        CYS 130   5.245  -1.359  -1.359
 1033    HA   CYS 130           HA       CYS 130   6.647   1.244   1.244
 1034   1HB   CYS 130          2HB       CYS 130   6.762  -0.381  -0.381
 1035   2HB   CYS 130          1HB       CYS 130   5.311   0.510   0.510
 1036    HG   CYS 130           HG       CYS 130   8.152   1.727   1.727
 1037    H    THR 131           H        THR 131   5.368   2.801   2.801
 1038    HA   THR 131           HA       THR 131   2.457   2.781   2.781
 1039    HB   THR 131           HB       THR 131   3.931   4.161   4.161
 1040    HG1  THR 131           HG1      THR 131   3.799   2.236   2.236
 1041   1HG2  THR 131          3HG2      THR 131   1.084   4.146   4.146
 1042   2HG2  THR 131          2HG2      THR 131   1.406   4.198   4.198
 1043   3HG2  THR 131          1HG2      THR 131   2.033   5.467   5.467
 1044    H    ARG 132           H        ARG 132   1.486   4.674   4.674
 1045    HA   ARG 132           HA       ARG 132   3.033   7.114   7.114
 1046   1HB   ARG 132          2HB       ARG 132   2.188   7.086   7.086
 1047   2HB   ARG 132          1HB       ARG 132   3.641   6.173   6.173
 1048   1HG   ARG 132          2HG       ARG 132   2.110   4.144   4.144
 1049   2HG   ARG 132          1HG       ARG 132   0.838   5.110   5.110
 1050   1HD   ARG 132          2HD       ARG 132   1.809   3.897   3.897
 1051   2HD   ARG 132          1HD       ARG 132   2.508   5.511   5.511
 1052    HE   ARG 132           HE       ARG 132   4.024   3.429   3.429
 1053   1HH1  ARG 132          1HH2      ARG 132   5.818   5.430   5.430
 1054   2HH1  ARG 132          2HH2      ARG 132   6.468   5.312   5.312
 1055   1HH2  ARG 132          2HH1      ARG 132   3.895   3.309   3.309
 1056   2HH2  ARG 132          1HH1      ARG 132   5.379   4.111   4.111
 1057    H    VAL 133           H        VAL 133   1.595   8.690   8.690
 1058    HA   VAL 133           HA       VAL 133  -1.281   8.072   8.072
 1059    HB   VAL 133           HB       VAL 133   0.174  10.630  10.630
 1060   1HG1  VAL 133          2HG1      VAL 133  -2.335  10.724  10.724
 1061   2HG1  VAL 133          1HG1      VAL 133  -2.528   9.654   9.654
 1062   3HG1  VAL 133          3HG1      VAL 133  -1.827  11.258  11.258
 1063   1HG2  VAL 133          1HG2      VAL 133  -0.513   8.159   8.159
 1064   2HG2  VAL 133          3HG2      VAL 133   1.047   8.970   8.970
 1065   3HG2  VAL 133          2HG2      VAL 133  -0.257   9.715   9.715
 1066    H    TYR 134           H        TYR 134  -2.831   8.923   8.923
 1067    HA   TYR 134           HA       TYR 134  -1.792  10.760  10.760
 1068   1HB   TYR 134          2HB       TYR 134  -3.439   8.268   8.268
 1069   2HB   TYR 134          1HB       TYR 134  -3.668   9.573   9.573
 1070    HD1  TYR 134           HD2      TYR 134  -1.877  10.260  10.260
 1071    HD2  TYR 134           HD1      TYR 134  -1.330   7.035   7.035
 1072    HE1  TYR 134           HE2      TYR 134   0.142   9.522   9.522
 1073    HE2  TYR 134           HE1      TYR 134   0.673   6.297   6.297
 1074    HH   TYR 134           HH       TYR 134   1.499   6.568   6.568
 1075    H    VAL 135           H        VAL 135  -2.961  12.548  12.548
 1076    HA   VAL 135           HA       VAL 135  -5.680  12.639  12.639
 1077    HB   VAL 135           HB       VAL 135  -3.451  14.312  14.312
 1078   1HG1  VAL 135          2HG1      VAL 135  -5.553  15.804  15.804
 1079   2HG1  VAL 135          1HG1      VAL 135  -4.257  16.560  16.560
 1080   3HG1  VAL 135          3HG1      VAL 135  -3.872  15.559  15.559
 1081   1HG2  VAL 135          2HG2      VAL 135  -6.396  14.723  14.723
 1082   2HG2  VAL 135          1HG2      VAL 135  -5.250  13.839  13.839
 1083   3HG2  VAL 135          3HG2      VAL 135  -5.087  15.584  15.584
 1084    H    ARG 136           H        ARG 136  -7.385  13.301  13.301
 1085    HA   ARG 136           HA       ARG 136  -7.191  12.825  12.825
 1086   1HB   ARG 136          2HB       ARG 136  -9.165  13.926  13.926
 1087   2HB   ARG 136          1HB       ARG 136  -9.146  14.843  14.843
 1088   1HG   ARG 136          2HG       ARG 136  -9.712  13.020  13.020
 1089   2HG   ARG 136          1HG       ARG 136  -9.043  11.861  11.861
 1090   1HD   ARG 136          2HD       ARG 136 -11.633  13.415  13.415
 1091   2HD   ARG 136          1HD       ARG 136 -11.448  11.668  11.668
 1092    HE   ARG 136           HE       ARG 136 -10.018  12.311  12.311
 1093   1HH1  ARG 136          1HH2      ARG 136 -12.836  10.918  10.918
 1094   2HH1  ARG 136          2HH2      ARG 136 -13.742  11.734  11.734
 1095   1HH2  ARG 136          2HH1      ARG 136 -11.347  14.194  14.194
 1096   2HH2  ARG 136          1HH1      ARG 136 -12.899  13.594  13.594
 1097    H    GLU 137           HN       GLU 137  -6.299  13.802  13.802
 1098    HA   GLU 137           HA       GLU 137  -4.995  15.339  15.339
 1099   1HB   GLU 137          2HB       GLU 137  -7.491  15.996  15.996
 1100   2HB   GLU 137          1HB       GLU 137  -7.019  17.346  17.346
 1101   1HG   GLU 137          2HG       GLU 137  -5.179  17.830  17.830
 1102   2HG   GLU 137          1HG       GLU 137  -5.984  16.673  16.673

  Start of MODEL   17
    1   1H    PRO   1          1H        PRO   1 -18.119   7.096   7.096
    2   2H    PRO   1          2H        PRO   1 -17.537   6.873   6.873
    3    HA   PRO   1           HA       PRO   1 -16.780   4.860   4.860
    4   1HB   PRO   1          2HB       PRO   1 -19.038   3.590   3.590
    5   2HB   PRO   1          1HB       PRO   1 -18.435   3.381   3.381
    6   1HG   PRO   1          2HG       PRO   1 -20.801   4.753   4.753
    7   2HG   PRO   1          1HG       PRO   1 -20.191   4.544   4.544
    8   1HD   PRO   1          1HD       PRO   1 -20.204   6.932   6.932
    9   2HD   PRO   1          2HD       PRO   1 -19.601   6.718   6.718
   10    H    ASN   2           H        ASN   2 -15.400   5.680   5.680
   11    HA   ASN   2           HA       ASN   2 -15.651   4.374   4.374
   12   1HB   ASN   2          2HB       ASN   2 -15.819   6.713   6.713
   13   2HB   ASN   2          1HB       ASN   2 -17.229   5.730   5.730
   14   1HD2  ASN   2          2HD2      ASN   2 -18.573   8.699   8.699
   15   2HD2  ASN   2          1HD2      ASN   2 -18.671   7.591   7.591
   16    H    PHE   3           H        PHE   3 -13.811   4.455   4.455
   17    HA   PHE   3           HA       PHE   3 -11.592   6.088   6.088
   18   1HB   PHE   3          2HB       PHE   3 -11.615   3.583   3.583
   19   2HB   PHE   3          1HB       PHE   3 -10.164   4.428   4.428
   20    HD1  PHE   3           HD1      PHE   3 -13.312   3.219   3.219
   21    HD2  PHE   3           HD2      PHE   3  -9.016   3.391   3.391
   22    HE1  PHE   3           HE1      PHE   3 -13.269   1.922   1.922
   23    HE2  PHE   3           HE2      PHE   3  -8.986   2.082   2.082
   24    HZ   PHE   3           HZ       PHE   3 -11.112   1.338   1.338
   25    H    SER   4           H        SER   4 -13.779   6.069   6.069
   26    HA   SER   4           HA       SER   4 -12.092   6.645   6.645
   27   1HB   SER   4          2HB       SER   4 -14.157   7.453   7.453
   28   2HB   SER   4          1HB       SER   4 -14.422   5.921   5.921
   29    HG   SER   4           HG       SER   4 -15.540   8.348   8.348
   30    H    GLY   5           H        GLY   5 -10.862   8.367   8.367
   31   1HA   GLY   5          2HA       GLY   5 -11.590  11.003  11.003
   32   2HA   GLY   5          1HA       GLY   5 -11.184  10.837  10.837
   33    H    ASN   6           H        ASN   6  -9.462  12.459  12.459
   34    HA   ASN   6           HA       ASN   6  -7.153  11.009  11.009
   35   1HB   ASN   6          2HB       ASN   6  -7.867  13.919  13.919
   36   2HB   ASN   6          1HB       ASN   6  -6.176  13.457  13.457
   37   1HD2  ASN   6          2HD2      ASN   6  -6.939  12.051  12.051
   38   2HD2  ASN   6          1HD2      ASN   6  -6.237  11.483  11.483
   39    H    TRP   7           H        TRP   7  -4.990  11.599  11.599
   40    HA   TRP   7           HA       TRP   7  -5.457  11.942  11.942
   41   1HB   TRP   7          2HB       TRP   7  -4.345   9.421   9.421
   42   2HB   TRP   7          1HB       TRP   7  -4.276   9.786   9.786
   43    HD1  TRP   7           HD1      TRP   7  -6.553   8.492   8.492
   44    HE1  TRP   7           HE1      TRP   7  -8.917   8.074   8.074
   45    HE3  TRP   7           HE3      TRP   7  -6.015  10.782  10.782
   46    HZ2  TRP   7           HZ2      TRP   7 -10.375   8.677   8.677
   47    HZ3  TRP   7           HZ3      TRP   7  -7.897  10.893  10.893
   48    HH2  TRP   7           HH2      TRP   7 -10.058   9.841   9.841
   49    H    LYS   8           H        LYS   8  -3.930  13.201  13.201
   50    HA   LYS   8           HA       LYS   8  -1.210  13.118  13.118
   51   1HB   LYS   8          2HB       LYS   8  -2.757  15.389  15.389
   52   2HB   LYS   8          1HB       LYS   8  -1.008  15.452  15.452
   53   1HG   LYS   8          2HG       LYS   8  -1.615  14.745  14.745
   54   2HG   LYS   8          1HG       LYS   8  -3.170  15.470  15.470
   55   1HD   LYS   8          2HD       LYS   8  -0.614  16.941  16.941
   56   2HD   LYS   8          1HD       LYS   8  -1.309  16.992  16.992
   57   1HE   LYS   8          2HE       LYS   8  -3.300  18.020  18.020
   58   2HE   LYS   8          1HE       LYS   8  -2.981  17.589  17.589
   59   1HZ   LYS   8          1HZ       LYS   8  -1.117  19.331  19.331
   60   2HZ   LYS   8          3HZ       LYS   8  -2.520  19.979  19.979
   61   3HZ   LYS   8          2HZ       LYS   8  -1.365  19.205  19.205
   62    H    ILE   9           H        ILE   9   0.084  12.003  12.003
   63    HA   ILE   9           HA       ILE   9  -0.455  11.146  11.146
   64    HB   ILE   9           HB       ILE   9   1.235  10.138  10.138
   65   1HG1  ILE   9          2HG1      ILE   9   2.508  11.346  11.346
   66   2HG1  ILE   9          1HG1      ILE   9   1.505   9.897   9.897
   67   1HG2  ILE   9          1HG2      ILE   9   2.258  12.906  12.906
   68   2HG2  ILE   9          3HG2      ILE   9   3.509  11.675  11.675
   69   3HG2  ILE   9          2HG2      ILE   9   2.408  11.629  11.629
   70   1HD1  ILE   9          1HD1      ILE   9   3.413   9.389   9.389
   71   2HD1  ILE   9          3HD1      ILE   9   4.330  10.211  10.211
   72   3HD1  ILE   9          2HD1      ILE   9   3.427   8.745   8.745
   73    H    ILE  10           H        ILE  10   0.498  11.725  11.725
   74    HA   ILE  10           HA       ILE  10   1.373  14.565  14.565
   75    HB   ILE  10           HB       ILE  10   0.035  14.755  14.755
   76   1HG1  ILE  10          2HG1      ILE  10  -1.871  12.764  12.764
   77   2HG1  ILE  10          1HG1      ILE  10  -0.397  11.890  11.890
   78   1HG2  ILE  10          3HG2      ILE  10  -1.210  14.185  14.185
   79   2HG2  ILE  10          2HG2      ILE  10  -2.275  14.434  14.434
   80   3HG2  ILE  10          1HG2      ILE  10  -1.141  15.698  15.698
   81   1HD1  ILE  10          3HD1      ILE  10   0.516  13.315  13.315
   82   2HD1  ILE  10          2HD1      ILE  10  -1.182  13.185  13.185
   83   3HD1  ILE  10          1HD1      ILE  10  -0.229  11.727  11.727
   84    H    ARG  11           H        ARG  11   1.478  11.254  11.254
   85    HA   ARG  11           HA       ARG  11   4.091  11.882  11.882
   86   1HB   ARG  11          2HB       ARG  11   1.852  11.875  11.875
   87   2HB   ARG  11          1HB       ARG  11   2.392  10.203  10.203
   88   1HG   ARG  11          2HG       ARG  11   3.489  11.486  11.486
   89   2HG   ARG  11          1HG       ARG  11   4.698  11.062  11.062
   90   1HD   ARG  11          2HD       ARG  11   4.854  13.231  13.231
   91   2HD   ARG  11          1HD       ARG  11   3.214  13.645  13.645
   92    HE   ARG  11           HE       ARG  11   4.226  13.498  13.498
   93   1HH1  ARG  11          2HH1      ARG  11   6.727  13.483  13.483
   94   2HH1  ARG  11          1HH1      ARG  11   7.505  14.895  14.895
   95   1HH2  ARG  11          1HH2      ARG  11   4.869  15.740  15.740
   96   2HH2  ARG  11          2HH2      ARG  11   6.454  16.173  16.173
   97    H    SER  12           H        SER  12   5.128   9.720   9.720
   98    HA   SER  12           HA       SER  12   4.130   7.213   7.213
   99   1HB   SER  12          2HB       SER  12   5.551   6.908   6.908
  100   2HB   SER  12          1HB       SER  12   4.492   8.295   8.295
  101    HG   SER  12           HG       SER  12   6.499   8.987   8.987
  102    H    GLU  13           H        GLU  13   5.782   5.510   5.510
  103    HA   GLU  13           HA       GLU  13   8.385   6.208   6.208
  104   1HB   GLU  13          2HB       GLU  13   7.910   4.855   4.855
  105   2HB   GLU  13          1HB       GLU  13   7.065   6.399   6.399
  106   1HG   GLU  13          2HG       GLU  13   5.627   4.105   4.105
  107   2HG   GLU  13          1HG       GLU  13   5.827   4.036   4.036
  108    H    ASN  14           H        ASN  14   9.636   4.153   4.153
  109    HA   ASN  14           HA       ASN  14  10.458   2.059   2.059
  110   1HB   ASN  14          2HB       ASN  14   7.613   1.362   1.362
  111   2HB   ASN  14          1HB       ASN  14   8.910   0.272   0.272
  112   1HD2  ASN  14          2HD2      ASN  14   6.557   1.671   1.671
  113   2HD2  ASN  14          1HD2      ASN  14   6.164   1.694   1.694
  114    H    PHE  15           H        PHE  15  10.095   4.288   4.288
  115    HA   PHE  15           HA       PHE  15   9.188   3.234   3.234
  116   1HB   PHE  15          2HB       PHE  15   9.725   5.697   5.697
  117   2HB   PHE  15          1HB       PHE  15  11.407   5.272   5.272
  118    HD1  PHE  15           HD2      PHE  15  11.763   3.874   3.874
  119    HD2  PHE  15           HD1      PHE  15   8.440   6.465   6.465
  120    HE1  PHE  15           HE2      PHE  15  11.294   4.048   4.048
  121    HE2  PHE  15           HE1      PHE  15   7.984   6.632   6.632
  122    HZ   PHE  15           HZ       PHE  15   9.403   5.411   5.411
  123    H    GLU  16           H        GLU  16  12.555   3.828   3.828
  124    HA   GLU  16           HA       GLU  16  13.746   2.250   2.250
  125   1HB   GLU  16          2HB       GLU  16  14.908   3.937   3.937
  126   2HB   GLU  16          1HB       GLU  16  14.887   2.714   2.714
  127   1HG   GLU  16          2HG       GLU  16  16.114   1.160   1.160
  128   2HG   GLU  16          1HG       GLU  16  16.184   2.428   2.428
  129    H    GLU  17           H        GLU  17  12.301   1.359   1.359
  130    HA   GLU  17           HA       GLU  17  13.526  -1.193  -1.193
  131   1HB   GLU  17          2HB       GLU  17  10.767  -0.258  -0.258
  132   2HB   GLU  17          1HB       GLU  17  11.628  -1.644  -1.644
  133   1HG   GLU  17          2HG       GLU  17  13.532   0.067   0.067
  134   2HG   GLU  17          1HG       GLU  17  12.262   1.276   1.276
  135    H    LEU  18           H        LEU  18  10.611  -0.167  -0.167
  136    HA   LEU  18           HA       LEU  18   9.967  -2.867  -2.867
  137   1HB   LEU  18          2HB       LEU  18   8.211  -1.142  -1.142
  138   2HB   LEU  18          1HB       LEU  18   8.849  -0.197  -0.197
  139    HG   LEU  18           HG       LEU  18   8.416  -2.151  -2.151
  140   1HD1  LEU  18          3HD1      LEU  18   7.566  -3.302  -3.302
  141   2HD1  LEU  18          2HD1      LEU  18   6.595  -3.716  -3.716
  142   3HD1  LEU  18          1HD1      LEU  18   8.317  -4.093  -4.093
  143   1HD2  LEU  18          1HD2      LEU  18   6.725  -0.216  -0.216
  144   2HD2  LEU  18          3HD2      LEU  18   6.214  -1.535  -1.535
  145   3HD2  LEU  18          2HD2      LEU  18   5.819  -1.575  -1.575
  146    H    LEU  19           H        LEU  19  12.098  -0.404  -0.404
  147    HA   LEU  19           HA       LEU  19  12.005  -1.249  -1.249
  148   1HB   LEU  19          2HB       LEU  19  13.576   0.842   0.842
  149   2HB   LEU  19          1HB       LEU  19  13.909   0.473   0.473
  150    HG   LEU  19           HG       LEU  19  12.145   2.389   2.389
  151   1HD1  LEU  19          1HD1      LEU  19  12.361   0.826   0.826
  152   2HD1  LEU  19          3HD1      LEU  19  11.212   2.154   2.154
  153   3HD1  LEU  19          2HD1      LEU  19  12.938   2.452   2.452
  154   1HD2  LEU  19          2HD2      LEU  19  10.456  -0.013  -0.013
  155   2HD2  LEU  19          1HD2      LEU  19  10.453   0.771   0.771
  156   3HD2  LEU  19          3HD2      LEU  19   9.863   1.638   1.638
  157    H    LYS  20           H        LYS  20  13.741  -1.915  -1.915
  158    HA   LYS  20           HA       LYS  20  16.074  -3.075  -3.075
  159   1HB   LYS  20          2HB       LYS  20  15.309  -3.458  -3.458
  160   2HB   LYS  20          1HB       LYS  20  16.908  -3.616  -3.616
  161   1HG   LYS  20          2HG       LYS  20  15.896  -0.984  -0.984
  162   2HG   LYS  20          1HG       LYS  20  15.723  -1.297  -1.297
  163   1HD   LYS  20          2HD       LYS  20  18.283  -1.694  -1.694
  164   2HD   LYS  20          1HD       LYS  20  17.927  -0.291  -0.291
  165   1HE   LYS  20          2HE       LYS  20  17.410  -2.241  -2.241
  166   2HE   LYS  20          1HE       LYS  20  18.611  -3.076  -3.076
  167   1HZ   LYS  20          2HZ       LYS  20  20.050  -1.094  -1.094
  168   2HZ   LYS  20          1HZ       LYS  20  18.923  -0.463  -0.463
  169   3HZ   LYS  20          3HZ       LYS  20  19.737  -1.908  -1.908
  170    H    VAL  21           H        VAL  21  13.011  -4.053  -4.053
  171    HA   VAL  21           HA       VAL  21  13.566  -6.911  -6.911
  172    HB   VAL  21           HB       VAL  21  11.898  -5.855  -5.855
  173   1HG1  VAL  21          3HG1      VAL  21  11.060  -4.222  -4.222
  174   2HG1  VAL  21          2HG1      VAL  21  10.133  -5.548  -5.548
  175   3HG1  VAL  21          1HG1      VAL  21   9.817  -5.011  -5.011
  176   1HG2  VAL  21          1HG2      VAL  21  11.781  -8.259  -8.259
  177   2HG2  VAL  21          3HG2      VAL  21  10.198  -7.583  -7.583
  178   3HG2  VAL  21          2HG2      VAL  21  10.681  -7.801  -7.801
  179    H    LEU  22           H        LEU  22  11.902  -4.532  -4.532
  180    HA   LEU  22           HA       LEU  22  10.887  -6.286  -6.286
  181   1HB   LEU  22          2HB       LEU  22  11.265  -3.387  -3.387
  182   2HB   LEU  22          1HB       LEU  22  11.279  -3.849  -3.849
  183    HG   LEU  22           HG       LEU  22   9.079  -4.833  -4.833
  184   1HD1  LEU  22          1HD1      LEU  22   9.414  -5.730  -5.730
  185   2HD1  LEU  22          3HD1      LEU  22   9.128  -4.102  -4.102
  186   3HD1  LEU  22          2HD1      LEU  22   7.853  -4.956  -4.956
  187   1HD2  LEU  22          2HD2      LEU  22   9.555  -2.090  -2.090
  188   2HD2  LEU  22          1HD2      LEU  22   8.760  -2.574  -2.574
  189   3HD2  LEU  22          3HD2      LEU  22   7.909  -2.721  -2.721
  190    H    GLY  23           H        GLY  23  13.653  -4.110  -4.110
  191   1HA   GLY  23          2HA       GLY  23  14.872  -5.490  -5.490
  192   2HA   GLY  23          1HA       GLY  23  15.307  -3.879  -3.879
  193    H    VAL  24           H        VAL  24  17.511  -4.385  -4.385
  194    HA   VAL  24           HA       VAL  24  18.279  -5.805  -5.805
  195    HB   VAL  24           HB       VAL  24  19.511  -6.550  -6.550
  196   1HG1  VAL  24          2HG1      VAL  24  20.739  -6.674  -6.674
  197   2HG1  VAL  24          1HG1      VAL  24  19.756  -8.126  -8.126
  198   3HG1  VAL  24          3HG1      VAL  24  20.886  -7.995  -7.995
  199   1HG2  VAL  24          3HG2      VAL  24  17.465  -7.981  -7.981
  200   2HG2  VAL  24          2HG2      VAL  24  17.262  -7.440  -7.440
  201   3HG2  VAL  24          1HG2      VAL  24  18.369  -8.762  -8.762
  202    H    ASN  25           H        ASN  25  19.343  -3.930  -3.930
  203    HA   ASN  25           HA       ASN  25  21.918  -3.195  -3.195
  204   1HB   ASN  25          2HB       ASN  25  20.469  -2.690  -2.690
  205   2HB   ASN  25          1HB       ASN  25  20.333  -1.136  -1.136
  206   1HD2  ASN  25          2HD2      ASN  25  23.645  -0.204  -0.204
  207   2HD2  ASN  25          1HD2      ASN  25  22.135   0.260   0.260
  208    H    VAL  26           H        VAL  26  22.087  -0.487  -0.487
  209    HA   VAL  26           HA       VAL  26  20.441   0.122   0.122
  210    HB   VAL  26           HB       VAL  26  22.444   1.466   1.466
  211   1HG1  VAL  26          3HG1      VAL  26  22.552  -1.534  -1.534
  212   2HG1  VAL  26          2HG1      VAL  26  23.765  -0.654  -0.654
  213   3HG1  VAL  26          1HG1      VAL  26  22.073  -0.602  -0.602
  214   1HG2  VAL  26          1HG2      VAL  26  23.767  -0.082  -0.082
  215   2HG2  VAL  26          3HG2      VAL  26  23.631   1.671   1.671
  216   3HG2  VAL  26          2HG2      VAL  26  24.638   0.778   0.778
  217    H    MET  27           H        MET  27  22.233   1.539   1.539
  218    HA   MET  27           HA       MET  27  21.214   4.214   4.214
  219   1HB   MET  27          2HB       MET  27  23.232   3.378   3.378
  220   2HB   MET  27          1HB       MET  27  22.007   3.155   3.155
  221   1HG   MET  27          2HG       MET  27  21.597   5.417   5.417
  222   2HG   MET  27          1HG       MET  27  22.008   5.747   5.747
  223   1HE   MET  27          1HE       MET  27  23.808   6.035   6.035
  224   2HE   MET  27          3HE       MET  27  25.270   5.137   5.137
  225   3HE   MET  27          2HE       MET  27  25.191   6.878   6.878
  226    H    LEU  28           H        LEU  28  20.022   1.348   1.348
  227    HA   LEU  28           HA       LEU  28  18.065   2.423   2.423
  228   1HB   LEU  28          2HB       LEU  28  18.646  -0.134  -0.134
  229   2HB   LEU  28          1HB       LEU  28  16.942   0.100   0.100
  230    HG   LEU  28           HG       LEU  28  18.084  -1.017  -1.017
  231   1HD1  LEU  28          2HD1      LEU  28  16.275   0.891   0.891
  232   2HD1  LEU  28          1HD1      LEU  28  17.617   1.770   1.770
  233   3HD1  LEU  28          3HD1      LEU  28  17.089   0.233   0.233
  234   1HD2  LEU  28          2HD2      LEU  28  20.313   0.150   0.150
  235   2HD2  LEU  28          1HD2      LEU  28  19.935  -0.070  -0.070
  236   3HD2  LEU  28          3HD2      LEU  28  19.702   1.505   1.505
  237    H    ARG  29           H        ARG  29  17.702   1.399   1.399
  238    HA   ARG  29           HA       ARG  29  14.954   2.145   2.145
  239   1HB   ARG  29          2HB       ARG  29  16.909   2.247   2.247
  240   2HB   ARG  29          1HB       ARG  29  15.199   1.843   1.843
  241   1HG   ARG  29          2HG       ARG  29  15.739  -0.338  -0.338
  242   2HG   ARG  29          1HG       ARG  29  16.404  -0.008  -0.008
  243   1HD   ARG  29          2HD       ARG  29  18.032  -1.079  -1.079
  244   2HD   ARG  29          1HD       ARG  29  18.582   0.443   0.443
  245    HE   ARG  29           HE       ARG  29  17.238   0.539   0.539
  246   1HH1  ARG  29          2HH1      ARG  29  18.590   2.949   2.949
  247   2HH1  ARG  29          1HH1      ARG  29  20.161   2.833   2.833
  248   1HH2  ARG  29          1HH2      ARG  29  19.904  -0.560  -0.560
  249   2HH2  ARG  29          2HH2      ARG  29  20.904   0.847   0.847
  250    H    LYS  30           H        LYS  30  17.934   3.927   3.927
  251    HA   LYS  30           HA       LYS  30  16.691   6.206   6.206
  252   1HB   LYS  30          2HB       LYS  30  19.260   5.448   5.448
  253   2HB   LYS  30          1HB       LYS  30  19.148   6.656   6.656
  254   1HG   LYS  30          2HG       LYS  30  17.935   8.039   8.039
  255   2HG   LYS  30          1HG       LYS  30  18.948   7.002   7.002
  256   1HD   LYS  30          2HD       LYS  30  20.950   7.738   7.738
  257   2HD   LYS  30          1HD       LYS  30  19.995   8.641   8.641
  258   1HE   LYS  30          2HE       LYS  30  19.636   9.254   9.254
  259   2HE   LYS  30          1HE       LYS  30  21.067   9.874   9.874
  260   1HZ   LYS  30          1HZ       LYS  30  18.424  10.202  10.202
  261   2HZ   LYS  30          3HZ       LYS  30  18.885  11.246  11.246
  262   3HZ   LYS  30          2HZ       LYS  30  19.818  11.160  11.160
  263    H    ILE  31           H        ILE  31  17.020   5.289   5.289
  264    HA   ILE  31           HA       ILE  31  16.436   7.982   7.982
  265    HB   ILE  31           HB       ILE  31  16.354   5.296   5.296
  266   1HG1  ILE  31          2HG1      ILE  31  18.540   7.322   7.322
  267   2HG1  ILE  31          1HG1      ILE  31  18.559   6.287   6.287
  268   1HG2  ILE  31          1HG2      ILE  31  15.294   7.697   7.697
  269   2HG2  ILE  31          3HG2      ILE  31  16.925   7.762   7.762
  270   3HG2  ILE  31          2HG2      ILE  31  15.861   6.416   6.416
  271   1HD1  ILE  31          3HD1      ILE  31  18.100   4.385   4.385
  272   2HD1  ILE  31          2HD1      ILE  31  18.869   5.548   5.548
  273   3HD1  ILE  31          1HD1      ILE  31  19.739   4.945   4.945
  274    H    ALA  32           H        ALA  32  14.650   5.119   5.119
  275    HA   ALA  32           HA       ALA  32  12.156   6.013   6.013
  276   1HB   ALA  32          1HB       ALA  32  13.182   3.582   3.582
  277   2HB   ALA  32          3HB       ALA  32  11.650   3.984   3.984
  278   3HB   ALA  32          2HB       ALA  32  11.733   3.812   3.812
  279    H    VAL  33           H        VAL  33  13.767   6.379   6.379
  280    HA   VAL  33           HA       VAL  33  11.340   7.137   7.137
  281    HB   VAL  33           HB       VAL  33  14.172   7.750   7.750
  282   1HG1  VAL  33          3HG1      VAL  33  11.795   8.292   8.292
  283   2HG1  VAL  33          2HG1      VAL  33  12.069   6.676   6.676
  284   3HG1  VAL  33          1HG1      VAL  33  13.253   7.953   7.953
  285   1HG2  VAL  33          3HG2      VAL  33  13.112   5.110   5.110
  286   2HG2  VAL  33          2HG2      VAL  33  14.721   5.558   5.558
  287   3HG2  VAL  33          1HG2      VAL  33  13.433   5.265   5.265
  288    H    ALA  34           H        ALA  34  14.244   8.692   8.692
  289    HA   ALA  34           HA       ALA  34  13.538  11.386  11.386
  290   1HB   ALA  34          2HB       ALA  34  15.778  10.296  10.296
  291   2HB   ALA  34          1HB       ALA  34  15.067  10.760  10.760
  292   3HB   ALA  34          3HB       ALA  34  15.389  11.987  11.987
  293    H    ALA  35           H        ALA  35  13.019   9.369   9.369
  294    HA   ALA  35           HA       ALA  35  11.651  11.284  11.284
  295   1HB   ALA  35          2HB       ALA  35  11.575   8.258   8.258
  296   2HB   ALA  35          1HB       ALA  35  10.583   9.139   9.139
  297   3HB   ALA  35          3HB       ALA  35  12.342   9.252   9.252
  298    H    ALA  36           H        ALA  36  10.493   8.831   8.831
  299    HA   ALA  36           HA       ALA  36   7.725   9.753   9.753
  300   1HB   ALA  36          1HB       ALA  36   9.132   7.665   7.665
  301   2HB   ALA  36          3HB       ALA  36   7.399   7.976   7.976
  302   3HB   ALA  36          2HB       ALA  36   8.124   7.384   7.384
  303    H    SER  37           H        SER  37   9.587  11.808  11.808
  304    HA   SER  37           HA       SER  37   9.527  11.952  11.952
  305   1HB   SER  37          2HB       SER  37   9.757  14.478  14.478
  306   2HB   SER  37          1HB       SER  37  11.030  13.438  13.438
  307    HG   SER  37           HG       SER  37   9.039  14.861  14.861
  308    H    LYS  38           H        LYS  38   7.276  12.819  12.819
  309    HA   LYS  38           HA       LYS  38   5.032  12.841  12.841
  310   1HB   LYS  38          2HB       LYS  38   6.188  15.403  15.403
  311   2HB   LYS  38          1HB       LYS  38   4.433  15.258  15.258
  312   1HG   LYS  38          2HG       LYS  38   5.101  14.297  14.297
  313   2HG   LYS  38          1HG       LYS  38   6.467  15.381  15.381
  314   1HD   LYS  38          2HD       LYS  38   4.714  17.147  17.147
  315   2HD   LYS  38          1HD       LYS  38   3.527  16.066  16.066
  316   1HE   LYS  38          2HE       LYS  38   4.047  17.261  17.261
  317   2HE   LYS  38          1HE       LYS  38   5.371  16.099  16.099
  318   1HZ   LYS  38          2HZ       LYS  38   6.618  17.760  17.760
  319   2HZ   LYS  38          1HZ       LYS  38   5.423  18.878  18.878
  320   3HZ   LYS  38          3HZ       LYS  38   6.404  18.156  18.156
  321    HA   PRO  39           HA       PRO  39   4.404  11.716  11.716
  322   1HB   PRO  39          2HB       PRO  39   3.447   9.182   9.182
  323   2HB   PRO  39          1HB       PRO  39   5.160   9.560   9.560
  324   1HG   PRO  39          2HG       PRO  39   3.729   8.900   8.900
  325   2HG   PRO  39          1HG       PRO  39   5.432   8.655   8.655
  326   1HD   PRO  39          2HD       PRO  39   4.429  10.727  10.727
  327   2HD   PRO  39          1HD       PRO  39   6.042  10.676  10.676
  328    H    ALA  40           H        ALA  40   2.231  10.549  10.549
  329    HA   ALA  40           HA       ALA  40  -0.059  11.625  11.625
  330   1HB   ALA  40          2HB       ALA  40   0.675  11.991  11.991
  331   2HB   ALA  40          1HB       ALA  40  -1.036  11.847  11.847
  332   3HB   ALA  40          3HB       ALA  40  -0.066  13.134  13.134
  333    H    VAL  41           H        VAL  41  -2.173  10.592  10.592
  334    HA   VAL  41           HA       VAL  41  -1.897   7.904   7.904
  335    HB   VAL  41           HB       VAL  41  -2.674   8.427   8.427
  336   1HG1  VAL  41          1HG1      VAL  41  -3.182   5.942   5.942
  337   2HG1  VAL  41          3HG1      VAL  41  -3.321   6.015   6.015
  338   3HG1  VAL  41          2HG1      VAL  41  -4.403   6.973   6.973
  339   1HG2  VAL  41          1HG2      VAL  41  -0.537   6.926   6.926
  340   2HG2  VAL  41          3HG2      VAL  41  -0.415   7.939   7.939
  341   3HG2  VAL  41          2HG2      VAL  41  -1.085   6.312   6.312
  342    H    GLU  42           H        GLU  42  -4.136   6.957   6.957
  343    HA   GLU  42           HA       GLU  42  -6.390   8.841   8.841
  344   1HB   GLU  42          2HB       GLU  42  -5.333   9.514   9.514
  345   2HB   GLU  42          1HB       GLU  42  -5.459   7.858   7.858
  346   1HG   GLU  42          2HG       GLU  42  -7.950   8.016   8.016
  347   2HG   GLU  42          1HG       GLU  42  -7.747   9.719   9.719
  348    H    ILE  43           H        ILE  43  -7.850   7.496   7.496
  349    HA   ILE  43           HA       ILE  43  -7.891   4.649   4.649
  350    HB   ILE  43           HB       ILE  43  -8.971   6.122   6.122
  351   1HG1  ILE  43          2HG1      ILE  43  -7.622   3.973   3.973
  352   2HG1  ILE  43          1HG1      ILE  43  -6.800   4.188   4.188
  353   1HG2  ILE  43          2HG2      ILE  43  -9.821   3.476   3.476
  354   2HG2  ILE  43          1HG2      ILE  43  -9.590   3.600   3.600
  355   3HG2  ILE  43          3HG2      ILE  43 -10.748   4.653   4.653
  356   1HD1  ILE  43          1HD1      ILE  43  -7.209   6.375   6.375
  357   2HD1  ILE  43          3HD1      ILE  43  -5.713   5.469   5.469
  358   3HD1  ILE  43          2HD1      ILE  43  -6.309   6.515   6.515
  359    H    LYS  44           H        LYS  44  -9.544   3.812   3.812
  360    HA   LYS  44           HA       LYS  44 -11.906   5.556   5.556
  361   1HB   LYS  44          2HB       LYS  44 -11.533   3.332   3.332
  362   2HB   LYS  44          1HB       LYS  44 -11.790   5.038   5.038
  363   1HG   LYS  44          2HG       LYS  44  -9.418   5.508   5.508
  364   2HG   LYS  44          1HG       LYS  44  -9.104   3.900   3.900
  365   1HD   LYS  44          2HD       LYS  44  -9.509   2.872   2.872
  366   2HD   LYS  44          1HD       LYS  44 -10.365   4.281   4.281
  367   1HE   LYS  44          2HE       LYS  44  -8.332   5.551   5.551
  368   2HE   LYS  44          1HE       LYS  44  -7.428   4.326   4.326
  369   1HZ   LYS  44          1HZ       LYS  44  -7.867   2.766   2.766
  370   2HZ   LYS  44          3HZ       LYS  44  -8.686   3.977   3.977
  371   3HZ   LYS  44          2HZ       LYS  44  -7.022   4.133   4.133
  372    H    GLN  45           H        GLN  45 -13.419   4.782   4.782
  373    HA   GLN  45           HA       GLN  45 -13.540   1.855   1.855
  374   1HB   GLN  45          2HB       GLN  45 -13.519   3.344   3.344
  375   2HB   GLN  45          1HB       GLN  45 -14.994   4.122   4.122
  376   1HG   GLN  45          2HG       GLN  45 -16.142   1.895   1.895
  377   2HG   GLN  45          1HG       GLN  45 -14.685   1.214   1.214
  378   1HE2  GLN  45          2HE2      GLN  45 -16.243   2.020   2.020
  379   2HE2  GLN  45          1HE2      GLN  45 -15.836   0.765   0.765
  380    H    GLU  46           H        GLU  46 -15.028   0.603   0.603
  381    HA   GLU  46           HA       GLU  46 -17.556   1.852   1.852
  382   1HB   GLU  46          2HB       GLU  46 -15.838  -0.270  -0.270
  383   2HB   GLU  46          1HB       GLU  46 -17.485   0.106   0.106
  384   1HG   GLU  46          2HG       GLU  46 -16.830   2.447   2.447
  385   2HG   GLU  46          1HG       GLU  46 -15.183   2.078   2.078
  386    H    GLY  47           H        GLY  47 -17.654   0.945   0.945
  387   1HA   GLY  47          2HA       GLY  47 -19.213  -0.469  -0.469
  388   2HA   GLY  47          1HA       GLY  47 -19.205  -1.575  -1.575
  389    H    ASP  48           H        ASP  48 -18.305  -3.494  -3.494
  390    HA   ASP  48           HA       ASP  48 -16.363  -3.659  -3.659
  391   1HB   ASP  48          2HB       ASP  48 -16.210  -6.090  -6.090
  392   2HB   ASP  48          1HB       ASP  48 -17.775  -5.567  -5.567
  393    H    THR  49           H        THR  49 -15.994  -2.669  -2.669
  394    HA   THR  49           HA       THR  49 -13.409  -4.043  -4.043
  395    HB   THR  49           HB       THR  49 -15.196  -2.358  -2.358
  396    HG1  THR  49           HG1      THR  49 -15.806  -4.388  -4.388
  397   1HG2  THR  49          3HG2      THR  49 -12.865  -1.683  -1.683
  398   2HG2  THR  49          2HG2      THR  49 -12.423  -3.376  -3.376
  399   3HG2  THR  49          1HG2      THR  49 -13.544  -2.602  -2.602
  400    H    PHE  50           H        PHE  50 -11.466  -2.904  -2.904
  401    HA   PHE  50           HA       PHE  50 -11.622   0.022   0.022
  402   1HB   PHE  50          2HB       PHE  50 -10.058  -1.973  -1.973
  403   2HB   PHE  50          1HB       PHE  50  -9.914  -0.220  -0.220
  404    HD1  PHE  50           HD1      PHE  50 -12.134  -3.120  -3.120
  405    HD2  PHE  50           HD2      PHE  50 -11.682   1.110   1.110
  406    HE1  PHE  50           HE1      PHE  50 -14.155  -3.090  -3.090
  407    HE2  PHE  50           HE2      PHE  50 -13.701   1.141   1.141
  408    HZ   PHE  50           HZ       PHE  50 -14.947  -0.964  -0.964
  409    H    TYR  51           H        TYR  51 -10.396   0.954   0.954
  410    HA   TYR  51           HA       TYR  51  -8.051  -0.483  -0.483
  411   1HB   TYR  51          2HB       TYR  51  -9.830   0.388   0.388
  412   2HB   TYR  51          1HB       TYR  51  -9.489   2.011   2.011
  413    HD1  TYR  51           HD1      TYR  51  -6.908   2.706   2.706
  414    HD2  TYR  51           HD2      TYR  51  -8.731  -0.382  -0.382
  415    HE1  TYR  51           HE1      TYR  51  -5.096   2.901   2.901
  416    HE2  TYR  51           HE2      TYR  51  -6.929  -0.168  -0.168
  417    HH   TYR  51           HH       TYR  51  -5.167   2.172   2.172
  418    H    ILE  52           H        ILE  52  -5.982   0.591   0.591
  419    HA   ILE  52           HA       ILE  52  -5.965   3.126   3.126
  420    HB   ILE  52           HB       ILE  52  -4.044   0.920   0.920
  421   1HG1  ILE  52          2HG1      ILE  52  -6.844   1.304   1.304
  422   2HG1  ILE  52          1HG1      ILE  52  -6.311  -0.066  -0.066
  423   1HG2  ILE  52          2HG2      ILE  52  -4.105   3.485   3.485
  424   2HG2  ILE  52          1HG2      ILE  52  -5.273   2.866   2.866
  425   3HG2  ILE  52          3HG2      ILE  52  -3.634   2.215   2.215
  426   1HD1  ILE  52          1HD1      ILE  52  -4.459  -0.258  -0.258
  427   2HD1  ILE  52          3HD1      ILE  52  -5.659   0.615   0.615
  428   3HD1  ILE  52          2HD1      ILE  52  -6.066  -0.946  -0.946
  429    H    LYS  53           H        LYS  53  -5.080   4.401   4.401
  430    HA   LYS  53           HA       LYS  53  -2.629   3.432   3.432
  431   1HB   LYS  53          2HB       LYS  53  -4.797   4.735   4.735
  432   2HB   LYS  53          1HB       LYS  53  -3.748   6.104   6.104
  433   1HG   LYS  53          2HG       LYS  53  -1.961   4.404   4.404
  434   2HG   LYS  53          1HG       LYS  53  -3.433   3.954   3.954
  435   1HD   LYS  53          2HD       LYS  53  -2.451   6.806   6.806
  436   2HD   LYS  53          1HD       LYS  53  -2.150   5.806   5.806
  437   1HE   LYS  53          2HE       LYS  53  -4.521   5.614   5.614
  438   2HE   LYS  53          1HE       LYS  53  -4.916   6.423   6.423
  439   1HZ   LYS  53          2HZ       LYS  53  -3.550   8.340   8.340
  440   2HZ   LYS  53          1HZ       LYS  53  -3.674   7.569   7.569
  441   3HZ   LYS  53          3HZ       LYS  53  -5.076   8.076   8.076
  442    H    THR  54           H        THR  54  -0.764   3.951   3.951
  443    HA   THR  54           HA       THR  54  -0.653   6.523   6.523
  444    HB   THR  54           HB       THR  54   1.212   4.128   4.128
  445    HG1  THR  54           HG1      THR  54   0.073   3.533   3.533
  446   1HG2  THR  54          1HG2      THR  54   1.549   6.791   6.791
  447   2HG2  THR  54          3HG2      THR  54   1.142   5.871   5.871
  448   3HG2  THR  54          2HG2      THR  54   2.521   5.394   5.394
  449    H    SER  55           H        SER  55   0.976   8.028   8.028
  450    HA   SER  55           HA       SER  55   2.954   7.303   7.303
  451   1HB   SER  55          2HB       SER  55   2.233   9.552   9.552
  452   2HB   SER  55          1HB       SER  55   1.341   8.073   8.073
  453    HG   SER  55           HG       SER  55   0.044   9.954   9.954
  454    H    THR  56           H        THR  56   4.869   8.154   8.154
  455    HA   THR  56           HA       THR  56   4.837  10.350  10.350
  456    HB   THR  56           HB       THR  56   7.112   8.595   8.595
  457    HG1  THR  56           HG1      THR  56   5.419   7.473   7.473
  458   1HG2  THR  56          2HG2      THR  56   7.665  10.832  10.832
  459   2HG2  THR  56          1HG2      THR  56   6.899  10.259  10.259
  460   3HG2  THR  56          3HG2      THR  56   8.322   9.432   9.432
  461    H    THR  57           H        THR  57   7.000   9.497   9.497
  462    HA   THR  57           HA       THR  57   6.620  11.933  11.933
  463    HB   THR  57           HB       THR  57   7.707  12.983  12.983
  464    HG1  THR  57           HG1      THR  57   9.313  13.974  13.974
  465   1HG2  THR  57          1HG2      THR  57   8.893  10.718  10.718
  466   2HG2  THR  57          3HG2      THR  57  10.174  11.344  11.344
  467   3HG2  THR  57          2HG2      THR  57   9.692  12.237  12.237
  468    H    VAL  58           H        VAL  58   8.911   9.421   9.421
  469    HA   VAL  58           HA       VAL  58   9.802   9.197   9.197
  470    HB   VAL  58           HB       VAL  58  11.100   8.011   8.011
  471   1HG1  VAL  58          2HG1      VAL  58  12.050   8.387   8.387
  472   2HG1  VAL  58          1HG1      VAL  58  13.030   7.743   7.743
  473   3HG1  VAL  58          3HG1      VAL  58  11.616   6.853   6.853
  474   1HG2  VAL  58          2HG2      VAL  58  11.215  10.718  10.718
  475   2HG2  VAL  58          1HG2      VAL  58  11.704  10.161  10.161
  476   3HG2  VAL  58          3HG2      VAL  58  12.796   9.972   9.972
  477    H    ARG  59           H        ARG  59   7.899   7.703   7.703
  478    HA   ARG  59           HA       ARG  59   7.722   5.255   5.255
  479   1HB   ARG  59          2HB       ARG  59   8.984   4.783   4.783
  480   2HB   ARG  59          1HB       ARG  59   7.594   5.341   5.341
  481   1HG   ARG  59          2HG       ARG  59   6.258   3.545   3.545
  482   2HG   ARG  59          1HG       ARG  59   7.237   3.220   3.220
  483   1HD   ARG  59          2HD       ARG  59   8.077   1.532   1.532
  484   2HD   ARG  59          1HD       ARG  59   9.101   2.825   2.825
  485    HE   ARG  59           HE       ARG  59   7.759   2.877   2.877
  486   1HH1  ARG  59          1HH2      ARG  59   7.658  -0.062  -0.062
  487   2HH1  ARG  59          2HH2      ARG  59   6.130  -0.565  -0.565
  488   1HH2  ARG  59          2HH1      ARG  59   5.325   2.566   2.566
  489   2HH2  ARG  59          1HH1      ARG  59   4.809   0.923   0.923
  490    H    THR  60           H        THR  60   5.602   4.140   4.140
  491    HA   THR  60           HA       THR  60   3.397   5.589   5.589
  492    HB   THR  60           HB       THR  60   3.531   5.385   5.385
  493    HG1  THR  60           HG1      THR  60   3.613   7.667   7.667
  494   1HG2  THR  60          1HG2      THR  60   1.414   6.097   6.097
  495   2HG2  THR  60          3HG2      THR  60   1.521   7.104   7.104
  496   3HG2  THR  60          2HG2      THR  60   1.264   5.366   5.366
  497    H    THR  61           H        THR  61   2.511   3.783   3.783
  498    HA   THR  61           HA       THR  61   2.161   1.354   1.354
  499    HB   THR  61           HB       THR  61   1.674   0.339   0.339
  500    HG1  THR  61           HG1      THR  61   2.115   1.624   1.624
  501   1HG2  THR  61          1HG2      THR  61   3.652  -0.046  -0.046
  502   2HG2  THR  61          3HG2      THR  61   4.512   1.159   1.159
  503   3HG2  THR  61          2HG2      THR  61   3.952  -0.332  -0.332
  504    H    GLU  62           H        GLU  62   0.142   0.042   0.042
  505    HA   GLU  62           HA       GLU  62  -2.108   1.514   1.514
  506   1HB   GLU  62          2HB       GLU  62  -3.427   1.823   1.823
  507   2HB   GLU  62          1HB       GLU  62  -1.847   2.518   2.518
  508   1HG   GLU  62          2HG       GLU  62  -1.445  -0.032  -0.032
  509   2HG   GLU  62          1HG       GLU  62  -3.167   0.155   0.155
  510    H    ILE  63           H        ILE  63  -3.661   0.052   0.052
  511    HA   ILE  63           HA       ILE  63  -3.424  -2.757  -2.757
  512    HB   ILE  63           HB       ILE  63  -4.025  -3.491  -3.491
  513   1HG1  ILE  63          2HG1      ILE  63  -3.433  -0.597  -0.597
  514   2HG1  ILE  63          1HG1      ILE  63  -5.050  -1.297  -1.297
  515   1HG2  ILE  63          2HG2      ILE  63  -1.600  -2.983  -2.983
  516   2HG2  ILE  63          1HG2      ILE  63  -1.571  -1.823  -1.823
  517   3HG2  ILE  63          3HG2      ILE  63  -1.812  -3.538  -3.538
  518   1HD1  ILE  63          3HD1      ILE  63  -3.364  -3.021  -3.021
  519   2HD1  ILE  63          2HD1      ILE  63  -3.153  -1.368  -1.368
  520   3HD1  ILE  63          1HD1      ILE  63  -4.762  -2.086  -2.086
  521    H    ASN  64           H        ASN  64  -5.527  -4.015  -4.015
  522    HA   ASN  64           HA       ASN  64  -7.948  -2.418  -2.418
  523   1HB   ASN  64          2HB       ASN  64  -8.958  -3.139  -3.139
  524   2HB   ASN  64          1HB       ASN  64  -7.617  -2.019  -2.019
  525   1HD2  ASN  64          2HD2      ASN  64  -5.381  -4.525  -4.525
  526   2HD2  ASN  64          1HD2      ASN  64  -5.398  -3.157  -3.157
  527    H    PHE  65           H        PHE  65  -9.439  -3.774  -3.774
  528    HA   PHE  65           HA       PHE  65  -9.554  -6.628  -6.628
  529   1HB   PHE  65          2HB       PHE  65  -8.852  -7.473  -7.473
  530   2HB   PHE  65          1HB       PHE  65  -7.563  -6.504  -6.504
  531    HD1  PHE  65           HD2      PHE  65  -7.100  -4.201  -4.201
  532    HD2  PHE  65           HD1      PHE  65 -10.041  -6.750  -6.750
  533    HE1  PHE  65           HE2      PHE  65  -7.168  -2.714  -2.714
  534    HE2  PHE  65           HE1      PHE  65 -10.116  -5.268  -5.268
  535    HZ   PHE  65           HZ       PHE  65  -8.687  -3.249  -3.249
  536    H    LYS  66           H        LYS  66 -10.803  -7.751  -7.751
  537    HA   LYS  66           HA       LYS  66 -13.110  -6.018  -6.018
  538   1HB   LYS  66          2HB       LYS  66 -14.536  -8.124  -8.124
  539   2HB   LYS  66          1HB       LYS  66 -14.000  -7.359  -7.359
  540   1HG   LYS  66          2HG       LYS  66 -12.037  -8.964  -8.964
  541   2HG   LYS  66          1HG       LYS  66 -12.818  -9.808  -9.808
  542   1HD   LYS  66          2HD       LYS  66 -14.286 -10.833 -10.833
  543   2HD   LYS  66          1HD       LYS  66 -14.684  -9.321  -9.321
  544   1HE   LYS  66          2HE       LYS  66 -12.081 -10.743 -10.743
  545   2HE   LYS  66          1HE       LYS  66 -13.560 -11.189 -11.189
  546   1HZ   LYS  66          3HZ       LYS  66 -13.768  -8.718  -8.718
  547   2HZ   LYS  66          2HZ       LYS  66 -12.140  -8.597  -8.597
  548   3HZ   LYS  66          1HZ       LYS  66 -12.575  -9.574  -9.574
  549    H    VAL  67           H        VAL  67 -14.079  -6.699  -6.699
  550    HA   VAL  67           HA       VAL  67 -12.058  -7.924  -7.924
  551    HB   VAL  67           HB       VAL  67 -14.741  -7.400  -7.400
  552   1HG1  VAL  67          2HG1      VAL  67 -11.844  -6.963  -6.963
  553   2HG1  VAL  67          1HG1      VAL  67 -13.083  -6.071  -6.071
  554   3HG1  VAL  67          3HG1      VAL  67 -13.077  -7.834  -7.834
  555   1HG2  VAL  67          2HG2      VAL  67 -13.202  -5.317  -5.317
  556   2HG2  VAL  67          1HG2      VAL  67 -14.937  -5.431  -5.431
  557   3HG2  VAL  67          3HG2      VAL  67 -13.858  -4.868  -4.868
  558    H    GLY  68           H        GLY  68 -11.942 -10.125 -10.125
  559   1HA   GLY  68          2HA       GLY  68 -13.250 -12.072 -12.072
  560   2HA   GLY  68          1HA       GLY  68 -14.465 -11.692 -11.692
  561    H    GLU  69           H        GLU  69 -12.500 -11.117 -11.117
  562    HA   GLU  69           HA       GLU  69 -11.644 -13.938 -13.938
  563   1HB   GLU  69          2HB       GLU  69 -12.627 -11.725 -11.725
  564   2HB   GLU  69          1HB       GLU  69 -11.641 -13.028 -13.028
  565   1HG   GLU  69          2HG       GLU  69 -13.391 -14.505 -14.505
  566   2HG   GLU  69          1HG       GLU  69 -14.416 -13.111 -13.111
  567    H    GLU  70           H        GLU  70  -9.589 -14.251 -14.251
  568    HA   GLU  70           HA       GLU  70  -7.568 -12.285 -12.285
  569   1HB   GLU  70          2HB       GLU  70  -5.979 -14.018 -14.018
  570   2HB   GLU  70          1HB       GLU  70  -7.087 -14.647 -14.647
  571   1HG   GLU  70          2HG       GLU  70  -8.112 -14.849 -14.849
  572   2HG   GLU  70          1HG       GLU  70  -6.641 -15.780 -15.780
  573    H    PHE  71           H        PHE  71  -5.811 -11.728 -11.728
  574    HA   PHE  71           HA       PHE  71  -6.628 -11.737 -11.737
  575   1HB   PHE  71          2HB       PHE  71  -6.691  -9.230  -9.230
  576   2HB   PHE  71          1HB       PHE  71  -8.029  -9.910  -9.910
  577    HD1  PHE  71           HD2      PHE  71  -7.829 -10.004 -10.004
  578    HD2  PHE  71           HD1      PHE  71  -5.171  -7.715  -7.715
  579    HE1  PHE  71           HE2      PHE  71  -7.121  -8.684  -8.684
  580    HE2  PHE  71           HE1      PHE  71  -4.461  -6.396  -6.396
  581    HZ   PHE  71           HZ       PHE  71  -5.435  -6.880  -6.880
  582    H    GLU  72           H        GLU  72  -5.052 -10.267 -10.267
  583    HA   GLU  72           HA       GLU  72  -2.355 -10.583 -10.583
  584   1HB   GLU  72          2HB       GLU  72  -2.766  -9.905  -9.905
  585   2HB   GLU  72          1HB       GLU  72  -1.422 -10.739 -10.739
  586   1HG   GLU  72          2HG       GLU  72  -2.955 -12.665 -12.665
  587   2HG   GLU  72          1HG       GLU  72  -4.202 -11.852 -11.852
  588    H    GLU  73           H        GLU  73  -0.987  -8.780  -8.780
  589    HA   GLU  73           HA       GLU  73  -1.765  -6.191  -6.191
  590   1HB   GLU  73          2HB       GLU  73  -1.906  -5.083  -5.083
  591   2HB   GLU  73          1HB       GLU  73  -3.236  -6.201  -6.201
  592   1HG   GLU  73          2HG       GLU  73  -2.539  -7.679  -7.679
  593   2HG   GLU  73          1HG       GLU  73  -0.831  -7.381  -7.381
  594    H    GLN  74           H        GLN  74  -0.213  -4.480  -4.480
  595    HA   GLN  74           HA       GLN  74   2.502  -5.733  -5.733
  596   1HB   GLN  74          2HB       GLN  74   1.390  -3.020  -3.020
  597   2HB   GLN  74          1HB       GLN  74   3.026  -3.081  -3.081
  598   1HG   GLN  74          2HG       GLN  74   2.370  -4.964  -4.964
  599   2HG   GLN  74          1HG       GLN  74   2.565  -3.260  -3.260
  600   1HE2  GLN  74          2HE2      GLN  74   5.845  -5.454  -5.454
  601   2HE2  GLN  74          1HE2      GLN  74   4.303  -6.113  -6.113
  602    H    THR  75           H        THR  75   4.096  -5.155  -5.155
  603    HA   THR  75           HA       THR  75   2.836  -4.843  -4.843
  604    HB   THR  75           HB       THR  75   4.498  -6.683  -6.683
  605    HG1  THR  75           HG1      THR  75   4.035  -5.948  -5.948
  606   1HG2  THR  75          1HG2      THR  75   6.081  -4.465  -4.465
  607   2HG2  THR  75          3HG2      THR  75   6.882  -5.210  -5.210
  608   3HG2  THR  75          2HG2      THR  75   6.493  -6.177  -6.177
  609    H    VAL  76           H        VAL  76   5.581  -3.699  -3.699
  610    HA   VAL  76           HA       VAL  76   4.941  -0.895  -0.895
  611    HB   VAL  76           HB       VAL  76   6.399  -1.884  -1.884
  612   1HG1  VAL  76          3HG1      VAL  76   5.375   0.796   0.796
  613   2HG1  VAL  76          2HG1      VAL  76   5.665   0.464   0.464
  614   3HG1  VAL  76          1HG1      VAL  76   6.996   0.377   0.377
  615   1HG2  VAL  76          1HG2      VAL  76   3.496  -1.141  -1.141
  616   2HG2  VAL  76          3HG2      VAL  76   4.126  -2.695  -2.695
  617   3HG2  VAL  76          2HG2      VAL  76   4.235  -1.282  -1.282
  618    H    ASP  77           H        ASP  77   7.430  -3.310  -3.310
  619    HA   ASP  77           HA       ASP  77   9.567  -1.337  -1.337
  620   1HB   ASP  77          2HB       ASP  77   9.649  -3.782  -3.782
  621   2HB   ASP  77          1HB       ASP  77  10.016  -4.217  -4.217
  622    H    GLY  78           H        GLY  78   7.779  -3.777  -3.777
  623   1HA   GLY  78          2HA       GLY  78   7.258  -2.810  -2.810
  624   2HA   GLY  78          1HA       GLY  78   9.014  -2.776  -2.776
  625    H    ARG  79           H        ARG  79   6.905  -5.231  -5.231
  626    HA   ARG  79           HA       ARG  79   7.862  -7.187  -7.187
  627   1HB   ARG  79          2HB       ARG  79   8.002  -7.271  -7.271
  628   2HB   ARG  79          1HB       ARG  79   7.688  -8.774  -8.774
  629   1HG   ARG  79          2HG       ARG  79   9.954  -6.939  -6.939
  630   2HG   ARG  79          1HG       ARG  79  10.153  -8.193  -8.193
  631   1HD   ARG  79          2HD       ARG  79   9.073  -8.776  -8.776
  632   2HD   ARG  79          1HD       ARG  79  10.791  -8.864  -8.864
  633    HE   ARG  79           HE       ARG  79   8.878 -10.463 -10.463
  634   1HH1  ARG  79          2HH1      ARG  79  12.064 -10.297 -10.297
  635   2HH1  ARG  79          1HH1      ARG  79  12.261 -11.905 -11.905
  636   1HH2  ARG  79          1HH2      ARG  79   8.856 -12.506 -12.506
  637   2HH2  ARG  79          2HH2      ARG  79  10.445 -13.156 -13.156
  638    HA   PRO  80           HA       PRO  80   3.542  -8.186  -8.186
  639   1HB   PRO  80          2HB       PRO  80   3.689 -10.712 -10.712
  640   2HB   PRO  80          1HB       PRO  80   3.932  -9.226  -9.226
  641   1HG   PRO  80          2HG       PRO  80   5.951 -11.209 -11.209
  642   2HG   PRO  80          1HG       PRO  80   6.017 -10.107 -10.107
  643   1HD   PRO  80          2HD       PRO  80   7.325  -9.737  -9.737
  644   2HD   PRO  80          1HD       PRO  80   7.125  -8.512  -8.512
  645    H    CYS  81           H        CYS  81   2.047  -9.193  -9.193
  646    HA   CYS  81           HA       CYS  81   2.658 -11.643 -11.643
  647   1HB   CYS  81          2HB       CYS  81   2.300 -10.542 -10.542
  648   2HB   CYS  81          1HB       CYS  81   3.842 -10.169 -10.169
  649    HG   CYS  81           HG       CYS  81   1.551  -8.170  -8.170
  650    H    LYS  82           H        LYS  82   0.761 -12.623 -12.623
  651    HA   LYS  82           HA       LYS  82  -1.763 -11.300 -11.300
  652   1HB   LYS  82          2HB       LYS  82  -1.342 -13.656 -13.656
  653   2HB   LYS  82          1HB       LYS  82  -1.259 -14.110 -14.110
  654   1HG   LYS  82          2HG       LYS  82  -3.600 -12.976 -12.976
  655   2HG   LYS  82          1HG       LYS  82  -3.626 -13.206 -13.206
  656   1HD   LYS  82          2HD       LYS  82  -2.970 -15.463 -15.463
  657   2HD   LYS  82          1HD       LYS  82  -4.628 -15.101 -15.101
  658   1HE   LYS  82          2HE       LYS  82  -2.382 -15.599 -15.599
  659   2HE   LYS  82          1HE       LYS  82  -3.498 -16.850 -16.850
  660   1HZ   LYS  82          1HZ       LYS  82  -5.295 -15.185 -15.185
  661   2HZ   LYS  82          3HZ       LYS  82  -4.058 -14.445 -14.445
  662   3HZ   LYS  82          2HZ       LYS  82  -4.479 -16.061 -16.061
  663    H    SER  83           H        SER  83  -2.707 -10.073 -10.073
  664    HA   SER  83           HA       SER  83  -2.195 -10.702 -10.702
  665   1HB   SER  83          2HB       SER  83  -1.879  -8.381  -8.381
  666   2HB   SER  83          1HB       SER  83  -3.600  -8.237  -8.237
  667    HG   SER  83           HG       SER  83  -2.085  -7.457  -7.457
  668    H    LEU  84           H        LEU  84  -4.192  -9.979  -9.979
  669    HA   LEU  84           HA       LEU  84  -6.793 -10.594 -10.594
  670   1HB   LEU  84          2HB       LEU  84  -5.977 -12.848 -12.848
  671   2HB   LEU  84          1HB       LEU  84  -5.637 -12.309 -12.309
  672    HG   LEU  84           HG       LEU  84  -8.035 -11.850 -11.850
  673   1HD1  LEU  84          2HD1      LEU  84  -8.549 -11.367 -11.367
  674   2HD1  LEU  84          1HD1      LEU  84  -8.453 -13.098 -13.098
  675   3HD1  LEU  84          3HD1      LEU  84  -9.694 -12.461 -12.461
  676   1HD2  LEU  84          3HD2      LEU  84  -7.394 -14.604 -14.604
  677   2HD2  LEU  84          2HD2      LEU  84  -7.229 -14.064 -14.064
  678   3HD2  LEU  84          1HD2      LEU  84  -8.830 -14.221 -14.221
  679    H    VAL  85           H        VAL  85  -8.543  -9.884  -9.884
  680    HA   VAL  85           HA       VAL  85  -7.583  -8.402  -8.402
  681    HB   VAL  85           HB       VAL  85  -9.476  -7.163  -7.163
  682   1HG1  VAL  85          2HG1      VAL  85  -9.478  -6.305  -6.305
  683   2HG1  VAL  85          1HG1      VAL  85  -7.745  -5.999  -5.999
  684   3HG1  VAL  85          3HG1      VAL  85  -8.874  -5.107  -5.107
  685   1HG2  VAL  85          1HG2      VAL  85  -6.504  -7.297  -7.297
  686   2HG2  VAL  85          3HG2      VAL  85  -7.619  -7.125  -7.125
  687   3HG2  VAL  85          2HG2      VAL  85  -7.224  -5.730  -5.730
  688    H    LYS  86           H        LYS  86  -8.883  -8.638  -8.638
  689    HA   LYS  86           HA       LYS  86 -11.732  -9.400  -9.400
  690   1HB   LYS  86          2HB       LYS  86 -11.326 -10.441 -10.441
  691   2HB   LYS  86          1HB       LYS  86 -11.040 -11.379 -11.379
  692   1HG   LYS  86          2HG       LYS  86  -8.622 -10.657 -10.657
  693   2HG   LYS  86          1HG       LYS  86  -8.975  -9.918  -9.918
  694   1HD   LYS  86          2HD       LYS  86 -10.009 -12.347 -12.347
  695   2HD   LYS  86          1HD       LYS  86  -8.807 -12.802 -12.802
  696   1HE   LYS  86          2HE       LYS  86  -7.152 -11.390 -11.390
  697   2HE   LYS  86          1HE       LYS  86  -8.367 -11.482 -11.482
  698   1HZ   LYS  86          2HZ       LYS  86  -7.417 -13.903 -13.903
  699   2HZ   LYS  86          1HZ       LYS  86  -6.582 -13.274 -13.274
  700   3HZ   LYS  86          3HZ       LYS  86  -8.190 -13.784 -13.784
  701    H    TRP  87           H        TRP  87 -13.139  -8.602  -8.602
  702    HA   TRP  87           HA       TRP  87 -12.241  -5.932  -5.932
  703   1HB   TRP  87          2HB       TRP  87 -14.836  -7.454  -7.454
  704   2HB   TRP  87          1HB       TRP  87 -14.591  -5.908  -5.908
  705    HD1  TRP  87           HD1      TRP  87 -15.511  -7.430  -7.430
  706    HE1  TRP  87           HE1      TRP  87 -15.732  -5.637  -5.637
  707    HE3  TRP  87           HE3      TRP  87 -13.375  -3.485  -3.485
  708    HZ2  TRP  87           HZ2      TRP  87 -15.083  -2.881  -2.881
  709    HZ3  TRP  87           HZ3      TRP  87 -13.162  -1.287  -1.287
  710    HH2  TRP  87           HH2      TRP  87 -14.013  -0.988  -0.988
  711    H    GLU  88           H        GLU  88 -12.785  -5.275  -5.275
  712    HA   GLU  88           HA       GLU  88 -12.204  -7.412  -7.412
  713   1HB   GLU  88          2HB       GLU  88 -10.190  -5.897  -5.897
  714   2HB   GLU  88          1HB       GLU  88 -11.035  -4.643  -4.643
  715   1HG   GLU  88          2HG       GLU  88  -9.641  -5.599  -5.599
  716   2HG   GLU  88          1HG       GLU  88 -11.190  -6.397  -6.397
  717    H    SER  89           H        SER  89 -13.185  -4.080  -4.080
  718    HA   SER  89           HA       SER  89 -15.300  -4.345  -4.345
  719   1HB   SER  89          2HB       SER  89 -14.853  -2.109  -2.109
  720   2HB   SER  89          1HB       SER  89 -13.306  -2.951  -2.951
  721    HG   SER  89           HG       SER  89 -14.000  -0.737  -0.737
  722    H    GLU  90           H        GLU  90 -16.256  -1.630  -1.630
  723    HA   GLU  90           HA       GLU  90 -17.736  -2.305  -2.305
  724   1HB   GLU  90          2HB       GLU  90 -17.706   0.387   0.387
  725   2HB   GLU  90          1HB       GLU  90 -18.988  -0.298  -0.298
  726   1HG   GLU  90          2HG       GLU  90 -18.868  -2.228  -2.228
  727   2HG   GLU  90          1HG       GLU  90 -18.265  -0.893  -0.893
  728    H    ASN  91           H        ASN  91 -14.879  -0.435  -0.435
  729    HA   ASN  91           HA       ASN  91 -14.616   0.126   0.126
  730   1HB   ASN  91          2HB       ASN  91 -14.132   2.259   2.259
  731   2HB   ASN  91          1HB       ASN  91 -14.069   2.442   2.442
  732   1HD2  ASN  91          2HD2      ASN  91 -17.518   3.171   3.171
  733   2HD2  ASN  91          1HD2      ASN  91 -15.988   3.272   3.272
  734    H    LYS  92           H        LYS  92 -13.214  -1.683  -1.683
  735    HA   LYS  92           HA       LYS  92 -10.478  -0.636  -0.636
  736   1HB   LYS  92          2HB       LYS  92 -11.004  -0.294  -0.294
  737   2HB   LYS  92          1HB       LYS  92 -11.394  -2.006  -2.006
  738   1HG   LYS  92          2HG       LYS  92  -8.954  -2.293  -2.293
  739   2HG   LYS  92          1HG       LYS  92  -8.733  -0.688  -0.688
  740   1HD   LYS  92          2HD       LYS  92  -9.736  -1.675  -1.675
  741   2HD   LYS  92          1HD       LYS  92  -9.461  -3.253  -3.253
  742   1HE   LYS  92          2HE       LYS  92  -7.232  -1.237  -1.237
  743   2HE   LYS  92          1HE       LYS  92  -7.593  -2.215  -2.215
  744   1HZ   LYS  92          3HZ       LYS  92  -7.556  -4.143  -4.143
  745   2HZ   LYS  92          2HZ       LYS  92  -6.630  -3.062  -3.062
  746   3HZ   LYS  92          1HZ       LYS  92  -6.098  -3.533  -3.533
  747    H    MET  93           H        MET  93  -9.808  -2.028  -2.028
  748    HA   MET  93           HA       MET  93 -10.397  -4.935  -4.935
  749   1HB   MET  93          2HB       MET  93  -9.825  -4.955  -4.955
  750   2HB   MET  93          1HB       MET  93 -11.438  -4.539  -4.539
  751   1HG   MET  93          2HG       MET  93 -11.157  -2.276  -2.276
  752   2HG   MET  93          1HG       MET  93  -9.408  -2.364  -2.364
  753   1HE   MET  93          3HE       MET  93 -12.193  -4.071  -4.071
  754   2HE   MET  93          2HE       MET  93 -12.289  -3.475  -3.475
  755   3HE   MET  93          1HE       MET  93 -11.420  -4.968  -4.968
  756    H    VAL  94           H        VAL  94  -8.746  -6.436  -6.436
  757    HA   VAL  94           HA       VAL  94  -5.981  -5.321  -5.321
  758    HB   VAL  94           HB       VAL  94  -6.502  -8.230  -8.230
  759   1HG1  VAL  94          1HG1      VAL  94  -4.343  -6.569  -6.569
  760   2HG1  VAL  94          3HG1      VAL  94  -4.959  -6.664  -6.664
  761   3HG1  VAL  94          2HG1      VAL  94  -4.521  -8.136  -8.136
  762   1HG2  VAL  94          3HG2      VAL  94  -7.563  -6.051  -6.051
  763   2HG2  VAL  94          2HG2      VAL  94  -8.283  -7.612  -7.612
  764   3HG2  VAL  94          1HG2      VAL  94  -6.933  -7.527  -7.527
  765    H    CYS  95           H        CYS  95  -4.317  -6.855  -6.855
  766    HA   CYS  95           HA       CYS  95  -5.485  -8.129  -8.129
  767   1HB   CYS  95          2HB       CYS  95  -5.126  -5.727  -5.727
  768   2HB   CYS  95          1HB       CYS  95  -3.425  -5.915  -5.915
  769    HG   CYS  95           HG       CYS  95  -3.317  -7.738  -7.738
  770    H    GLU  96           H        GLU  96  -4.363  -9.927  -9.927
  771    HA   GLU  96           HA       GLU  96  -1.658 -10.308 -10.308
  772   1HB   GLU  96          2HB       GLU  96  -2.019 -12.726 -12.726
  773   2HB   GLU  96          1HB       GLU  96  -3.192 -12.117 -12.117
  774   1HG   GLU  96          2HG       GLU  96  -3.923 -11.782 -11.782
  775   2HG   GLU  96          1HG       GLU  96  -3.896 -13.441 -13.441
  776    H    GLN  97           H        GLN  97  -0.033 -11.415 -11.415
  777    HA   GLN  97           HA       GLN  97  -0.614 -11.054 -11.054
  778   1HB   GLN  97          2HB       GLN  97   0.004  -8.777  -8.777
  779   2HB   GLN  97          1HB       GLN  97   1.643  -9.404  -9.404
  780   1HG   GLN  97          2HG       GLN  97   1.043  -9.907  -9.907
  781   2HG   GLN  97          1HG       GLN  97  -0.286  -8.777  -8.777
  782   1HE2  GLN  97          2HE2      GLN  97   1.789  -5.912  -5.912
  783   2HE2  GLN  97          1HE2      GLN  97   0.218  -6.522  -6.522
  784    H    LYS  98           H        LYS  98   0.804 -12.144 -12.144
  785    HA   LYS  98           HA       LYS  98   3.352 -13.175 -13.175
  786   1HB   LYS  98          2HB       LYS  98   2.787 -15.488 -15.488
  787   2HB   LYS  98          1HB       LYS  98   1.735 -14.936 -14.936
  788   1HG   LYS  98          2HG       LYS  98  -0.035 -14.405 -14.405
  789   2HG   LYS  98          1HG       LYS  98   1.018 -14.756 -14.756
  790   1HD   LYS  98          2HD       LYS  98  -0.291 -16.718 -16.718
  791   2HD   LYS  98          1HD       LYS  98   1.257 -17.113 -17.113
  792   1HE   LYS  98          2HE       LYS  98   0.010 -16.070 -16.070
  793   2HE   LYS  98          1HE       LYS  98  -1.400 -16.664 -16.664
  794   1HZ   LYS  98          1HZ       LYS  98   0.984 -18.357 -18.357
  795   2HZ   LYS  98          3HZ       LYS  98  -0.252 -18.259 -18.259
  796   3HZ   LYS  98          2HZ       LYS  98  -0.596 -18.835 -18.835
  797    H    LEU  99           H        LEU  99   4.851 -13.675 -13.675
  798    HA   LEU  99           HA       LEU  99   4.562 -12.113 -12.113
  799   1HB   LEU  99          2HB       LEU  99   6.317 -14.506 -14.506
  800   2HB   LEU  99          1HB       LEU  99   6.473 -13.486 -13.486
  801    HG   LEU  99           HG       LEU  99   6.427 -12.112 -12.112
  802   1HD1  LEU  99          1HD1      LEU  99   8.628 -13.922 -13.922
  803   2HD1  LEU  99          3HD1      LEU  99   8.987 -12.532 -12.532
  804   3HD1  LEU  99          2HD1      LEU  99   7.937 -13.819 -13.819
  805   1HD2  LEU  99          1HD2      LEU  99   7.665 -11.800 -11.800
  806   2HD2  LEU  99          3HD2      LEU  99   6.709 -10.642 -10.642
  807   3HD2  LEU  99          2HD2      LEU  99   8.385 -10.961 -10.961
  808    H    LEU 100           H        LEU 100   4.630 -12.979 -12.979
  809    HA   LEU 100           HA       LEU 100   2.627 -15.132 -15.132
  810   1HB   LEU 100          2HB       LEU 100   3.649 -12.916 -12.916
  811   2HB   LEU 100          1HB       LEU 100   2.706 -14.263 -14.263
  812    HG   LEU 100           HG       LEU 100   1.740 -12.648 -12.648
  813   1HD1  LEU 100          1HD1      LEU 100   1.579 -12.037 -12.037
  814   2HD1  LEU 100          3HD1      LEU 100   0.275 -11.544 -11.544
  815   3HD1  LEU 100          2HD1      LEU 100   1.911 -10.942 -10.942
  816   1HD2  LEU 100          2HD2      LEU 100   0.652 -14.696 -14.696
  817   2HD2  LEU 100          1HD2      LEU 100   0.372 -14.505 -14.505
  818   3HD2  LEU 100          3HD2      LEU 100  -0.456 -13.453 -13.453
  819    H    LYS 101           H        LYS 101   5.981 -14.708 -14.708
  820    HA   LYS 101           HA       LYS 101   6.378 -17.270 -17.270
  821   1HB   LYS 101          2HB       LYS 101   6.640 -15.160 -15.160
  822   2HB   LYS 101          1HB       LYS 101   8.209 -15.036 -15.036
  823   1HG   LYS 101          2HG       LYS 101   8.507 -16.403 -16.403
  824   2HG   LYS 101          1HG       LYS 101   8.588 -17.471 -17.471
  825   1HD   LYS 101          2HD       LYS 101   6.515 -18.422 -18.422
  826   2HD   LYS 101          1HD       LYS 101   5.929 -17.004 -17.004
  827   1HE   LYS 101          2HE       LYS 101   6.317 -18.408 -18.408
  828   2HE   LYS 101          1HE       LYS 101   7.908 -17.657 -17.657
  829   1HZ   LYS 101          2HZ       LYS 101   7.111 -20.228 -20.228
  830   2HZ   LYS 101          1HZ       LYS 101   8.060 -20.068 -20.068
  831   3HZ   LYS 101          3HZ       LYS 101   8.648 -19.510 -19.510
  832    H    GLY 102           H        GLY 102   8.101 -18.396 -18.396
  833   1HA   GLY 102          2HA       GLY 102   9.838 -18.877 -18.877
  834   2HA   GLY 102          1HA       GLY 102  10.290 -17.173 -17.173
  835    H    GLU 103           H        GLU 103  10.668 -17.304 -17.304
  836    HA   GLU 103           HA       GLU 103   8.486 -16.269 -16.269
  837   1HB   GLU 103          2HB       GLU 103   7.765 -18.673 -18.673
  838   2HB   GLU 103          1HB       GLU 103   9.236 -19.114 -19.114
  839   1HG   GLU 103          2HG       GLU 103   8.572 -17.947 -17.947
  840   2HG   GLU 103          1HG       GLU 103   7.315 -17.061 -17.061
  841    H    GLY 104           H        GLY 104   9.262 -15.343 -15.343
  842   1HA   GLY 104          2HA       GLY 104  11.738 -16.238 -16.238
  843   2HA   GLY 104          1HA       GLY 104  11.888 -14.691 -14.691
  844    HA   PRO 105           HA       PRO 105  10.076 -12.848 -12.848
  845   1HB   PRO 105          2HB       PRO 105   9.262 -10.457 -10.457
  846   2HB   PRO 105          1HB       PRO 105  10.959 -10.844 -10.844
  847   1HG   PRO 105          2HG       PRO 105   9.558 -10.673 -10.673
  848   2HG   PRO 105          1HG       PRO 105  11.286 -10.524 -10.524
  849   1HD   PRO 105          2HD       PRO 105   9.946 -12.822 -12.822
  850   2HD   PRO 105          1HD       PRO 105  11.642 -12.721 -12.721
  851    H    LYS 106           H        LYS 106   7.922 -11.451 -11.451
  852    HA   LYS 106           HA       LYS 106   5.631 -12.542 -12.542
  853   1HB   LYS 106          2HB       LYS 106   5.906 -13.987 -13.987
  854   2HB   LYS 106          1HB       LYS 106   5.962 -12.573 -12.573
  855   1HG   LYS 106          2HG       LYS 106   3.700 -12.128 -12.128
  856   2HG   LYS 106          1HG       LYS 106   3.603 -12.939 -12.939
  857   1HD   LYS 106          2HD       LYS 106   3.254 -14.993 -14.993
  858   2HD   LYS 106          1HD       LYS 106   4.359 -14.678 -14.678
  859   1HE   LYS 106          2HE       LYS 106   1.943 -14.881 -14.881
  860   2HE   LYS 106          1HE       LYS 106   2.697 -13.355 -13.355
  861   1HZ   LYS 106          3HZ       LYS 106   1.074 -13.748 -13.748
  862   2HZ   LYS 106          2HZ       LYS 106   0.476 -13.092 -13.092
  863   3HZ   LYS 106          1HZ       LYS 106   1.694 -12.281 -12.281
  864    H    THR 107           H        THR 107   4.040 -10.965 -10.965
  865    HA   THR 107           HA       THR 107   4.434  -8.407  -8.407
  866    HB   THR 107           HB       THR 107   3.117  -7.646  -7.646
  867    HG1  THR 107           HG1      THR 107   3.555  -9.843  -9.843
  868   1HG2  THR 107          3HG2      THR 107   6.038  -7.744  -7.744
  869   2HG2  THR 107          2HG2      THR 107   5.484  -6.967  -6.967
  870   3HG2  THR 107          1HG2      THR 107   4.930  -6.375  -6.375
  871    H    SER 108           H        SER 108   2.657  -7.316  -7.316
  872    HA   SER 108           HA       SER 108  -0.073  -8.114  -8.114
  873   1HB   SER 108          2HB       SER 108   0.871  -8.534  -8.534
  874   2HB   SER 108          1HB       SER 108  -0.703  -8.937  -8.937
  875    HG   SER 108           HG       SER 108   1.448 -10.454 -10.454
  876    H    TRP 109           H        TRP 109  -1.302  -6.231  -6.231
  877    HA   TRP 109           HA       TRP 109  -0.266  -4.204  -4.204
  878   1HB   TRP 109          2HB       TRP 109  -0.928  -2.426  -2.426
  879   2HB   TRP 109          1HB       TRP 109   0.499  -3.366  -3.366
  880    HD1  TRP 109           HD1      TRP 109   0.390  -4.924  -4.924
  881    HE1  TRP 109           HE1      TRP 109  -1.341  -5.230  -5.230
  882    HE3  TRP 109           HE3      TRP 109  -3.562  -2.384  -2.384
  883    HZ2  TRP 109           HZ2      TRP 109  -4.042  -4.492  -4.492
  884    HZ3  TRP 109           HZ3      TRP 109  -5.697  -2.203  -2.203
  885    HH2  TRP 109           HH2      TRP 109  -5.944  -3.252  -3.252
  886    H    THR 110           H        THR 110  -1.935  -2.461  -2.461
  887    HA   THR 110           HA       THR 110  -4.713  -3.551  -3.551
  888    HB   THR 110           HB       THR 110  -5.194  -3.106  -3.106
  889    HG1  THR 110           HG1      THR 110  -4.164  -1.205  -1.205
  890   1HG2  THR 110          2HG2      THR 110  -3.244  -4.949  -4.949
  891   2HG2  THR 110          1HG2      THR 110  -2.517  -4.089  -4.089
  892   3HG2  THR 110          3HG2      THR 110  -4.080  -4.881  -4.881
  893    H    MET 111           H        MET 111  -6.305  -1.762  -1.762
  894    HA   MET 111           HA       MET 111  -5.434   1.006   1.006
  895   1HB   MET 111          2HB       MET 111  -7.014   1.369   1.369
  896   2HB   MET 111          1HB       MET 111  -5.572   0.434   0.434
  897   1HG   MET 111          2HG       MET 111  -6.763  -1.597  -1.597
  898   2HG   MET 111          1HG       MET 111  -8.118  -0.934  -0.934
  899   1HE   MET 111          2HE       MET 111  -5.826  -0.227  -0.227
  900   2HE   MET 111          1HE       MET 111  -6.725  -0.495  -0.495
  901   3HE   MET 111          3HE       MET 111  -6.635   1.125   1.125
  902    H    GLU 112           H        GLU 112  -6.756   2.267   2.267
  903    HA   GLU 112           HA       GLU 112  -9.432   1.143   1.143
  904   1HB   GLU 112          2HB       GLU 112  -7.771   1.050   1.050
  905   2HB   GLU 112          1HB       GLU 112  -7.615   2.804   2.804
  906   1HG   GLU 112          2HG       GLU 112  -9.798   3.173   3.173
  907   2HG   GLU 112          1HG       GLU 112 -10.334   1.556   1.556
  908    H    LEU 113           H        LEU 113 -11.104   2.690   2.690
  909    HA   LEU 113           HA       LEU 113 -10.541   5.361   5.361
  910   1HB   LEU 113          2HB       LEU 113 -12.284   3.400   3.400
  911   2HB   LEU 113          1HB       LEU 113 -13.337   4.374   4.374
  912    HG   LEU 113           HG       LEU 113 -13.304   5.010   5.010
  913   1HD1  LEU 113          2HD1      LEU 113 -13.956   6.560   6.560
  914   2HD1  LEU 113          1HD1      LEU 113 -12.322   7.210   7.210
  915   3HD1  LEU 113          3HD1      LEU 113 -13.376   7.364   7.364
  916   1HD2  LEU 113          2HD2      LEU 113 -10.754   4.661   4.661
  917   2HD2  LEU 113          1HD2      LEU 113 -11.431   6.055   6.055
  918   3HD2  LEU 113          3HD2      LEU 113 -10.629   6.267   6.267
  919    H    THR 114           H        THR 114 -11.338   7.175   7.175
  920    HA   THR 114           HA       THR 114 -12.105   6.518   6.518
  921    HB   THR 114           HB       THR 114 -11.536   8.764   8.764
  922    HG1  THR 114           HG1      THR 114 -11.987  10.264  10.264
  923   1HG2  THR 114          3HG2      THR 114  -9.644   7.190   7.190
  924   2HG2  THR 114          2HG2      THR 114  -9.589   8.057   8.057
  925   3HG2  THR 114          1HG2      THR 114  -9.257   8.911   8.911
  926    H    ASN 115           H        ASN 115 -13.907   7.683   7.683
  927    HA   ASN 115           HA       ASN 115 -16.336   7.468   7.468
  928   1HB   ASN 115          2HB       ASN 115 -15.750   7.718   7.718
  929   2HB   ASN 115          1HB       ASN 115 -16.248   9.376   9.376
  930   1HD2  ASN 115          2HD2      ASN 115 -19.020   6.358   6.358
  931   2HD2  ASN 115          1HD2      ASN 115 -17.366   5.980   5.980
  932    H    ASP 116           H        ASP 116 -14.030  10.071  10.071
  933    HA   ASP 116           HA       ASP 116 -15.935  12.100  12.100
  934   1HB   ASP 116          2HB       ASP 116 -12.972  12.057  12.057
  935   2HB   ASP 116          1HB       ASP 116 -13.708  13.410  13.410
  936    H    GLY 117           H        GLY 117 -13.541   9.907   9.907
  937   1HA   GLY 117          2HA       GLY 117 -14.147   9.291   9.291
  938   2HA   GLY 117          1HA       GLY 117 -14.097  11.023  11.023
  939    H    GLU 118           H        GLU 118 -11.705  10.777  10.777
  940    HA   GLU 118           HA       GLU 118  -9.571  11.103  11.103
  941   1HB   GLU 118          2HB       GLU 118  -9.464  10.100  10.100
  942   2HB   GLU 118          1HB       GLU 118  -8.090  10.717  10.717
  943   1HG   GLU 118          2HG       GLU 118  -8.972  12.912  12.912
  944   2HG   GLU 118          1HG       GLU 118 -10.589  12.366  12.366
  945    H    LEU 119           H        LEU 119  -7.603   9.517   9.517
  946    HA   LEU 119           HA       LEU 119  -8.471   6.678   6.678
  947   1HB   LEU 119          2HB       LEU 119  -9.022   7.591   7.591
  948   2HB   LEU 119          1HB       LEU 119  -7.319   7.966   7.966
  949    HG   LEU 119           HG       LEU 119  -8.249   5.167   5.167
  950   1HD1  LEU 119          3HD1      LEU 119  -8.309   6.673   6.673
  951   2HD1  LEU 119          2HD1      LEU 119  -7.914   4.954   4.954
  952   3HD1  LEU 119          1HD1      LEU 119  -9.461   5.498   5.498
  953   1HD2  LEU 119          2HD2      LEU 119  -5.758   6.500   6.500
  954   2HD2  LEU 119          1HD2      LEU 119  -5.924   5.193   5.193
  955   3HD2  LEU 119          3HD2      LEU 119  -6.111   4.862   4.862
  956    H    ILE 120           H        ILE 120  -6.923   5.806   5.806
  957    HA   ILE 120           HA       ILE 120  -4.094   6.688   6.688
  958    HB   ILE 120           HB       ILE 120  -4.831   6.939   6.939
  959   1HG1  ILE 120          2HG1      ILE 120  -3.079   4.472   4.472
  960   2HG1  ILE 120          1HG1      ILE 120  -2.496   6.104   6.104
  961   1HG2  ILE 120          1HG2      ILE 120  -5.655   4.054   4.054
  962   2HG2  ILE 120          3HG2      ILE 120  -5.384   4.751   4.751
  963   3HG2  ILE 120          2HG2      ILE 120  -6.637   5.413   5.413
  964   1HD1  ILE 120          1HD1      ILE 120  -3.655   6.578   6.578
  965   2HD1  ILE 120          3HD1      ILE 120  -3.310   4.863   4.863
  966   3HD1  ILE 120          2HD1      ILE 120  -1.996   5.989   5.989
  967    H    LEU 121           H        LEU 121  -2.461   4.948   4.948
  968    HA   LEU 121           HA       LEU 121  -3.606   2.308   2.308
  969   1HB   LEU 121          2HB       LEU 121  -3.207   3.634   3.634
  970   2HB   LEU 121          1HB       LEU 121  -1.542   3.920   3.920
  971    HG   LEU 121           HG       LEU 121  -2.407   1.069   1.069
  972   1HD1  LEU 121          1HD1      LEU 121  -2.294   2.929   2.929
  973   2HD1  LEU 121          3HD1      LEU 121  -1.739   1.266   1.266
  974   3HD1  LEU 121          2HD1      LEU 121  -3.399   1.590   1.590
  975   1HD2  LEU 121          3HD2      LEU 121  -0.051   2.275   2.275
  976   2HD2  LEU 121          2HD2      LEU 121  -0.157   0.718   0.718
  977   3HD2  LEU 121          1HD2      LEU 121   0.027   2.199   2.199
  978    H    THR 122           H        THR 122  -2.102   0.577   0.577
  979    HA   THR 122           HA       THR 122   0.441   1.207   1.207
  980    HB   THR 122           HB       THR 122  -0.554  -1.195  -1.195
  981    HG1  THR 122           HG1      THR 122  -2.402   0.950   0.950
  982   1HG2  THR 122          2HG2      THR 122   0.158   1.561   1.561
  983   2HG2  THR 122          1HG2      THR 122  -0.774   0.592   0.592
  984   3HG2  THR 122          3HG2      THR 122   0.785   0.010   0.010
  985    H    MET 123           H        MET 123   1.819  -0.884  -0.884
  986    HA   MET 123           HA       MET 123   1.123  -2.714  -2.714
  987   1HB   MET 123          2HB       MET 123   3.656  -1.044  -1.044
  988   2HB   MET 123          1HB       MET 123   3.199  -2.251  -2.251
  989   1HG   MET 123          2HG       MET 123   1.085  -0.870  -0.870
  990   2HG   MET 123          1HG       MET 123   1.861   0.400   0.400
  991   1HE   MET 123          1HE       MET 123   0.835  -0.430  -0.430
  992   2HE   MET 123          3HE       MET 123   2.086  -0.230  -0.230
  993   3HE   MET 123          2HE       MET 123   1.993  -1.722  -1.722
  994    H    THR 124           H        THR 124   2.779  -4.450  -4.450
  995    HA   THR 124           HA       THR 124   4.518  -4.828  -4.828
  996    HB   THR 124           HB       THR 124   2.597  -7.009  -7.009
  997    HG1  THR 124           HG1      THR 124   1.387  -6.310  -6.310
  998   1HG2  THR 124          3HG2      THR 124   4.672  -7.577  -7.577
  999   2HG2  THR 124          2HG2      THR 124   4.217  -6.433  -6.433
 1000   3HG2  THR 124          1HG2      THR 124   3.231  -7.867  -7.867
 1001    H    ALA 125           H        ALA 125   6.131  -6.391  -6.391
 1002    HA   ALA 125           HA       ALA 125   6.204  -7.880  -7.880
 1003   1HB   ALA 125          3HB       ALA 125   7.899  -5.441  -5.441
 1004   2HB   ALA 125          2HB       ALA 125   8.508  -6.763  -6.763
 1005   3HB   ALA 125          1HB       ALA 125   7.032  -5.917  -5.917
 1006    H    ASP 126           H        ASP 126   6.554  -9.734  -9.734
 1007    HA   ASP 126           HA       ASP 126   7.898 -11.378 -11.378
 1008   1HB   ASP 126          2HB       ASP 126   9.812  -9.528  -9.528
 1009   2HB   ASP 126          1HB       ASP 126  10.274  -9.879  -9.879
 1010    H    ASP 127           H        ASP 127   9.261  -8.541  -8.541
 1011    HA   ASP 127           HA       ASP 127   7.501  -9.042  -9.042
 1012   1HB   ASP 127          2HB       ASP 127   9.754 -10.425 -10.425
 1013   2HB   ASP 127          1HB       ASP 127  10.442  -8.870  -8.870
 1014    H    VAL 128           H        VAL 128   8.129  -6.915  -6.915
 1015    HA   VAL 128           HA       VAL 128   8.749  -4.705  -4.705
 1016    HB   VAL 128           HB       VAL 128   9.579  -3.420  -3.420
 1017   1HG1  VAL 128          3HG1      VAL 128  10.682  -6.175  -6.175
 1018   2HG1  VAL 128          2HG1      VAL 128  11.415  -5.140  -5.140
 1019   3HG1  VAL 128          1HG1      VAL 128  11.361  -4.613  -4.613
 1020   1HG2  VAL 128          2HG2      VAL 128   8.288  -5.626  -5.626
 1021   2HG2  VAL 128          1HG2      VAL 128   8.538  -3.946  -3.946
 1022   3HG2  VAL 128          3HG2      VAL 128   9.848  -5.114  -5.114
 1023    H    VAL 129           H        VAL 129   7.695  -2.587  -2.587
 1024    HA   VAL 129           HA       VAL 129   5.153  -3.161  -3.161
 1025    HB   VAL 129           HB       VAL 129   5.361  -2.611  -2.611
 1026   1HG1  VAL 129          3HG1      VAL 129   3.351  -1.297  -1.297
 1027   2HG1  VAL 129          2HG1      VAL 129   2.818  -1.883  -1.883
 1028   3HG1  VAL 129          1HG1      VAL 129   4.100  -0.676  -0.676
 1029   1HG2  VAL 129          3HG2      VAL 129   3.847  -4.356  -4.356
 1030   2HG2  VAL 129          2HG2      VAL 129   4.608  -4.748  -4.748
 1031   3HG2  VAL 129          1HG2      VAL 129   3.050  -3.922  -3.922
 1032    H    CYS 130           H        CYS 130   4.971  -1.579  -1.579
 1033    HA   CYS 130           HA       CYS 130   6.206   1.078   1.078
 1034   1HB   CYS 130          2HB       CYS 130   6.369  -0.453  -0.453
 1035   2HB   CYS 130          1HB       CYS 130   4.931   0.477   0.477
 1036    HG   CYS 130           HG       CYS 130   6.837   1.988   1.988
 1037    H    THR 131           H        THR 131   4.871   2.662   2.662
 1038    HA   THR 131           HA       THR 131   1.962   2.458   2.458
 1039    HB   THR 131           HB       THR 131   3.287   3.584   3.584
 1040    HG1  THR 131           HG1      THR 131   3.142   1.576   1.576
 1041   1HG2  THR 131          3HG2      THR 131   0.609   3.930   3.930
 1042   2HG2  THR 131          2HG2      THR 131   0.585   3.313   3.313
 1043   3HG2  THR 131          1HG2      THR 131   1.406   4.830   4.830
 1044    H    ARG 132           H        ARG 132   0.930   4.355   4.355
 1045    HA   ARG 132           HA       ARG 132   2.396   6.907   6.907
 1046   1HB   ARG 132          2HB       ARG 132   1.269   5.706   5.706
 1047   2HB   ARG 132          1HB       ARG 132   2.141   7.230   7.230
 1048   1HG   ARG 132          2HG       ARG 132   4.099   5.859   5.859
 1049   2HG   ARG 132          1HG       ARG 132   3.225   4.430   4.430
 1050   1HD   ARG 132          2HD       ARG 132   3.936   6.781   6.781
 1051   2HD   ARG 132          1HD       ARG 132   4.873   5.290   5.290
 1052    HE   ARG 132           HE       ARG 132   2.016   5.337   5.337
 1053   1HH1  ARG 132          2HH1      ARG 132   3.930   2.892   2.892
 1054   2HH1  ARG 132          1HH1      ARG 132   4.236   2.351   2.351
 1055   1HH2  ARG 132          1HH2      ARG 132   2.984   5.225   5.225
 1056   2HH2  ARG 132          2HH2      ARG 132   3.701   3.672   3.672
 1057    H    VAL 133           H        VAL 133   0.853   8.381   8.381
 1058    HA   VAL 133           HA       VAL 133  -1.996   7.651   7.651
 1059    HB   VAL 133           HB       VAL 133  -0.671  10.198  10.198
 1060   1HG1  VAL 133          2HG1      VAL 133  -3.465   9.093   9.093
 1061   2HG1  VAL 133          1HG1      VAL 133  -2.879  10.184  10.184
 1062   3HG1  VAL 133          3HG1      VAL 133  -2.943  10.723  10.723
 1063   1HG2  VAL 133          2HG2      VAL 133  -1.377   7.606   7.606
 1064   2HG2  VAL 133          1HG2      VAL 133   0.180   8.434   8.434
 1065   3HG2  VAL 133          3HG2      VAL 133  -1.163   9.108   9.108
 1066    H    TYR 134           H        TYR 134  -3.527   8.569   8.569
 1067    HA   TYR 134           HA       TYR 134  -2.466  10.589  10.589
 1068   1HB   TYR 134          2HB       TYR 134  -3.975   8.050   8.050
 1069   2HB   TYR 134          1HB       TYR 134  -4.191   9.424   9.424
 1070    HD1  TYR 134           HD2      TYR 134  -2.339  10.296  10.296
 1071    HD2  TYR 134           HD1      TYR 134  -1.825   6.901   6.901
 1072    HE1  TYR 134           HE2      TYR 134  -0.205   9.749   9.749
 1073    HE2  TYR 134           HE1      TYR 134   0.308   6.354   6.354
 1074    HH   TYR 134           HH       TYR 134   1.242   7.802   7.802
 1075    H    VAL 135           H        VAL 135  -3.660  12.372  12.372
 1076    HA   VAL 135           HA       VAL 135  -6.463  12.230  12.230
 1077    HB   VAL 135           HB       VAL 135  -4.347  13.968  13.968
 1078   1HG1  VAL 135          2HG1      VAL 135  -4.891  15.269  15.269
 1079   2HG1  VAL 135          1HG1      VAL 135  -6.489  15.571  15.571
 1080   3HG1  VAL 135          3HG1      VAL 135  -5.053  16.193  16.193
 1081   1HG2  VAL 135          3HG2      VAL 135  -6.582  13.154  13.154
 1082   2HG2  VAL 135          2HG2      VAL 135  -5.844  14.676  14.676
 1083   3HG2  VAL 135          1HG2      VAL 135  -7.210  14.682  14.682
 1084    H    ARG 136           H        ARG 136  -8.124  12.892  12.892
 1085    HA   ARG 136           HA       ARG 136  -7.759  12.641  12.641
 1086   1HB   ARG 136          2HB       ARG 136  -9.882  13.505  13.505
 1087   2HB   ARG 136          1HB       ARG 136  -9.836  14.527  14.527
 1088   1HG   ARG 136          2HG       ARG 136 -10.227  12.773  12.773
 1089   2HG   ARG 136          1HG       ARG 136  -9.554  11.574  11.574
 1090   1HD   ARG 136          2HD       ARG 136 -12.240  12.960  12.960
 1091   2HD   ARG 136          1HD       ARG 136 -11.943  11.241  11.241
 1092    HE   ARG 136           HE       ARG 136 -10.680  11.792  11.792
 1093   1HH1  ARG 136          1HH2      ARG 136 -13.467  10.412  10.412
 1094   2HH1  ARG 136          2HH2      ARG 136 -14.445  11.083  11.083
 1095   1HH2  ARG 136          2HH1      ARG 136 -12.093  13.463  13.463
 1096   2HH2  ARG 136          1HH1      ARG 136 -13.667  12.815  12.815
 1097    H    GLU 137           HN       GLU 137  -6.841  13.779  13.779
 1098    HA   GLU 137           HA       GLU 137  -5.552  15.458  15.458
 1099   1HB   GLU 137          2HB       GLU 137  -8.068  15.996  15.996
 1100   2HB   GLU 137          1HB       GLU 137  -7.731  17.294  17.294
 1101   1HG   GLU 137          2HG       GLU 137  -5.875  18.057  18.057
 1102   2HG   GLU 137          1HG       GLU 137  -6.404  16.850  16.850

  Start of MODEL   18
    1   1H    PRO   1          1H        PRO   1  16.649   7.377   7.377
    2   2H    PRO   1          2H        PRO   1  16.159   6.605   6.605
    3    HA   PRO   1           HA       PRO   1  16.465   4.613   4.613
    4   1HB   PRO   1          2HB       PRO   1  19.116   4.779   4.779
    5   2HB   PRO   1          1HB       PRO   1  18.600   3.996   3.996
    6   1HG   PRO   1          2HG       PRO   1  20.080   6.429   6.429
    7   2HG   PRO   1          1HG       PRO   1  19.558   5.642   5.642
    8   1HD   PRO   1          1HD       PRO   1  18.525   8.039   8.039
    9   2HD   PRO   1          2HD       PRO   1  18.010   7.250   7.250
   10    H    ASN   2           H        ASN   2  15.268   6.536   6.536
   11    HA   ASN   2           HA       ASN   2  15.811   5.308   5.308
   12   1HB   ASN   2          2HB       ASN   2  16.301   8.221   8.221
   13   2HB   ASN   2          1HB       ASN   2  15.857   7.696   7.696
   14   1HD2  ASN   2          2HD2      ASN   2  19.660   7.320   7.320
   15   2HD2  ASN   2          1HD2      ASN   2  18.530   8.320   8.320
   16    H    PHE   3           H        PHE   3  13.873   4.909   4.909
   17    HA   PHE   3           HA       PHE   3  11.483   6.364   6.364
   18   1HB   PHE   3          2HB       PHE   3  11.789   3.847   3.847
   19   2HB   PHE   3          1HB       PHE   3  10.253   4.543   4.543
   20    HD1  PHE   3           HD1      PHE   3  13.509   3.644   3.644
   21    HD2  PHE   3           HD2      PHE   3   9.215   3.476   3.476
   22    HE1  PHE   3           HE1      PHE   3  13.598   2.372   2.372
   23    HE2  PHE   3           HE2      PHE   3   9.313   2.194   2.194
   24    HZ   PHE   3           HZ       PHE   3  11.504   1.639   1.639
   25    H    SER   4           H        SER   4  13.664   6.501   6.501
   26    HA   SER   4           HA       SER   4  11.846   6.906   6.906
   27   1HB   SER   4          2HB       SER   4  13.771   7.523   7.523
   28   2HB   SER   4          1HB       SER   4  14.311   6.284   6.284
   29    HG   SER   4           HG       SER   4  15.753   7.960   7.960
   30    H    GLY   5           H        GLY   5  10.532   8.570   8.570
   31   1HA   GLY   5          2HA       GLY   5  11.137  11.240  11.240
   32   2HA   GLY   5          1HA       GLY   5  10.810  11.081  11.081
   33    H    ASN   6           H        ASN   6   8.939  12.601  12.601
   34    HA   ASN   6           HA       ASN   6   6.700  10.951  10.951
   35   1HB   ASN   6          2HB       ASN   6   7.158  13.926  13.926
   36   2HB   ASN   6          1HB       ASN   6   5.527  13.279  13.279
   37   1HD2  ASN   6          2HD2      ASN   6   6.419  11.880  11.880
   38   2HD2  ASN   6          1HD2      ASN   6   5.763  11.297  11.297
   39    H    TRP   7           H        TRP   7   4.560  11.485  11.485
   40    HA   TRP   7           HA       TRP   7   5.145  11.855  11.855
   41   1HB   TRP   7          2HB       TRP   7   4.065   9.303   9.303
   42   2HB   TRP   7          1HB       TRP   7   4.054   9.657   9.657
   43    HD1  TRP   7           HD1      TRP   7   6.265   8.427   8.427
   44    HE1  TRP   7           HE1      TRP   7   8.678   8.102   8.102
   45    HE3  TRP   7           HE3      TRP   7   5.838  10.740  10.740
   46    HZ2  TRP   7           HZ2      TRP   7  10.215   8.777   8.777
   47    HZ3  TRP   7           HZ3      TRP   7   7.781  10.922  10.922
   48    HH2  TRP   7           HH2      TRP   7   9.953   9.940   9.940
   49    H    LYS   8           H        LYS   8   3.607  13.025  13.025
   50    HA   LYS   8           HA       LYS   8   0.843  12.883  12.883
   51   1HB   LYS   8          2HB       LYS   8   2.461  15.188  15.188
   52   2HB   LYS   8          1HB       LYS   8   0.703  15.219  15.219
   53   1HG   LYS   8          2HG       LYS   8   0.552  14.755  14.755
   54   2HG   LYS   8          1HG       LYS   8   2.304  14.933  14.933
   55   1HD   LYS   8          2HD       LYS   8   1.707  17.108  17.108
   56   2HD   LYS   8          1HD       LYS   8   1.747  17.214  17.214
   57   1HE   LYS   8          2HE       LYS   8  -0.753  16.449  16.449
   58   2HE   LYS   8          1HE       LYS   8  -0.633  17.011  17.011
   59   1HZ   LYS   8          1HZ       LYS   8   0.340  19.116  19.116
   60   2HZ   LYS   8          3HZ       LYS   8  -0.306  18.558  18.558
   61   3HZ   LYS   8          2HZ       LYS   8  -1.334  18.868  18.868
   62    H    ILE   9           H        ILE   9  -0.356  11.737  11.737
   63    HA   ILE   9           HA       ILE   9   0.264  10.903  10.903
   64    HB   ILE   9           HB       ILE   9  -1.457   9.890   9.890
   65   1HG1  ILE   9          2HG1      ILE   9  -2.555  11.066  11.066
   66   2HG1  ILE   9          1HG1      ILE   9  -1.662   9.556   9.556
   67   1HG2  ILE   9          1HG2      ILE   9  -2.911  12.521  12.521
   68   2HG2  ILE   9          3HG2      ILE   9  -3.669  11.078  11.078
   69   3HG2  ILE   9          2HG2      ILE   9  -2.340  11.855  11.855
   70   1HD1  ILE   9          3HD1      ILE   9  -3.475   8.670   8.670
   71   2HD1  ILE   9          2HD1      ILE   9  -4.379  10.163  10.163
   72   3HD1  ILE   9          1HD1      ILE   9  -4.063   9.081   9.081
   73    H    ILE  10           H        ILE  10  -0.472  11.554  11.554
   74    HA   ILE  10           HA       ILE  10  -1.469  14.354  14.354
   75    HB   ILE  10           HB       ILE  10   0.061  14.716  14.716
   76   1HG1  ILE  10          2HG1      ILE  10   2.015  12.813  12.813
   77   2HG1  ILE  10          1HG1      ILE  10   0.586  11.832  11.832
   78   1HG2  ILE  10          2HG2      ILE  10   1.260  13.836  13.836
   79   2HG2  ILE  10          1HG2      ILE  10   2.219  14.604  14.604
   80   3HG2  ILE  10          3HG2      ILE  10   0.878  15.476  15.476
   81   1HD1  ILE  10          2HD1      ILE  10  -0.411  13.149  13.149
   82   2HD1  ILE  10          1HD1      ILE  10   1.289  13.398  13.398
   83   3HD1  ILE  10          3HD1      ILE  10   0.645  11.762  11.762
   84    H    ARG  11           H        ARG  11  -1.476  11.071  11.071
   85    HA   ARG  11           HA       ARG  11  -3.871  11.753  11.753
   86   1HB   ARG  11          2HB       ARG  11  -1.225  11.127  11.127
   87   2HB   ARG  11          1HB       ARG  11  -2.601  10.281  10.281
   88   1HG   ARG  11          2HG       ARG  11  -3.708  12.678  12.678
   89   2HG   ARG  11          1HG       ARG  11  -2.031  13.223  13.223
   90   1HD   ARG  11          2HD       ARG  11  -2.857  11.151  11.151
   91   2HD   ARG  11          1HD       ARG  11  -3.208  12.852  12.852
   92    HE   ARG  11           HE       ARG  11  -0.498  11.658  11.658
   93   1HH1  ARG  11          1HH2      ARG  11  -0.265  14.298  14.298
   94   2HH1  ARG  11          2HH2      ARG  11  -0.053  15.350  15.350
   95   1HH2  ARG  11          2HH1      ARG  11  -1.227  13.039  13.039
   96   2HH2  ARG  11          1HH1      ARG  11  -0.599  14.637  14.637
   97    H    SER  12           H        SER  12  -4.526   9.588   9.588
   98    HA   SER  12           HA       SER  12  -3.884   7.007   7.007
   99   1HB   SER  12          2HB       SER  12  -4.452   7.502   7.502
  100   2HB   SER  12          1HB       SER  12  -5.890   8.397   8.397
  101    HG   SER  12           HG       SER  12  -6.923   6.580   6.580
  102    H    GLU  13           H        GLU  13  -5.870   5.471   5.471
  103    HA   GLU  13           HA       GLU  13  -8.082   6.699   6.699
  104   1HB   GLU  13          2HB       GLU  13  -7.471   5.908   5.908
  105   2HB   GLU  13          1HB       GLU  13  -6.214   6.970   6.970
  106   1HG   GLU  13          2HG       GLU  13  -5.535   4.352   4.352
  107   2HG   GLU  13          1HG       GLU  13  -6.001   4.213   4.213
  108    H    ASN  14           H        ASN  14  -7.648   4.554   4.554
  109    HA   ASN  14           HA       ASN  14  -9.560   2.664   2.664
  110   1HB   ASN  14          2HB       ASN  14  -7.424   0.963   0.963
  111   2HB   ASN  14          1HB       ASN  14  -8.231   0.938   0.938
  112   1HD2  ASN  14          2HD2      ASN  14  -5.238   1.945   1.945
  113   2HD2  ASN  14          1HD2      ASN  14  -6.593   0.939   0.939
  114    H    PHE  15           H        PHE  15  -9.499   4.455   4.455
  115    HA   PHE  15           HA       PHE  15  -8.965   2.972   2.972
  116   1HB   PHE  15          2HB       PHE  15  -8.925   5.521   5.521
  117   2HB   PHE  15          1HB       PHE  15 -10.678   5.443   5.443
  118    HD1  PHE  15           HD2      PHE  15 -10.175   2.896   2.896
  119    HD2  PHE  15           HD1      PHE  15  -9.394   7.113   7.113
  120    HE1  PHE  15           HE2      PHE  15 -10.239   3.034   3.034
  121    HE2  PHE  15           HE1      PHE  15  -9.451   7.217   7.217
  122    HZ   PHE  15           HZ       PHE  15  -9.866   5.145   5.145
  123    H    GLU  16           H        GLU  16 -12.022   4.301   4.301
  124    HA   GLU  16           HA       GLU  16 -13.742   2.844   2.844
  125   1HB   GLU  16          2HB       GLU  16 -14.028   4.257   4.257
  126   2HB   GLU  16          1HB       GLU  16 -15.321   3.152   3.152
  127   1HG   GLU  16          2HG       GLU  16 -15.451   4.321   4.321
  128   2HG   GLU  16          1HG       GLU  16 -14.270   5.489   5.489
  129    H    GLU  17           H        GLU  17 -12.158   1.866   1.866
  130    HA   GLU  17           HA       GLU  17 -13.850  -0.465  -0.465
  131   1HB   GLU  17          2HB       GLU  17 -12.173  -1.212  -1.212
  132   2HB   GLU  17          1HB       GLU  17 -12.654   0.463   0.463
  133   1HG   GLU  17          2HG       GLU  17 -10.457   0.951   0.951
  134   2HG   GLU  17          1HG       GLU  17 -10.535   0.693   0.693
  135    H    LEU  18           H        LEU  18 -10.879   0.178   0.178
  136    HA   LEU  18           HA       LEU  18 -10.303  -2.630  -2.630
  137   1HB   LEU  18          2HB       LEU  18  -8.551  -0.807  -0.807
  138   2HB   LEU  18          1HB       LEU  18  -9.248  -0.190  -0.190
  139    HG   LEU  18           HG       LEU  18  -8.864  -2.417  -2.417
  140   1HD1  LEU  18          2HD1      LEU  18  -7.903  -2.993  -2.993
  141   2HD1  LEU  18          1HD1      LEU  18  -7.030  -3.739  -3.739
  142   3HD1  LEU  18          3HD1      LEU  18  -8.755  -4.042  -4.042
  143   1HD2  LEU  18          2HD2      LEU  18  -7.156  -0.420  -0.420
  144   2HD2  LEU  18          1HD2      LEU  18  -6.619  -1.978  -1.978
  145   3HD2  LEU  18          3HD2      LEU  18  -6.244  -1.520  -1.520
  146    H    LEU  19           H        LEU  19 -12.414  -0.263  -0.263
  147    HA   LEU  19           HA       LEU  19 -12.506  -1.692  -1.692
  148   1HB   LEU  19          2HB       LEU  19 -14.336   0.559   0.559
  149   2HB   LEU  19          1HB       LEU  19 -13.952   0.047   0.047
  150    HG   LEU  19           HG       LEU  19 -12.352   1.734   1.734
  151   1HD1  LEU  19          3HD1      LEU  19 -13.768   2.219   2.219
  152   2HD1  LEU  19          2HD1      LEU  19 -12.152   1.985   1.985
  153   3HD1  LEU  19          1HD1      LEU  19 -12.431   3.219   3.219
  154   1HD2  LEU  19          2HD2      LEU  19 -11.190  -0.383  -0.383
  155   2HD2  LEU  19          1HD2      LEU  19 -10.506   0.389   0.389
  156   3HD2  LEU  19          3HD2      LEU  19 -10.452   1.203   1.203
  157    H    LYS  20           H        LYS  20 -14.118  -1.667  -1.667
  158    HA   LYS  20           HA       LYS  20 -16.577  -2.937  -2.937
  159   1HB   LYS  20          2HB       LYS  20 -15.701  -3.128  -3.128
  160   2HB   LYS  20          1HB       LYS  20 -17.326  -2.975  -2.975
  161   1HG   LYS  20          2HG       LYS  20 -16.061  -0.628  -0.628
  162   2HG   LYS  20          1HG       LYS  20 -15.446  -0.899  -0.899
  163   1HD   LYS  20          2HD       LYS  20 -18.368  -0.828  -0.828
  164   2HD   LYS  20          1HD       LYS  20 -17.502   0.456   0.456
  165   1HE   LYS  20          2HE       LYS  20 -16.912  -1.409  -1.409
  166   2HE   LYS  20          1HE       LYS  20 -18.282  -2.263  -2.263
  167   1HZ   LYS  20          1HZ       LYS  20 -19.649  -0.292  -0.292
  168   2HZ   LYS  20          3HZ       LYS  20 -18.330   0.460   0.460
  169   3HZ   LYS  20          2HZ       LYS  20 -19.008  -0.944  -0.944
  170    H    VAL  21           H        VAL  21 -13.461  -3.841  -3.841
  171    HA   VAL  21           HA       VAL  21 -14.115  -6.652  -6.652
  172    HB   VAL  21           HB       VAL  21 -12.370  -5.425  -5.425
  173   1HG1  VAL  21          2HG1      VAL  21 -11.500  -4.064  -4.064
  174   2HG1  VAL  21          1HG1      VAL  21 -10.758  -5.504  -5.504
  175   3HG1  VAL  21          3HG1      VAL  21 -10.231  -4.896  -4.896
  176   1HG2  VAL  21          2HG2      VAL  21 -11.814  -7.903  -7.903
  177   2HG2  VAL  21          1HG2      VAL  21 -12.032  -7.714  -7.714
  178   3HG2  VAL  21          3HG2      VAL  21 -10.512  -7.235  -7.235
  179    H    LEU  22           H        LEU  22 -12.421  -4.681  -4.681
  180    HA   LEU  22           HA       LEU  22 -11.532  -6.781  -6.781
  181   1HB   LEU  22          2HB       LEU  22 -11.811  -3.833  -3.833
  182   2HB   LEU  22          1HB       LEU  22 -11.884  -4.584  -4.584
  183    HG   LEU  22           HG       LEU  22  -9.710  -5.586  -5.586
  184   1HD1  LEU  22          2HD1      LEU  22 -10.012  -6.076  -6.076
  185   2HD1  LEU  22          1HD1      LEU  22  -9.641  -4.385  -4.385
  186   3HD1  LEU  22          3HD1      LEU  22  -8.432  -5.427  -5.427
  187   1HD2  LEU  22          1HD2      LEU  22  -9.797  -3.206  -3.206
  188   2HD2  LEU  22          3HD2      LEU  22  -8.347  -3.546  -3.546
  189   3HD2  LEU  22          2HD2      LEU  22  -9.718  -2.730  -2.730
  190    H    GLY  23           H        GLY  23 -14.266  -4.562  -4.562
  191   1HA   GLY  23          2HA       GLY  23 -15.545  -6.237  -6.237
  192   2HA   GLY  23          1HA       GLY  23 -15.969  -4.567  -4.567
  193    H    VAL  24           H        VAL  24 -18.170  -5.140  -5.140
  194    HA   VAL  24           HA       VAL  24 -18.917  -6.156  -6.156
  195    HB   VAL  24           HB       VAL  24 -20.108  -7.346  -7.346
  196   1HG1  VAL  24          2HG1      VAL  24 -21.431  -7.131  -7.131
  197   2HG1  VAL  24          1HG1      VAL  24 -20.340  -8.388  -8.388
  198   3HG1  VAL  24          3HG1      VAL  24 -21.390  -8.703  -8.703
  199   1HG2  VAL  24          1HG2      VAL  24 -18.010  -8.384  -8.384
  200   2HG2  VAL  24          3HG2      VAL  24 -17.870  -8.195  -8.195
  201   3HG2  VAL  24          2HG2      VAL  24 -18.924  -9.440  -9.440
  202    H    ASN  25           H        ASN  25 -19.973  -4.747  -4.747
  203    HA   ASN  25           HA       ASN  25 -22.580  -3.949  -3.949
  204   1HB   ASN  25          2HB       ASN  25 -21.147  -3.813  -3.813
  205   2HB   ASN  25          1HB       ASN  25 -21.072  -2.136  -2.136
  206   1HD2  ASN  25          2HD2      ASN  25 -24.377  -1.495  -1.495
  207   2HD2  ASN  25          1HD2      ASN  25 -22.854  -0.880  -0.880
  208    H    VAL  26           H        VAL  26 -22.548  -1.115  -1.115
  209    HA   VAL  26           HA       VAL  26 -21.038  -0.143  -0.143
  210    HB   VAL  26           HB       VAL  26 -23.684   1.072   1.072
  211   1HG1  VAL  26          2HG1      VAL  26 -21.953   1.842   1.842
  212   2HG1  VAL  26          1HG1      VAL  26 -22.515   0.456   0.456
  213   3HG1  VAL  26          3HG1      VAL  26 -23.644   1.734   1.734
  214   1HG2  VAL  26          3HG2      VAL  26 -23.254  -1.647  -1.647
  215   2HG2  VAL  26          2HG2      VAL  26 -24.541  -1.092  -1.092
  216   3HG2  VAL  26          1HG2      VAL  26 -24.553  -0.635  -0.635
  217    H    MET  27           H        MET  27 -22.771   0.836   0.836
  218    HA   MET  27           HA       MET  27 -21.618   3.475   3.475
  219   1HB   MET  27          2HB       MET  27 -23.661   2.590   2.590
  220   2HB   MET  27          1HB       MET  27 -22.501   1.852   1.852
  221   1HG   MET  27          2HG       MET  27 -21.476   4.074   4.074
  222   2HG   MET  27          1HG       MET  27 -22.672   4.802   4.802
  223   1HE   MET  27          2HE       MET  27 -24.489   5.991   5.991
  224   2HE   MET  27          1HE       MET  27 -24.878   6.107   6.107
  225   3HE   MET  27          3HE       MET  27 -23.240   6.465   6.465
  226    H    LEU  28           H        LEU  28 -20.584   0.305   0.305
  227    HA   LEU  28           HA       LEU  28 -18.508   0.997   0.997
  228   1HB   LEU  28          2HB       LEU  28 -19.360  -1.316  -1.316
  229   2HB   LEU  28          1HB       LEU  28 -17.626  -1.272  -1.272
  230    HG   LEU  28           HG       LEU  28 -18.786  -2.513  -2.513
  231   1HD1  LEU  28          1HD1      LEU  28 -16.804  -0.797  -0.797
  232   2HD1  LEU  28          3HD1      LEU  28 -18.029   0.066   0.066
  233   3HD1  LEU  28          2HD1      LEU  28 -17.592  -1.586  -1.586
  234   1HD2  LEU  28          2HD2      LEU  28 -20.235   0.111   0.111
  235   2HD2  LEU  28          1HD2      LEU  28 -20.960  -1.365  -1.365
  236   3HD2  LEU  28          3HD2      LEU  28 -20.357  -1.323  -1.323
  237    H    ARG  29           H        ARG  29 -18.628   1.086   1.086
  238    HA   ARG  29           HA       ARG  29 -15.706   1.449   1.449
  239   1HB   ARG  29          2HB       ARG  29 -17.797   1.665   1.665
  240   2HB   ARG  29          1HB       ARG  29 -16.058   1.480   1.480
  241   1HG   ARG  29          2HG       ARG  29 -16.469  -0.746  -0.746
  242   2HG   ARG  29          1HG       ARG  29 -16.690  -0.661  -0.661
  243   1HD   ARG  29          2HD       ARG  29 -18.778  -1.444  -1.444
  244   2HD   ARG  29          1HD       ARG  29 -19.143   0.186   0.186
  245    HE   ARG  29           HE       ARG  29 -18.301  -2.039  -2.039
  246   1HH1  ARG  29          2HH1      ARG  29 -18.507   1.143   1.143
  247   2HH1  ARG  29          1HH1      ARG  29 -19.893   1.161   1.161
  248   1HH2  ARG  29          1HH2      ARG  29 -20.733  -2.144  -2.144
  249   2HH2  ARG  29          2HH2      ARG  29 -21.152  -0.699  -0.699
  250    H    LYS  30           H        LYS  30 -18.652   3.364   3.364
  251    HA   LYS  30           HA       LYS  30 -17.348   5.729   5.729
  252   1HB   LYS  30          2HB       LYS  30 -19.806   5.258   5.258
  253   2HB   LYS  30          1HB       LYS  30 -19.958   5.577   5.577
  254   1HG   LYS  30          2HG       LYS  30 -19.596   7.839   7.839
  255   2HG   LYS  30          1HG       LYS  30 -18.554   7.628   7.628
  256   1HD   LYS  30          2HD       LYS  30 -20.851   6.726   6.726
  257   2HD   LYS  30          1HD       LYS  30 -21.523   7.825   7.825
  258   1HE   LYS  30          2HE       LYS  30 -20.695   9.693   9.693
  259   2HE   LYS  30          1HE       LYS  30 -19.249   8.861   8.861
  260   1HZ   LYS  30          1HZ       LYS  30 -20.818   7.615   7.615
  261   2HZ   LYS  30          3HZ       LYS  30 -21.974   8.796   8.796
  262   3HZ   LYS  30          2HZ       LYS  30 -20.520   9.245   9.245
  263    H    ILE  31           H        ILE  31 -17.763   4.436   4.436
  264    HA   ILE  31           HA       ILE  31 -17.149   6.985   6.985
  265    HB   ILE  31           HB       ILE  31 -17.322   4.138   4.138
  266   1HG1  ILE  31          2HG1      ILE  31 -19.445   5.138   5.138
  267   2HG1  ILE  31          1HG1      ILE  31 -19.466   4.905   4.905
  268   1HG2  ILE  31          1HG2      ILE  31 -16.515   6.708   6.708
  269   2HG2  ILE  31          3HG2      ILE  31 -17.610   5.675   5.675
  270   3HG2  ILE  31          2HG2      ILE  31 -16.043   5.056   5.056
  271   1HD1  ILE  31          3HD1      ILE  31 -18.388   7.480   7.480
  272   2HD1  ILE  31          2HD1      ILE  31 -19.736   7.361   7.361
  273   3HD1  ILE  31          1HD1      ILE  31 -20.003   7.088   7.088
  274    H    ALA  32           H        ALA  32 -15.417   4.214   4.214
  275    HA   ALA  32           HA       ALA  32 -12.938   4.824   4.824
  276   1HB   ALA  32          3HB       ALA  32 -13.779   2.859   2.859
  277   2HB   ALA  32          2HB       ALA  32 -12.065   3.136   3.136
  278   3HB   ALA  32          1HB       ALA  32 -13.113   2.544   2.544
  279    H    VAL  33           H        VAL  33 -14.457   5.660   5.660
  280    HA   VAL  33           HA       VAL  33 -12.021   6.642   6.642
  281    HB   VAL  33           HB       VAL  33 -14.824   7.386   7.386
  282   1HG1  VAL  33          3HG1      VAL  33 -12.157   7.006   7.006
  283   2HG1  VAL  33          2HG1      VAL  33 -13.667   7.109   7.109
  284   3HG1  VAL  33          1HG1      VAL  33 -13.141   8.467   8.467
  285   1HG2  VAL  33          3HG2      VAL  33 -13.770   4.688   4.688
  286   2HG2  VAL  33          2HG2      VAL  33 -15.364   5.213   5.213
  287   3HG2  VAL  33          1HG2      VAL  33 -14.043   5.093   5.093
  288    H    ALA  34           H        ALA  34 -14.908   8.021   8.021
  289    HA   ALA  34           HA       ALA  34 -14.106  10.761  10.761
  290   1HB   ALA  34          1HB       ALA  34 -16.445   9.934   9.934
  291   2HB   ALA  34          3HB       ALA  34 -15.859   9.587   9.587
  292   3HB   ALA  34          2HB       ALA  34 -15.869  11.246  11.246
  293    H    ALA  35           H        ALA  35 -13.601   8.255   8.255
  294    HA   ALA  35           HA       ALA  35 -12.379   9.829   9.829
  295   1HB   ALA  35          1HB       ALA  35 -12.071   6.925   6.925
  296   2HB   ALA  35          3HB       ALA  35 -11.297   7.602   7.602
  297   3HB   ALA  35          2HB       ALA  35 -13.056   7.570   7.570
  298    H    ALA  36           H        ALA  36 -10.895   7.865   7.865
  299    HA   ALA  36           HA       ALA  36  -8.261   9.077   9.077
  300   1HB   ALA  36          2HB       ALA  36  -9.386   6.864   6.864
  301   2HB   ALA  36          1HB       ALA  36  -7.919   7.622   7.622
  302   3HB   ALA  36          3HB       ALA  36  -7.937   6.888   6.888
  303    H    SER  37           H        SER  37  -9.948  11.164  11.164
  304    HA   SER  37           HA       SER  37 -10.194  11.696  11.696
  305   1HB   SER  37          2HB       SER  37 -10.348  14.095  14.095
  306   2HB   SER  37          1HB       SER  37 -11.415  13.040  13.040
  307    HG   SER  37           HG       SER  37 -10.059  13.156  13.156
  308    H    LYS  38           H        LYS  38  -7.621  12.123  12.123
  309    HA   LYS  38           HA       LYS  38  -5.584  12.234  12.234
  310   1HB   LYS  38          2HB       LYS  38  -6.396  14.710  14.710
  311   2HB   LYS  38          1HB       LYS  38  -4.701  14.471  14.471
  312   1HG   LYS  38          2HG       LYS  38  -5.630  13.973  13.973
  313   2HG   LYS  38          1HG       LYS  38  -7.074  14.811  14.811
  314   1HD   LYS  38          2HD       LYS  38  -5.354  16.630  16.630
  315   2HD   LYS  38          1HD       LYS  38  -4.297  15.883  15.883
  316   1HE   LYS  38          2HE       LYS  38  -5.568  16.601  16.601
  317   2HE   LYS  38          1HE       LYS  38  -7.079  16.474  16.474
  318   1HZ   LYS  38          2HZ       LYS  38  -6.262  18.434  18.434
  319   2HZ   LYS  38          1HZ       LYS  38  -5.048  18.623  18.623
  320   3HZ   LYS  38          3HZ       LYS  38  -6.680  18.757  18.757
  321    HA   PRO  39           HA       PRO  39  -4.660  10.481  10.481
  322   1HB   PRO  39          2HB       PRO  39  -3.788   8.039   8.039
  323   2HB   PRO  39          1HB       PRO  39  -5.470   8.405   8.405
  324   1HG   PRO  39          2HG       PRO  39  -4.212   8.128   8.128
  325   2HG   PRO  39          1HG       PRO  39  -5.886   7.824   7.824
  326   1HD   PRO  39          2HD       PRO  39  -4.981  10.116  10.116
  327   2HD   PRO  39          1HD       PRO  39  -6.527   9.966   9.966
  328    H    ALA  40           H        ALA  40  -2.694  10.767  10.767
  329    HA   ALA  40           HA       ALA  40  -0.376  11.337  11.337
  330   1HB   ALA  40          1HB       ALA  40  -0.698  11.455  11.455
  331   2HB   ALA  40          3HB       ALA  40   0.712  12.018  12.018
  332   3HB   ALA  40          2HB       ALA  40  -0.845  12.822  12.822
  333    H    VAL  41           H        VAL  41   1.784  10.426  10.426
  334    HA   VAL  41           HA       VAL  41   1.553   7.713   7.713
  335    HB   VAL  41           HB       VAL  41   2.365   8.308   8.308
  336   1HG1  VAL  41          2HG1      VAL  41   3.113   5.860   5.860
  337   2HG1  VAL  41          1HG1      VAL  41   3.257   5.979   5.979
  338   3HG1  VAL  41          3HG1      VAL  41   4.232   7.020   7.020
  339   1HG2  VAL  41          1HG2      VAL  41   0.495   6.396   6.396
  340   2HG2  VAL  41          3HG2      VAL  41   0.104   7.632   7.632
  341   3HG2  VAL  41          2HG2      VAL  41   0.972   6.176   6.176
  342    H    GLU  42           H        GLU  42   3.781   6.830   6.830
  343    HA   GLU  42           HA       GLU  42   5.991   8.789   8.789
  344   1HB   GLU  42          2HB       GLU  42   4.847   9.458   9.458
  345   2HB   GLU  42          1HB       GLU  42   4.840   7.788   7.788
  346   1HG   GLU  42          2HG       GLU  42   7.525   8.737   8.737
  347   2HG   GLU  42          1HG       GLU  42   6.790   9.702   9.702
  348    H    ILE  43           H        ILE  43   7.571   7.536   7.536
  349    HA   ILE  43           HA       ILE  43   7.724   4.686   4.686
  350    HB   ILE  43           HB       ILE  43   8.782   6.156   6.156
  351   1HG1  ILE  43          2HG1      ILE  43   7.155   3.793   3.793
  352   2HG1  ILE  43          1HG1      ILE  43   6.306   4.908   4.908
  353   1HG2  ILE  43          2HG2      ILE  43   9.420   3.433   3.433
  354   2HG2  ILE  43          1HG2      ILE  43   9.268   3.637   3.637
  355   3HG2  ILE  43          3HG2      ILE  43  10.461   4.576   4.576
  356   1HD1  ILE  43          2HD1      ILE  43   7.624   6.281   6.281
  357   2HD1  ILE  43          1HD1      ILE  43   6.437   5.097   5.097
  358   3HD1  ILE  43          3HD1      ILE  43   5.954   6.387   6.387
  359    H    LYS  44           H        LYS  44   9.568   3.871   3.871
  360    HA   LYS  44           HA       LYS  44  11.816   5.761   5.761
  361   1HB   LYS  44          2HB       LYS  44  11.680   3.534   3.534
  362   2HB   LYS  44          1HB       LYS  44  11.786   5.258   5.258
  363   1HG   LYS  44          2HG       LYS  44   9.396   5.511   5.511
  364   2HG   LYS  44          1HG       LYS  44   9.188   3.903   3.903
  365   1HD   LYS  44          2HD       LYS  44   9.547   2.839   2.839
  366   2HD   LYS  44          1HD       LYS  44  10.581   4.129   4.129
  367   1HE   LYS  44          2HE       LYS  44   8.539   5.601   5.601
  368   2HE   LYS  44          1HE       LYS  44   7.565   4.188   4.188
  369   1HZ   LYS  44          2HZ       LYS  44   9.425   4.328   4.328
  370   2HZ   LYS  44          1HZ       LYS  44   7.752   4.605   4.605
  371   3HZ   LYS  44          3HZ       LYS  44   8.331   3.078   3.078
  372    H    GLN  45           H        GLN  45  13.590   5.071   5.071
  373    HA   GLN  45           HA       GLN  45  13.683   2.211   2.211
  374   1HB   GLN  45          2HB       GLN  45  13.910   3.884   3.884
  375   2HB   GLN  45          1HB       GLN  45  15.321   4.569   4.569
  376   1HG   GLN  45          2HG       GLN  45  16.560   2.501   2.501
  377   2HG   GLN  45          1HG       GLN  45  15.135   1.683   1.683
  378   1HE2  GLN  45          2HE2      GLN  45  16.454   2.486   2.486
  379   2HE2  GLN  45          1HE2      GLN  45  16.151   1.247   1.247
  380    H    GLU  46           H        GLU  46  14.880   0.857   0.857
  381    HA   GLU  46           HA       GLU  46  17.376   1.912   1.912
  382   1HB   GLU  46          2HB       GLU  46  15.271   0.021   0.021
  383   2HB   GLU  46          1HB       GLU  46  16.938  -0.195  -0.195
  384   1HG   GLU  46          2HG       GLU  46  16.263   1.299   1.299
  385   2HG   GLU  46          1HG       GLU  46  16.735   2.457   2.457
  386    H    GLY  47           H        GLY  47  17.411   1.046   1.046
  387   1HA   GLY  47          2HA       GLY  47  19.060  -0.302  -0.302
  388   2HA   GLY  47          1HA       GLY  47  19.039  -1.433  -1.433
  389    H    ASP  48           H        ASP  48  18.231  -3.357  -3.357
  390    HA   ASP  48           HA       ASP  48  16.322  -3.512  -3.512
  391   1HB   ASP  48          2HB       ASP  48  16.176  -5.959  -5.959
  392   2HB   ASP  48          1HB       ASP  48  17.742  -5.411  -5.411
  393    H    THR  49           H        THR  49  15.905  -2.661  -2.661
  394    HA   THR  49           HA       THR  49  13.280  -3.995  -3.995
  395    HB   THR  49           HB       THR  49  15.143  -2.546  -2.546
  396    HG1  THR  49           HG1      THR  49  15.213  -4.457  -4.457
  397   1HG2  THR  49          1HG2      THR  49  12.167  -2.867  -2.867
  398   2HG2  THR  49          3HG2      THR  49  13.246  -2.875  -2.875
  399   3HG2  THR  49          2HG2      THR  49  13.174  -1.461  -1.461
  400    H    PHE  50           H        PHE  50  11.404  -2.865  -2.865
  401    HA   PHE  50           HA       PHE  50  11.610   0.091   0.091
  402   1HB   PHE  50          2HB       PHE  50  10.121  -1.849  -1.849
  403   2HB   PHE  50          1HB       PHE  50   9.952  -0.090  -0.090
  404    HD1  PHE  50           HD2      PHE  50  11.984   1.326   1.326
  405    HD2  PHE  50           HD1      PHE  50  12.018  -2.945  -2.945
  406    HE1  PHE  50           HE2      PHE  50  14.084   1.455   1.455
  407    HE2  PHE  50           HE1      PHE  50  14.118  -2.821  -2.821
  408    HZ   PHE  50           HZ       PHE  50  15.162  -0.625  -0.625
  409    H    TYR  51           H        TYR  51  10.423   0.951   0.951
  410    HA   TYR  51           HA       TYR  51   7.994  -0.451  -0.451
  411   1HB   TYR  51          2HB       TYR  51   9.724   0.293   0.293
  412   2HB   TYR  51          1HB       TYR  51   9.462   1.954   1.954
  413    HD1  TYR  51           HD1      TYR  51   7.027   2.824   2.824
  414    HD2  TYR  51           HD2      TYR  51   8.387  -0.623  -0.623
  415    HE1  TYR  51           HE1      TYR  51   5.112   3.037   3.037
  416    HE2  TYR  51           HE2      TYR  51   6.483  -0.404  -0.404
  417    HH   TYR  51           HH       TYR  51   4.949   1.792   1.792
  418    H    ILE  52           H        ILE  52   5.982   0.692   0.692
  419    HA   ILE  52           HA       ILE  52   5.991   3.263   3.263
  420    HB   ILE  52           HB       ILE  52   3.984   1.173   1.173
  421   1HG1  ILE  52          2HG1      ILE  52   6.878   1.311   1.311
  422   2HG1  ILE  52          1HG1      ILE  52   6.061  -0.067  -0.067
  423   1HG2  ILE  52          3HG2      ILE  52   4.276   3.748   3.748
  424   2HG2  ILE  52          2HG2      ILE  52   5.373   3.039   3.039
  425   3HG2  ILE  52          1HG2      ILE  52   3.681   2.544   2.544
  426   1HD1  ILE  52          2HD1      ILE  52   4.515   0.578   0.578
  427   2HD1  ILE  52          1HD1      ILE  52   6.189   0.733   0.733
  428   3HD1  ILE  52          3HD1      ILE  52   5.624  -0.784  -0.784
  429    H    LYS  53           H        LYS  53   4.252   4.618   4.618
  430    HA   LYS  53           HA       LYS  53   2.247   3.499   3.499
  431   1HB   LYS  53          2HB       LYS  53   4.092   4.541   4.541
  432   2HB   LYS  53          1HB       LYS  53   3.831   6.054   6.054
  433   1HG   LYS  53          2HG       LYS  53   1.877   6.510   6.510
  434   2HG   LYS  53          1HG       LYS  53   1.446   4.808   4.808
  435   1HD   LYS  53          2HD       LYS  53   2.039   5.192   5.192
  436   2HD   LYS  53          1HD       LYS  53   3.646   4.832   4.832
  437   1HE   LYS  53          2HE       LYS  53   4.008   6.857   6.857
  438   2HE   LYS  53          1HE       LYS  53   3.711   7.397   7.397
  439   1HZ   LYS  53          1HZ       LYS  53   1.275   7.493   7.493
  440   2HZ   LYS  53          3HZ       LYS  53   1.899   7.478   7.478
  441   3HZ   LYS  53          2HZ       LYS  53   2.323   8.730   8.730
  442    H    THR  54           H        THR  54   0.412   3.878   3.878
  443    HA   THR  54           HA       THR  54   0.155   6.468   6.468
  444    HB   THR  54           HB       THR  54  -1.811   4.165   4.165
  445    HG1  THR  54           HG1      THR  54  -0.661   3.373   3.373
  446   1HG2  THR  54          1HG2      THR  54  -1.883   6.720   6.720
  447   2HG2  THR  54          3HG2      THR  54  -1.323   5.729   5.729
  448   3HG2  THR  54          2HG2      THR  54  -2.845   5.348   5.348
  449    H    SER  55           H        SER  55  -1.618   7.877   7.877
  450    HA   SER  55           HA       SER  55  -3.290   7.117   7.117
  451   1HB   SER  55          2HB       SER  55  -2.709   9.573   9.573
  452   2HB   SER  55          1HB       SER  55  -1.685   8.205   8.205
  453    HG   SER  55           HG       SER  55  -0.152   9.052   9.052
  454    H    THR  56           H        THR  56  -5.332   7.570   7.570
  455    HA   THR  56           HA       THR  56  -5.843   9.752   9.752
  456    HB   THR  56           HB       THR  56  -8.081   8.697   8.697
  457    HG1  THR  56           HG1      THR  56  -8.433   6.743   6.743
  458   1HG2  THR  56          2HG2      THR  56  -5.550   7.416   7.416
  459   2HG2  THR  56          1HG2      THR  56  -6.823   6.219   6.219
  460   3HG2  THR  56          3HG2      THR  56  -7.022   7.491   7.491
  461    H    THR  57           H        THR  57  -8.682   9.976   9.976
  462    HA   THR  57           HA       THR  57  -8.199  12.081  12.081
  463    HB   THR  57           HB       THR  57 -10.562  12.432  12.432
  464    HG1  THR  57           HG1      THR  57 -11.929  10.786  10.786
  465   1HG2  THR  57          1HG2      THR  57  -9.233  12.703  12.703
  466   2HG2  THR  57          3HG2      THR  57 -10.013  11.207  11.207
  467   3HG2  THR  57          2HG2      THR  57 -10.991  12.625  12.625
  468    H    VAL  58           H        VAL  58  -9.527   8.777   8.777
  469    HA   VAL  58           HA       VAL  58  -9.191   9.010   9.010
  470    HB   VAL  58           HB       VAL  58 -11.349   7.469   7.469
  471   1HG1  VAL  58          2HG1      VAL  58 -10.733   8.058   8.058
  472   2HG1  VAL  58          1HG1      VAL  58 -12.333   7.540   7.540
  473   3HG1  VAL  58          3HG1      VAL  58 -10.941   6.484   6.484
  474   1HG2  VAL  58          1HG2      VAL  58 -11.593   9.938   9.938
  475   2HG2  VAL  58          3HG2      VAL  58 -12.878   9.240   9.240
  476   3HG2  VAL  58          2HG2      VAL  58 -11.547  10.105  10.105
  477    H    ARG  59           H        ARG  59  -8.249   7.301   7.301
  478    HA   ARG  59           HA       ARG  59  -7.753   4.801   4.801
  479   1HB   ARG  59          2HB       ARG  59  -8.914   4.652   4.652
  480   2HB   ARG  59          1HB       ARG  59  -7.439   5.264   5.264
  481   1HG   ARG  59          2HG       ARG  59  -6.195   3.356   3.356
  482   2HG   ARG  59          1HG       ARG  59  -7.339   2.877   2.877
  483   1HD   ARG  59          2HD       ARG  59  -7.543   1.437   1.437
  484   2HD   ARG  59          1HD       ARG  59  -9.024   2.347   2.347
  485    HE   ARG  59           HE       ARG  59  -7.099   3.566   3.566
  486   1HH1  ARG  59          2HH1      ARG  59 -10.026   4.255   4.255
  487   2HH1  ARG  59          1HH1      ARG  59 -10.655   3.419   3.419
  488   1HH2  ARG  59          1HH2      ARG  59  -7.870   1.386   1.386
  489   2HH2  ARG  59          2HH2      ARG  59  -9.435   1.794   1.794
  490    H    THR  60           H        THR  60  -5.598   3.740   3.740
  491    HA   THR  60           HA       THR  60  -3.386   5.385   5.385
  492    HB   THR  60           HB       THR  60  -3.412   4.644   4.644
  493    HG1  THR  60           HG1      THR  60  -4.529   6.362   6.362
  494   1HG2  THR  60          2HG2      THR  60  -1.632   6.151   6.151
  495   2HG2  THR  60          1HG2      THR  60  -1.705   6.677   6.677
  496   3HG2  THR  60          3HG2      THR  60  -1.203   5.032   5.032
  497    H    THR  61           H        THR  61  -2.697   3.626   3.626
  498    HA   THR  61           HA       THR  61  -2.410   0.975   0.975
  499    HB   THR  61           HB       THR  61  -1.379   0.589   0.589
  500    HG1  THR  61           HG1      THR  61  -3.312   2.612   2.612
  501   1HG2  THR  61          2HG2      THR  61  -4.195   0.634   0.634
  502   2HG2  THR  61          1HG2      THR  61  -3.903   0.254   0.254
  503   3HG2  THR  61          3HG2      THR  61  -3.186  -0.746  -0.746
  504    H    GLU  62           H        GLU  62  -0.355  -0.165  -0.165
  505    HA   GLU  62           HA       GLU  62   2.104   1.423   1.423
  506   1HB   GLU  62          2HB       GLU  62   1.018   0.667   0.667
  507   2HB   GLU  62          1HB       GLU  62   2.746   0.430   0.430
  508   1HG   GLU  62          2HG       GLU  62   3.098   2.731   2.731
  509   2HG   GLU  62          1HG       GLU  62   1.372   3.025   3.025
  510    H    ILE  63           H        ILE  63   2.966  -0.075  -0.075
  511    HA   ILE  63           HA       ILE  63   2.977  -2.953  -2.953
  512    HB   ILE  63           HB       ILE  63   3.667  -3.394  -3.394
  513   1HG1  ILE  63          2HG1      ILE  63   3.151  -0.436  -0.436
  514   2HG1  ILE  63          1HG1      ILE  63   4.764  -1.140  -1.140
  515   1HG2  ILE  63          1HG2      ILE  63   1.229  -3.141  -3.141
  516   2HG2  ILE  63          3HG2      ILE  63   1.237  -1.610  -1.610
  517   3HG2  ILE  63          2HG2      ILE  63   1.502  -3.123  -3.123
  518   1HD1  ILE  63          1HD1      ILE  63   2.892  -2.451  -2.451
  519   2HD1  ILE  63          3HD1      ILE  63   3.430  -0.832  -0.832
  520   3HD1  ILE  63          2HD1      ILE  63   4.613  -2.111  -2.111
  521    H    ASN  64           H        ASN  64   5.125  -4.121  -4.121
  522    HA   ASN  64           HA       ASN  64   7.548  -2.492  -2.492
  523   1HB   ASN  64          2HB       ASN  64   8.430  -3.254  -3.254
  524   2HB   ASN  64          1HB       ASN  64   7.088  -2.123  -2.123
  525   1HD2  ASN  64          2HD2      ASN  64   4.761  -4.596  -4.596
  526   2HD2  ASN  64          1HD2      ASN  64   4.862  -3.203  -3.203
  527    H    PHE  65           H        PHE  65   9.087  -3.780  -3.780
  528    HA   PHE  65           HA       PHE  65   9.244  -6.647  -6.647
  529   1HB   PHE  65          2HB       PHE  65   8.682  -7.440  -7.440
  530   2HB   PHE  65          1HB       PHE  65   7.330  -6.540  -6.540
  531    HD1  PHE  65           HD2      PHE  65   6.865  -4.196  -4.196
  532    HD2  PHE  65           HD1      PHE  65   9.906  -6.629  -6.629
  533    HE1  PHE  65           HE2      PHE  65   6.974  -2.629  -2.629
  534    HE2  PHE  65           HE1      PHE  65  10.022  -5.068  -5.068
  535    HZ   PHE  65           HZ       PHE  65   8.558  -3.064  -3.064
  536    H    LYS  66           H        LYS  66  10.615  -7.686  -7.686
  537    HA   LYS  66           HA       LYS  66  12.924  -5.894  -5.894
  538   1HB   LYS  66          2HB       LYS  66  14.364  -7.995  -7.995
  539   2HB   LYS  66          1HB       LYS  66  13.757  -7.281  -7.281
  540   1HG   LYS  66          2HG       LYS  66  11.812  -8.907  -8.907
  541   2HG   LYS  66          1HG       LYS  66  12.671  -9.705  -9.705
  542   1HD   LYS  66          2HD       LYS  66  13.957  -9.204  -9.204
  543   2HD   LYS  66          1HD       LYS  66  13.045 -10.674 -10.674
  544   1HE   LYS  66          2HE       LYS  66  14.539 -11.259 -11.259
  545   2HE   LYS  66          1HE       LYS  66  15.362  -9.704  -9.704
  546   1HZ   LYS  66          3HZ       LYS  66  15.235 -11.484 -11.484
  547   2HZ   LYS  66          2HZ       LYS  66  16.398 -11.752 -11.752
  548   3HZ   LYS  66          1HZ       LYS  66  16.369 -10.277 -10.277
  549    H    VAL  67           H        VAL  67  14.005  -6.514  -6.514
  550    HA   VAL  67           HA       VAL  67  12.066  -7.691  -7.691
  551    HB   VAL  67           HB       VAL  67  14.773  -7.145  -7.145
  552   1HG1  VAL  67          3HG1      VAL  67  11.951  -6.292  -6.292
  553   2HG1  VAL  67          2HG1      VAL  67  13.375  -5.920  -5.920
  554   3HG1  VAL  67          1HG1      VAL  67  12.874  -7.595  -7.595
  555   1HG2  VAL  67          2HG2      VAL  67  13.206  -5.046  -5.046
  556   2HG2  VAL  67          1HG2      VAL  67  14.953  -5.254  -5.254
  557   3HG2  VAL  67          3HG2      VAL  67  14.048  -4.606  -4.606
  558    H    GLY  68           H        GLY  68  11.948  -9.913  -9.913
  559   1HA   GLY  68          2HA       GLY  68  13.325 -11.812 -11.812
  560   2HA   GLY  68          1HA       GLY  68  14.486 -11.455 -11.455
  561    H    GLU  69           H        GLU  69  12.434 -10.958 -10.958
  562    HA   GLU  69           HA       GLU  69  11.589 -13.801 -13.801
  563   1HB   GLU  69          2HB       GLU  69  12.524 -11.644 -11.644
  564   2HB   GLU  69          1HB       GLU  69  11.455 -12.907 -12.907
  565   1HG   GLU  69          2HG       GLU  69  13.898 -13.625 -13.625
  566   2HG   GLU  69          1HG       GLU  69  14.029 -13.296 -13.296
  567    H    GLU  70           H        GLU  70   9.501 -14.165 -14.165
  568    HA   GLU  70           HA       GLU  70   7.487 -12.198 -12.198
  569   1HB   GLU  70          2HB       GLU  70   7.172 -14.906 -14.906
  570   2HB   GLU  70          1HB       GLU  70   5.862 -13.940 -13.940
  571   1HG   GLU  70          2HG       GLU  70   6.286 -15.234 -15.234
  572   2HG   GLU  70          1HG       GLU  70   7.510 -13.996 -13.996
  573    H    PHE  71           H        PHE  71   5.645 -11.723 -11.723
  574    HA   PHE  71           HA       PHE  71   6.320 -11.754 -11.754
  575   1HB   PHE  71          2HB       PHE  71   6.316  -9.246  -9.246
  576   2HB   PHE  71          1HB       PHE  71   7.719  -9.883  -9.883
  577    HD1  PHE  71           HD2      PHE  71   7.657  -9.952  -9.952
  578    HD2  PHE  71           HD1      PHE  71   4.828  -7.741  -7.741
  579    HE1  PHE  71           HE2      PHE  71   7.038  -8.614  -8.614
  580    HE2  PHE  71           HE1      PHE  71   4.209  -6.404  -6.404
  581    HZ   PHE  71           HZ       PHE  71   5.312  -6.838  -6.838
  582    H    GLU  72           H        GLU  72   4.641 -10.276 -10.276
  583    HA   GLU  72           HA       GLU  72   2.032 -10.673 -10.673
  584   1HB   GLU  72          2HB       GLU  72   2.233 -10.000 -10.000
  585   2HB   GLU  72          1HB       GLU  72   0.969 -10.872 -10.872
  586   1HG   GLU  72          2HG       GLU  72   2.574 -12.753 -12.753
  587   2HG   GLU  72          1HG       GLU  72   3.749 -11.904 -11.904
  588    H    GLU  73           H        GLU  73   0.638  -8.910  -8.910
  589    HA   GLU  73           HA       GLU  73   1.257  -6.306  -6.306
  590   1HB   GLU  73          2HB       GLU  73   1.528  -5.184  -5.184
  591   2HB   GLU  73          1HB       GLU  73   2.870  -6.254  -6.254
  592   1HG   GLU  73          2HG       GLU  73   2.372  -7.731  -7.731
  593   2HG   GLU  73          1HG       GLU  73   0.632  -7.546  -7.546
  594    H    GLN  74           H        GLN  74  -0.242  -4.633  -4.633
  595    HA   GLN  74           HA       GLN  74  -2.930  -5.957  -5.957
  596   1HB   GLN  74          2HB       GLN  74  -2.042  -3.075  -3.075
  597   2HB   GLN  74          1HB       GLN  74  -3.727  -3.513  -3.513
  598   1HG   GLN  74          2HG       GLN  74  -3.536  -5.083  -5.083
  599   2HG   GLN  74          1HG       GLN  74  -1.980  -4.327  -4.327
  600   1HE2  GLN  74          2HE2      GLN  74  -5.409  -2.112  -2.112
  601   2HE2  GLN  74          1HE2      GLN  74  -5.437  -3.456  -3.456
  602    H    THR  75           H        THR  75  -4.411  -5.425  -5.425
  603    HA   THR  75           HA       THR  75  -2.954  -5.047  -5.047
  604    HB   THR  75           HB       THR  75  -4.536  -6.989  -6.989
  605    HG1  THR  75           HG1      THR  75  -4.895  -6.994  -6.994
  606   1HG2  THR  75          2HG2      THR  75  -6.316  -4.878  -4.878
  607   2HG2  THR  75          1HG2      THR  75  -6.957  -5.664  -5.664
  608   3HG2  THR  75          3HG2      THR  75  -6.620  -6.613  -6.613
  609    H    VAL  76           H        VAL  76  -5.685  -4.076  -4.076
  610    HA   VAL  76           HA       VAL  76  -5.285  -1.238  -1.238
  611    HB   VAL  76           HB       VAL  76  -6.441  -2.311  -2.311
  612   1HG1  VAL  76          1HG1      VAL  76  -5.904   0.394   0.394
  613   2HG1  VAL  76          3HG1      VAL  76  -5.583   0.157   0.157
  614   3HG1  VAL  76          2HG1      VAL  76  -7.199  -0.136  -0.136
  615   1HG2  VAL  76          1HG2      VAL  76  -3.641  -1.495  -1.495
  616   2HG2  VAL  76          3HG2      VAL  76  -4.162  -2.978  -2.978
  617   3HG2  VAL  76          2HG2      VAL  76  -4.183  -1.449  -1.449
  618    H    ASP  77           H        ASP  77  -7.625  -3.806  -3.806
  619    HA   ASP  77           HA       ASP  77  -9.913  -1.975  -1.975
  620   1HB   ASP  77          2HB       ASP  77  -9.705  -4.464  -4.464
  621   2HB   ASP  77          1HB       ASP  77 -10.249  -4.859  -4.859
  622    H    GLY  78           H        GLY  78  -8.076  -4.185  -4.185
  623   1HA   GLY  78          2HA       GLY  78  -7.832  -3.200  -3.200
  624   2HA   GLY  78          1HA       GLY  78  -9.594  -3.230  -3.230
  625    H    ARG  79           H        ARG  79  -7.289  -5.613  -5.613
  626    HA   ARG  79           HA       ARG  79  -8.332  -7.593  -7.593
  627   1HB   ARG  79          2HB       ARG  79  -8.135  -7.722  -7.722
  628   2HB   ARG  79          1HB       ARG  79  -8.029  -9.196  -9.196
  629   1HG   ARG  79          2HG       ARG  79 -10.186  -8.291  -8.291
  630   2HG   ARG  79          1HG       ARG  79 -10.325  -7.282  -7.282
  631   1HD   ARG  79          2HD       ARG  79 -11.583  -9.360  -9.360
  632   2HD   ARG  79          1HD       ARG  79 -10.206  -9.311  -9.311
  633    HE   ARG  79           HE       ARG  79  -9.318 -10.611 -10.611
  634   1HH1  ARG  79          2HH1      ARG  79 -10.314 -11.288 -11.288
  635   2HH1  ARG  79          1HH1      ARG  79 -10.900 -12.885 -12.885
  636   1HH2  ARG  79          1HH2      ARG  79 -10.663 -12.563 -12.563
  637   2HH2  ARG  79          2HH2      ARG  79 -11.099 -13.607 -13.607
  638    HA   PRO  80           HA       PRO  80  -4.002  -8.443  -8.443
  639   1HB   PRO  80          2HB       PRO  80  -4.144 -10.975 -10.975
  640   2HB   PRO  80          1HB       PRO  80  -4.512  -9.503  -9.503
  641   1HG   PRO  80          2HG       PRO  80  -6.380 -11.552 -11.552
  642   2HG   PRO  80          1HG       PRO  80  -6.593 -10.460 -10.460
  643   1HD   PRO  80          2HD       PRO  80  -7.719 -10.124 -10.124
  644   2HD   PRO  80          1HD       PRO  80  -7.659  -8.898  -8.898
  645    H    CYS  81           H        CYS  81  -2.368  -9.408  -9.408
  646    HA   CYS  81           HA       CYS  81  -2.804 -11.868 -11.868
  647   1HB   CYS  81          2HB       CYS  81  -2.319 -10.759 -10.759
  648   2HB   CYS  81          1HB       CYS  81  -3.904 -10.372 -10.372
  649    HG   CYS  81           HG       CYS  81  -1.548  -8.385  -8.385
  650    H    LYS  82           H        LYS  82  -0.832 -12.791 -12.791
  651    HA   LYS  82           HA       LYS  82   1.588 -11.417 -11.417
  652   1HB   LYS  82          2HB       LYS  82   1.282 -13.762 -13.762
  653   2HB   LYS  82          1HB       LYS  82   1.144 -14.233 -14.233
  654   1HG   LYS  82          2HG       LYS  82   3.357 -14.611 -14.611
  655   2HG   LYS  82          1HG       LYS  82   3.556 -12.863 -12.863
  656   1HD   LYS  82          2HD       LYS  82   4.759 -13.468 -13.468
  657   2HD   LYS  82          1HD       LYS  82   3.166 -13.182 -13.182
  658   1HE   LYS  82          2HE       LYS  82   2.672 -15.632 -15.632
  659   2HE   LYS  82          1HE       LYS  82   4.349 -15.857 -15.857
  660   1HZ   LYS  82          1HZ       LYS  82   3.660 -14.538 -14.538
  661   2HZ   LYS  82          3HZ       LYS  82   3.787 -16.225 -16.225
  662   3HZ   LYS  82          2HZ       LYS  82   5.133 -15.248 -15.248
  663    H    SER  83           H        SER  83   2.558 -10.103 -10.103
  664    HA   SER  83           HA       SER  83   2.281 -10.708 -10.708
  665   1HB   SER  83          2HB       SER  83   1.772  -8.423  -8.423
  666   2HB   SER  83          1HB       SER  83   3.506  -8.201  -8.201
  667    HG   SER  83           HG       SER  83   1.995  -7.511  -7.511
  668    H    LEU  84           H        LEU  84   4.329  -9.918  -9.918
  669    HA   LEU  84           HA       LEU  84   6.872 -10.431 -10.431
  670   1HB   LEU  84          2HB       LEU  84   6.235 -12.713 -12.713
  671   2HB   LEU  84          1HB       LEU  84   5.848 -12.208 -12.208
  672    HG   LEU  84           HG       LEU  84   8.208 -11.635 -11.635
  673   1HD1  LEU  84          2HD1      LEU  84   8.377 -11.605 -11.605
  674   2HD1  LEU  84          1HD1      LEU  84   9.315 -13.013 -13.013
  675   3HD1  LEU  84          3HD1      LEU  84   9.714 -11.425 -11.425
  676   1HD2  LEU  84          2HD2      LEU  84   7.114 -14.089 -14.089
  677   2HD2  LEU  84          1HD2      LEU  84   8.799 -13.803 -13.803
  678   3HD2  LEU  84          3HD2      LEU  84   8.390 -14.370 -14.370
  679    H    VAL  85           H        VAL  85   8.677  -9.674  -9.674
  680    HA   VAL  85           HA       VAL  85   7.856  -8.252  -8.252
  681    HB   VAL  85           HB       VAL  85   9.545  -6.905  -6.905
  682   1HG1  VAL  85          2HG1      VAL  85   9.516  -6.236  -6.236
  683   2HG1  VAL  85          1HG1      VAL  85   7.879  -5.658  -5.658
  684   3HG1  VAL  85          3HG1      VAL  85   9.243  -4.960  -4.960
  685   1HG2  VAL  85          1HG2      VAL  85   6.594  -7.154  -7.154
  686   2HG2  VAL  85          3HG2      VAL  85   7.598  -6.873  -6.873
  687   3HG2  VAL  85          2HG2      VAL  85   7.216  -5.542  -5.542
  688    H    LYS  86           H        LYS  86   9.265  -8.596  -8.596
  689    HA   LYS  86           HA       LYS  86  12.111  -9.183  -9.183
  690   1HB   LYS  86          2HB       LYS  86  11.959 -10.238 -10.238
  691   2HB   LYS  86          1HB       LYS  86  11.611 -11.192 -11.192
  692   1HG   LYS  86          2HG       LYS  86   9.175 -10.586 -10.586
  693   2HG   LYS  86          1HG       LYS  86   9.611  -9.843  -9.843
  694   1HD   LYS  86          2HD       LYS  86   8.858 -12.101 -12.101
  695   2HD   LYS  86          1HD       LYS  86  10.603 -12.047 -12.047
  696   1HE   LYS  86          2HE       LYS  86  11.060 -13.249 -13.249
  697   2HE   LYS  86          1HE       LYS  86   9.550 -12.769 -12.769
  698   1HZ   LYS  86          2HZ       LYS  86   8.363 -14.144 -14.144
  699   2HZ   LYS  86          1HZ       LYS  86   9.854 -14.676 -14.676
  700   3HZ   LYS  86          3HZ       LYS  86   9.413 -15.054 -15.054
  701    H    TRP  87           H        TRP  87  13.631  -8.257  -8.257
  702    HA   TRP  87           HA       TRP  87  12.709  -5.637  -5.637
  703   1HB   TRP  87          2HB       TRP  87  15.333  -7.132  -7.132
  704   2HB   TRP  87          1HB       TRP  87  15.105  -5.604  -5.604
  705    HD1  TRP  87           HD1      TRP  87  15.965  -7.053  -7.053
  706    HE1  TRP  87           HE1      TRP  87  16.126  -5.221  -5.221
  707    HE3  TRP  87           HE3      TRP  87  13.831  -3.184  -3.184
  708    HZ2  TRP  87           HZ2      TRP  87  15.436  -2.457  -2.457
  709    HZ3  TRP  87           HZ3      TRP  87  13.571  -0.965  -0.965
  710    HH2  TRP  87           HH2      TRP  87  14.367  -0.604  -0.604
  711    H    GLU  88           H        GLU  88  13.420  -4.972  -4.972
  712    HA   GLU  88           HA       GLU  88  12.896  -7.092  -7.092
  713   1HB   GLU  88          2HB       GLU  88  10.853  -5.588  -5.588
  714   2HB   GLU  88          1HB       GLU  88  11.722  -4.332  -4.332
  715   1HG   GLU  88          2HG       GLU  88  10.407  -5.278  -5.278
  716   2HG   GLU  88          1HG       GLU  88  11.949  -6.111  -6.111
  717    H    SER  89           H        SER  89  13.829  -3.755  -3.755
  718    HA   SER  89           HA       SER  89  16.020  -3.978  -3.978
  719   1HB   SER  89          2HB       SER  89  15.569  -1.738  -1.738
  720   2HB   SER  89          1HB       SER  89  14.037  -2.605  -2.605
  721    HG   SER  89           HG       SER  89  13.797  -0.581  -0.581
  722    H    GLU  90           H        GLU  90  16.868  -1.221  -1.221
  723    HA   GLU  90           HA       GLU  90  18.296  -1.922  -1.922
  724   1HB   GLU  90          2HB       GLU  90  18.252   0.785   0.785
  725   2HB   GLU  90          1HB       GLU  90  19.507   0.130   0.130
  726   1HG   GLU  90          2HG       GLU  90  19.457  -1.797  -1.797
  727   2HG   GLU  90          1HG       GLU  90  18.967  -0.411  -0.411
  728    H    ASN  91           H        ASN  91  15.446  -0.050  -0.050
  729    HA   ASN  91           HA       ASN  91  15.077   0.433   0.433
  730   1HB   ASN  91          2HB       ASN  91  14.589   2.597   2.597
  731   2HB   ASN  91          1HB       ASN  91  14.511   2.742   2.742
  732   1HD2  ASN  91          2HD2      ASN  91  17.942   3.631   3.631
  733   2HD2  ASN  91          1HD2      ASN  91  16.406   3.750   3.750
  734    H    LYS  92           H        LYS  92  13.776  -1.366  -1.366
  735    HA   LYS  92           HA       LYS  92  10.999  -0.395  -0.395
  736   1HB   LYS  92          2HB       LYS  92  11.529   0.062   0.062
  737   2HB   LYS  92          1HB       LYS  92  12.059  -1.603  -1.603
  738   1HG   LYS  92          2HG       LYS  92   9.705  -2.302  -2.302
  739   2HG   LYS  92          1HG       LYS  92   9.257  -0.607  -0.607
  740   1HD   LYS  92          2HD       LYS  92  10.021  -0.657  -0.657
  741   2HD   LYS  92          1HD       LYS  92  10.446  -2.360  -2.360
  742   1HE   LYS  92          2HE       LYS  92   8.131  -2.949  -2.949
  743   2HE   LYS  92          1HE       LYS  92   7.660  -1.249  -1.249
  744   1HZ   LYS  92          2HZ       LYS  92   9.013  -2.370  -2.370
  745   2HZ   LYS  92          1HZ       LYS  92   7.352  -2.650  -2.650
  746   3HZ   LYS  92          3HZ       LYS  92   7.934  -1.062  -1.062
  747    H    MET  93           H        MET  93  10.229  -1.890  -1.890
  748    HA   MET  93           HA       MET  93  10.936  -4.757  -4.757
  749   1HB   MET  93          2HB       MET  93  10.663  -5.172  -5.172
  750   2HB   MET  93          1HB       MET  93  11.914  -3.979  -3.979
  751   1HG   MET  93          2HG       MET  93   9.583  -2.474  -2.474
  752   2HG   MET  93          1HG       MET  93   9.403  -3.708  -3.708
  753   1HE   MET  93          1HE       MET  93  11.154  -4.512  -4.512
  754   2HE   MET  93          3HE       MET  93  12.820  -4.021  -4.021
  755   3HE   MET  93          2HE       MET  93  11.996  -3.443  -3.443
  756    H    VAL  94           H        VAL  94   9.306  -6.310  -6.310
  757    HA   VAL  94           HA       VAL  94   6.542  -5.257  -5.257
  758    HB   VAL  94           HB       VAL  94   7.359  -8.123  -8.123
  759   1HG1  VAL  94          2HG1      VAL  94   5.120  -6.326  -6.326
  760   2HG1  VAL  94          1HG1      VAL  94   5.575  -7.549  -7.549
  761   3HG1  VAL  94          3HG1      VAL  94   5.093  -8.030  -8.030
  762   1HG2  VAL  94          3HG2      VAL  94   7.662  -5.869  -5.869
  763   2HG2  VAL  94          2HG2      VAL  94   8.976  -6.815  -6.815
  764   3HG2  VAL  94          1HG2      VAL  94   7.810  -7.586  -7.586
  765    H    CYS  95           H        CYS  95   4.832  -6.853  -6.853
  766    HA   CYS  95           HA       CYS  95   5.828  -8.065  -8.065
  767   1HB   CYS  95          2HB       CYS  95   5.341  -5.672  -5.672
  768   2HB   CYS  95          1HB       CYS  95   3.686  -5.920  -5.920
  769    HG   CYS  95           HG       CYS  95   3.148  -7.109  -7.109
  770    H    GLU  96           H        GLU  96   4.738  -9.917  -9.917
  771    HA   GLU  96           HA       GLU  96   2.145 -10.368 -10.368
  772   1HB   GLU  96          2HB       GLU  96   2.525 -12.781 -12.781
  773   2HB   GLU  96          1HB       GLU  96   3.745 -12.138 -12.138
  774   1HG   GLU  96          2HG       GLU  96   5.393 -12.145 -12.145
  775   2HG   GLU  96          1HG       GLU  96   4.261 -11.842 -11.842
  776    H    GLN  97           H        GLN  97   0.421 -11.499 -11.499
  777    HA   GLN  97           HA       GLN  97   0.772 -11.144 -11.144
  778   1HB   GLN  97          2HB       GLN  97   0.203  -8.874  -8.874
  779   2HB   GLN  97          1HB       GLN  97  -1.429  -9.531  -9.531
  780   1HG   GLN  97          2HG       GLN  97  -0.993 -10.031 -10.031
  781   2HG   GLN  97          1HG       GLN  97   0.320  -8.866  -8.866
  782   1HE2  GLN  97          2HE2      GLN  97  -1.821  -6.061  -6.061
  783   2HE2  GLN  97          1HE2      GLN  97  -0.224  -6.635  -6.635
  784    H    LYS  98           H        LYS  98  -0.694 -12.287 -12.287
  785    HA   LYS  98           HA       LYS  98  -3.161 -13.321 -13.321
  786   1HB   LYS  98          2HB       LYS  98  -2.613 -15.647 -15.647
  787   2HB   LYS  98          1HB       LYS  98  -1.493 -15.050 -15.050
  788   1HG   LYS  98          2HG       LYS  98   0.107 -14.426 -14.426
  789   2HG   LYS  98          1HG       LYS  98  -0.995 -15.122 -15.122
  790   1HD   LYS  98          2HD       LYS  98  -0.723 -17.318 -17.318
  791   2HD   LYS  98          1HD       LYS  98   0.044 -16.716 -16.716
  792   1HE   LYS  98          2HE       LYS  98   2.012 -16.037 -16.037
  793   2HE   LYS  98          1HE       LYS  98   1.232 -16.361 -16.361
  794   1HZ   LYS  98          3HZ       LYS  98   1.823 -18.396 -18.396
  795   2HZ   LYS  98          2HZ       LYS  98   2.727 -18.152 -18.152
  796   3HZ   LYS  98          1HZ       LYS  98   1.119 -18.693 -18.693
  797    H    LEU  99           H        LEU  99  -4.745 -13.868 -13.868
  798    HA   LEU  99           HA       LEU  99  -4.622 -12.361 -12.361
  799   1HB   LEU  99          2HB       LEU  99  -6.267 -14.792 -14.792
  800   2HB   LEU  99          1HB       LEU  99  -6.526 -13.820 -13.820
  801    HG   LEU  99           HG       LEU  99  -6.392 -12.367 -12.367
  802   1HD1  LEU  99          1HD1      LEU  99  -7.836 -14.544 -14.544
  803   2HD1  LEU  99          3HD1      LEU  99  -8.970 -13.677 -13.677
  804   3HD1  LEU  99          2HD1      LEU  99  -8.525 -13.012 -13.012
  805   1HD2  LEU  99          3HD2      LEU  99  -7.998 -12.203 -12.203
  806   2HD2  LEU  99          2HD2      LEU  99  -6.743 -11.093 -11.093
  807   3HD2  LEU  99          1HD2      LEU  99  -8.296 -11.154 -11.154
  808    H    LEU 100           H        LEU 100  -4.786 -13.271 -13.271
  809    HA   LEU 100           HA       LEU 100  -2.712 -15.338 -15.338
  810   1HB   LEU 100          2HB       LEU 100  -3.964 -13.224 -13.224
  811   2HB   LEU 100          1HB       LEU 100  -3.002 -14.540 -14.540
  812    HG   LEU 100           HG       LEU 100  -1.950 -12.835 -12.835
  813   1HD1  LEU 100          1HD1      LEU 100  -2.146 -12.218 -12.218
  814   2HD1  LEU 100          3HD1      LEU 100  -0.680 -11.748 -11.748
  815   3HD1  LEU 100          2HD1      LEU 100  -2.246 -11.128 -11.128
  816   1HD2  LEU 100          1HD2      LEU 100  -0.920 -14.874 -14.874
  817   2HD2  LEU 100          3HD2      LEU 100  -0.475 -14.586 -14.586
  818   3HD2  LEU 100          2HD2      LEU 100   0.168 -13.548 -13.548
  819    H    LYS 101           H        LYS 101  -6.080 -15.064 -15.064
  820    HA   LYS 101           HA       LYS 101  -6.433 -17.700 -17.700
  821   1HB   LYS 101          2HB       LYS 101  -6.887 -15.613 -15.613
  822   2HB   LYS 101          1HB       LYS 101  -8.447 -15.655 -15.655
  823   1HG   LYS 101          2HG       LYS 101  -8.181 -18.280 -18.280
  824   2HG   LYS 101          1HG       LYS 101  -7.218 -17.656 -17.656
  825   1HD   LYS 101          2HD       LYS 101  -9.848 -16.347 -16.347
  826   2HD   LYS 101          1HD       LYS 101  -9.874 -17.964 -17.964
  827   1HE   LYS 101          2HE       LYS 101  -8.644 -17.284 -17.284
  828   2HE   LYS 101          1HE       LYS 101  -8.089 -15.805 -15.805
  829   1HZ   LYS 101          3HZ       LYS 101 -10.495 -15.135 -15.135
  830   2HZ   LYS 101          2HZ       LYS 101 -10.814 -16.438 -16.438
  831   3HZ   LYS 101          1HZ       LYS 101  -9.793 -15.176 -15.176
  832    H    GLY 102           H        GLY 102  -8.101 -18.843 -18.843
  833   1HA   GLY 102          2HA       GLY 102  -9.740 -19.320 -19.320
  834   2HA   GLY 102          1HA       GLY 102 -10.255 -17.637 -17.637
  835    H    GLU 103           H        GLU 103 -10.523 -17.705 -17.705
  836    HA   GLU 103           HA       GLU 103  -8.322 -16.523 -16.523
  837   1HB   GLU 103          2HB       GLU 103  -7.476 -18.876 -18.876
  838   2HB   GLU 103          1HB       GLU 103  -8.905 -19.386 -19.386
  839   1HG   GLU 103          2HG       GLU 103  -8.278 -18.114 -18.114
  840   2HG   GLU 103          1HG       GLU 103  -7.042 -17.237 -17.237
  841    H    GLY 104           H        GLY 104  -9.042 -15.578 -15.578
  842   1HA   GLY 104          2HA       GLY 104 -11.437 -16.517 -16.517
  843   2HA   GLY 104          1HA       GLY 104 -11.657 -14.987 -14.987
  844    HA   PRO 105           HA       PRO 105  -9.723 -13.050 -13.050
  845   1HB   PRO 105          2HB       PRO 105  -9.003 -10.663 -10.663
  846   2HB   PRO 105          1HB       PRO 105 -10.674 -11.073 -11.073
  847   1HG   PRO 105          2HG       PRO 105  -9.415 -10.917 -10.917
  848   2HG   PRO 105          1HG       PRO 105 -11.125 -10.798 -10.798
  849   1HD   PRO 105          2HD       PRO 105  -9.791 -13.084 -13.084
  850   2HD   PRO 105          1HD       PRO 105 -11.460 -13.009 -13.009
  851    H    LYS 106           H        LYS 106  -7.565 -11.595 -11.595
  852    HA   LYS 106           HA       LYS 106  -5.336 -12.712 -12.712
  853   1HB   LYS 106          2HB       LYS 106  -5.506 -14.093 -14.093
  854   2HB   LYS 106          1HB       LYS 106  -5.537 -12.648 -12.648
  855   1HG   LYS 106          2HG       LYS 106  -3.289 -12.116 -12.116
  856   2HG   LYS 106          1HG       LYS 106  -3.247 -13.211 -13.211
  857   1HD   LYS 106          2HD       LYS 106  -2.184 -14.565 -14.565
  858   2HD   LYS 106          1HD       LYS 106  -3.850 -14.997 -14.997
  859   1HE   LYS 106          2HE       LYS 106  -2.824 -14.491 -14.491
  860   2HE   LYS 106          1HE       LYS 106  -3.807 -13.082 -13.082
  861   1HZ   LYS 106          2HZ       LYS 106  -1.630 -12.281 -12.281
  862   2HZ   LYS 106          1HZ       LYS 106  -0.886 -13.393 -13.393
  863   3HZ   LYS 106          3HZ       LYS 106  -1.814 -12.124 -12.124
  864    H    THR 107           H        THR 107  -3.736 -11.144 -11.144
  865    HA   THR 107           HA       THR 107  -4.091  -8.546  -8.546
  866    HB   THR 107           HB       THR 107  -2.918  -7.819  -7.819
  867    HG1  THR 107           HG1      THR 107  -3.345 -10.045 -10.045
  868   1HG2  THR 107          3HG2      THR 107  -5.711  -7.877  -7.877
  869   2HG2  THR 107          2HG2      THR 107  -5.461  -7.372  -7.372
  870   3HG2  THR 107          1HG2      THR 107  -4.674  -6.497  -6.497
  871    H    SER 108           H        SER 108  -2.288  -7.436  -7.436
  872    HA   SER 108           HA       SER 108   0.410  -8.223  -8.223
  873   1HB   SER 108          2HB       SER 108   0.960  -8.610  -8.610
  874   2HB   SER 108          1HB       SER 108   0.302  -9.944  -9.944
  875    HG   SER 108           HG       SER 108  -0.767  -9.552  -9.552
  876    H    TRP 109           H        TRP 109   1.627  -6.317  -6.317
  877    HA   TRP 109           HA       TRP 109   0.690  -4.293  -4.293
  878   1HB   TRP 109          2HB       TRP 109   1.160  -2.509  -2.509
  879   2HB   TRP 109          1HB       TRP 109  -0.253  -3.504  -3.504
  880    HD1  TRP 109           HD1      TRP 109  -0.222  -5.042  -5.042
  881    HE1  TRP 109           HE1      TRP 109   1.397  -5.284  -5.284
  882    HE3  TRP 109           HE3      TRP 109   3.763  -2.379  -2.379
  883    HZ2  TRP 109           HZ2      TRP 109   4.030  -4.459  -4.459
  884    HZ3  TRP 109           HZ3      TRP 109   5.807  -2.124  -2.124
  885    HH2  TRP 109           HH2      TRP 109   5.950  -3.158  -3.158
  886    H    THR 110           H        THR 110   2.366  -2.467  -2.467
  887    HA   THR 110           HA       THR 110   5.126  -3.559  -3.559
  888    HB   THR 110           HB       THR 110   5.741  -3.020  -3.020
  889    HG1  THR 110           HG1      THR 110   4.870  -1.186  -1.186
  890   1HG2  THR 110          2HG2      THR 110   3.786  -4.888  -4.888
  891   2HG2  THR 110          1HG2      THR 110   3.050  -3.912  -3.912
  892   3HG2  THR 110          3HG2      THR 110   4.616  -4.676  -4.676
  893    H    MET 111           H        MET 111   6.738  -1.717  -1.717
  894    HA   MET 111           HA       MET 111   5.809   1.013   1.013
  895   1HB   MET 111          2HB       MET 111   7.213   1.333   1.333
  896   2HB   MET 111          1HB       MET 111   5.861   0.236   0.236
  897   1HG   MET 111          2HG       MET 111   7.235  -1.649  -1.649
  898   2HG   MET 111          1HG       MET 111   8.518  -0.866  -0.866
  899   1HE   MET 111          2HE       MET 111   6.216  -0.253  -0.253
  900   2HE   MET 111          1HE       MET 111   7.113  -0.909  -0.909
  901   3HE   MET 111          3HE       MET 111   7.054   0.839   0.839
  902    H    GLU 112           H        GLU 112   7.208   2.393   2.393
  903    HA   GLU 112           HA       GLU 112   9.923   1.358   1.358
  904   1HB   GLU 112          2HB       GLU 112   8.377   1.165   1.165
  905   2HB   GLU 112          1HB       GLU 112   8.073   2.897   2.897
  906   1HG   GLU 112          2HG       GLU 112  10.213   3.457   3.457
  907   2HG   GLU 112          1HG       GLU 112  10.908   1.935   1.935
  908    H    LEU 113           H        LEU 113  11.533   2.967   2.967
  909    HA   LEU 113           HA       LEU 113  10.719   5.607   5.607
  910   1HB   LEU 113          2HB       LEU 113  12.587   3.788   3.788
  911   2HB   LEU 113          1HB       LEU 113  13.587   4.864   4.864
  912    HG   LEU 113           HG       LEU 113  13.417   5.487   5.487
  913   1HD1  LEU 113          3HD1      LEU 113  13.017   7.207   7.207
  914   2HD1  LEU 113          2HD1      LEU 113  12.350   7.920   7.920
  915   3HD1  LEU 113          1HD1      LEU 113  14.042   7.442   7.442
  916   1HD2  LEU 113          2HD2      LEU 113  10.931   4.847   4.847
  917   2HD2  LEU 113          1HD2      LEU 113  11.409   6.323   6.323
  918   3HD2  LEU 113          3HD2      LEU 113  10.619   6.415   6.415
  919    H    THR 114           H        THR 114  11.418   7.484   7.484
  920    HA   THR 114           HA       THR 114  12.244   6.948   6.948
  921    HB   THR 114           HB       THR 114  11.580   9.174   9.174
  922    HG1  THR 114           HG1      THR 114  12.067  10.648  10.648
  923   1HG2  THR 114          3HG2      THR 114   9.724   7.582   7.582
  924   2HG2  THR 114          2HG2      THR 114   9.711   8.316   8.316
  925   3HG2  THR 114          1HG2      THR 114   9.310   9.286   9.286
  926    H    ASN 115           H        ASN 115  13.999   8.244   8.244
  927    HA   ASN 115           HA       ASN 115  16.435   8.059   8.059
  928   1HB   ASN 115          2HB       ASN 115  15.715   9.645   9.645
  929   2HB   ASN 115          1HB       ASN 115  17.361   9.495   9.495
  930   1HD2  ASN 115          2HD2      ASN 115  15.590   6.296   6.296
  931   2HD2  ASN 115          1HD2      ASN 115  14.660   7.649   7.649
  932    H    ASP 116           H        ASP 116  14.021  10.566  10.566
  933    HA   ASP 116           HA       ASP 116  15.838  12.631  12.631
  934   1HB   ASP 116          2HB       ASP 116  13.720  12.992  12.992
  935   2HB   ASP 116          1HB       ASP 116  12.827  12.789  12.789
  936    H    GLY 117           H        GLY 117  13.538  10.281  10.281
  937   1HA   GLY 117          2HA       GLY 117  14.146   9.602   9.602
  938   2HA   GLY 117          1HA       GLY 117  14.036  11.319  11.319
  939    H    GLU 118           H        GLU 118  11.659  11.058  11.058
  940    HA   GLU 118           HA       GLU 118   9.519  11.229  11.229
  941   1HB   GLU 118          2HB       GLU 118   9.558  10.515  10.515
  942   2HB   GLU 118          1HB       GLU 118   8.068  10.718  10.718
  943   1HG   GLU 118          2HG       GLU 118   8.221  12.915  12.915
  944   2HG   GLU 118          1HG       GLU 118   9.510  12.987  12.987
  945    H    LEU 119           H        LEU 119   7.593   9.584   9.584
  946    HA   LEU 119           HA       LEU 119   8.559   6.777   6.777
  947   1HB   LEU 119          2HB       LEU 119   8.926   7.644   7.644
  948   2HB   LEU 119          1HB       LEU 119   7.191   7.906   7.906
  949    HG   LEU 119           HG       LEU 119   8.376   5.201   5.201
  950   1HD1  LEU 119          2HD1      LEU 119   8.019   6.604   6.604
  951   2HD1  LEU 119          1HD1      LEU 119   7.789   4.857   4.857
  952   3HD1  LEU 119          3HD1      LEU 119   9.339   5.566   5.566
  953   1HD2  LEU 119          3HD2      LEU 119   5.690   6.305   6.305
  954   2HD2  LEU 119          2HD2      LEU 119   6.091   5.039   5.039
  955   3HD2  LEU 119          1HD2      LEU 119   6.107   4.688   4.688
  956    H    ILE 120           H        ILE 120   7.115   5.943   5.943
  957    HA   ILE 120           HA       ILE 120   4.230   6.693   6.693
  958    HB   ILE 120           HB       ILE 120   5.082   7.131   7.131
  959   1HG1  ILE 120          2HG1      ILE 120   3.512   4.570   4.570
  960   2HG1  ILE 120          1HG1      ILE 120   2.768   6.016   6.016
  961   1HG2  ILE 120          3HG2      ILE 120   6.076   4.301   4.301
  962   2HG2  ILE 120          2HG2      ILE 120   5.767   4.994   4.994
  963   3HG2  ILE 120          1HG2      ILE 120   6.954   5.739   5.739
  964   1HD1  ILE 120          3HD1      ILE 120   3.418   7.283   7.283
  965   2HD1  ILE 120          2HD1      ILE 120   4.067   5.795   5.795
  966   3HD1  ILE 120          1HD1      ILE 120   2.339   5.936   5.936
  967    H    LEU 121           H        LEU 121   2.700   4.968   4.968
  968    HA   LEU 121           HA       LEU 121   3.948   2.295   2.295
  969   1HB   LEU 121          2HB       LEU 121   3.463   3.451   3.451
  970   2HB   LEU 121          1HB       LEU 121   1.782   3.645   3.645
  971    HG   LEU 121           HG       LEU 121   2.590   0.862   0.862
  972   1HD1  LEU 121          2HD1      LEU 121   4.095   1.863   1.863
  973   2HD1  LEU 121          1HD1      LEU 121   2.597   1.755   1.755
  974   3HD1  LEU 121          3HD1      LEU 121   3.295   0.304   0.304
  975   1HD2  LEU 121          2HD2      LEU 121   0.271   1.941   1.941
  976   2HD2  LEU 121          1HD2      LEU 121   0.566   0.480   0.480
  977   3HD2  LEU 121          3HD2      LEU 121   0.633   2.061   2.061
  978    H    THR 122           H        THR 122   2.753   0.552   0.552
  979    HA   THR 122           HA       THR 122   0.148   1.181   1.181
  980    HB   THR 122           HB       THR 122   1.319  -1.240  -1.240
  981    HG1  THR 122           HG1      THR 122   2.915   1.095   1.095
  982   1HG2  THR 122          3HG2      THR 122   0.724   1.485   1.485
  983   2HG2  THR 122          2HG2      THR 122   1.100   0.044   0.044
  984   3HG2  THR 122          1HG2      THR 122  -0.362   0.096   0.096
  985    H    MET 123           H        MET 123  -1.173  -0.968  -0.968
  986    HA   MET 123           HA       MET 123  -0.664  -2.797  -2.797
  987   1HB   MET 123          2HB       MET 123  -3.184  -1.113  -1.113
  988   2HB   MET 123          1HB       MET 123  -2.830  -2.344  -2.344
  989   1HG   MET 123          2HG       MET 123  -0.765  -0.990  -0.990
  990   2HG   MET 123          1HG       MET 123  -1.410   0.294   0.294
  991   1HE   MET 123          3HE       MET 123  -0.973  -1.228  -1.228
  992   2HE   MET 123          2HE       MET 123  -2.140  -0.605  -0.605
  993   3HE   MET 123          1HE       MET 123  -2.537  -2.030  -2.030
  994    H    THR 124           H        THR 124  -2.319  -4.541  -4.541
  995    HA   THR 124           HA       THR 124  -3.886  -4.874  -4.874
  996    HB   THR 124           HB       THR 124  -2.018  -7.059  -7.059
  997    HG1  THR 124           HG1      THR 124  -0.814  -5.234  -5.234
  998   1HG2  THR 124          1HG2      THR 124  -4.025  -7.633  -7.633
  999   2HG2  THR 124          3HG2      THR 124  -3.478  -6.511  -6.511
 1000   3HG2  THR 124          2HG2      THR 124  -2.524  -7.945  -7.945
 1001    H    ALA 125           H        ALA 125  -5.504  -6.479  -6.479
 1002    HA   ALA 125           HA       ALA 125  -5.796  -7.982  -7.982
 1003   1HB   ALA 125          2HB       ALA 125  -7.686  -5.692  -5.692
 1004   2HB   ALA 125          1HB       ALA 125  -7.934  -6.896  -6.896
 1005   3HB   ALA 125          3HB       ALA 125  -6.571  -5.782  -5.782
 1006    H    ASP 126           H        ASP 126  -6.104  -9.822  -9.822
 1007    HA   ASP 126           HA       ASP 126  -7.405 -11.436 -11.436
 1008   1HB   ASP 126          2HB       ASP 126  -9.345  -9.525  -9.525
 1009   2HB   ASP 126          1HB       ASP 126  -9.663  -9.876  -9.876
 1010    H    ASP 127           H        ASP 127  -8.531  -8.584  -8.584
 1011    HA   ASP 127           HA       ASP 127  -6.582  -9.145  -9.145
 1012   1HB   ASP 127          2HB       ASP 127  -9.500  -9.721  -9.721
 1013   2HB   ASP 127          1HB       ASP 127  -8.737  -8.956  -8.956
 1014    H    VAL 128           H        VAL 128  -7.360  -6.979  -6.979
 1015    HA   VAL 128           HA       VAL 128  -7.755  -4.798  -4.798
 1016    HB   VAL 128           HB       VAL 128  -8.802  -3.477  -3.477
 1017   1HG1  VAL 128          1HG1      VAL 128  -9.885  -6.266  -6.266
 1018   2HG1  VAL 128          3HG1      VAL 128 -10.774  -5.055  -5.055
 1019   3HG1  VAL 128          2HG1      VAL 128 -10.399  -4.768  -4.768
 1020   1HG2  VAL 128          2HG2      VAL 128  -7.724  -5.668  -5.668
 1021   2HG2  VAL 128          1HG2      VAL 128  -8.004  -3.976  -3.976
 1022   3HG2  VAL 128          3HG2      VAL 128  -9.343  -5.123  -5.123
 1023    H    VAL 129           H        VAL 129  -6.814  -2.667  -2.667
 1024    HA   VAL 129           HA       VAL 129  -4.456  -3.243  -3.243
 1025    HB   VAL 129           HB       VAL 129  -4.304  -2.747  -2.747
 1026   1HG1  VAL 129          3HG1      VAL 129  -2.544  -1.391  -1.391
 1027   2HG1  VAL 129          2HG1      VAL 129  -1.790  -2.047  -2.047
 1028   3HG1  VAL 129          1HG1      VAL 129  -3.060  -0.831  -0.831
 1029   1HG2  VAL 129          3HG2      VAL 129  -2.999  -4.449  -4.449
 1030   2HG2  VAL 129          2HG2      VAL 129  -3.640  -4.894  -4.894
 1031   3HG2  VAL 129          1HG2      VAL 129  -2.082  -4.077  -4.077
 1032    H    CYS 130           H        CYS 130  -4.480  -1.624  -1.624
 1033    HA   CYS 130           HA       CYS 130  -5.587   1.024   1.024
 1034   1HB   CYS 130          2HB       CYS 130  -6.311  -0.285  -0.285
 1035   2HB   CYS 130          1HB       CYS 130  -4.776   0.272   0.272
 1036    HG   CYS 130           HG       CYS 130  -6.677   2.423   2.423
 1037    H    THR 131           H        THR 131  -4.232   2.801   2.801
 1038    HA   THR 131           HA       THR 131  -1.401   2.436   2.436
 1039    HB   THR 131           HB       THR 131  -2.451   3.813   3.813
 1040    HG1  THR 131           HG1      THR 131  -1.594   2.096   2.096
 1041   1HG2  THR 131          3HG2      THR 131   0.243   3.687   3.687
 1042   2HG2  THR 131          2HG2      THR 131   0.146   3.708   3.708
 1043   3HG2  THR 131          1HG2      THR 131  -0.539   5.035   5.035
 1044    H    ARG 132           H        ARG 132  -0.786   4.009   4.009
 1045    HA   ARG 132           HA       ARG 132  -2.233   6.620   6.620
 1046   1HB   ARG 132          2HB       ARG 132  -1.118   5.128   5.128
 1047   2HB   ARG 132          1HB       ARG 132  -1.851   6.731   6.731
 1048   1HG   ARG 132          2HG       ARG 132  -3.819   5.399   5.399
 1049   2HG   ARG 132          1HG       ARG 132  -3.137   4.069   4.069
 1050   1HD   ARG 132          2HD       ARG 132  -3.653   6.689   6.689
 1051   2HD   ARG 132          1HD       ARG 132  -5.011   5.609   5.609
 1052    HE   ARG 132           HE       ARG 132  -2.752   4.265   4.265
 1053   1HH1  ARG 132          1HH2      ARG 132  -5.982   4.406   4.406
 1054   2HH1  ARG 132          2HH2      ARG 132  -6.110   4.624   4.624
 1055   1HH2  ARG 132          2HH1      ARG 132  -2.738   5.302   5.302
 1056   2HH2  ARG 132          1HH1      ARG 132  -4.274   5.133   5.133
 1057    H    VAL 133           H        VAL 133  -0.711   7.838   7.838
 1058    HA   VAL 133           HA       VAL 133   2.142   7.475   7.475
 1059    HB   VAL 133           HB       VAL 133   0.629   9.902   9.902
 1060   1HG1  VAL 133          3HG1      VAL 133   3.498   8.983   8.983
 1061   2HG1  VAL 133          2HG1      VAL 133   2.783  10.215  10.215
 1062   3HG1  VAL 133          1HG1      VAL 133   2.917  10.496  10.496
 1063   1HG2  VAL 133          3HG2      VAL 133   1.324   7.271   7.271
 1064   2HG2  VAL 133          2HG2      VAL 133  -0.075   8.305   8.305
 1065   3HG2  VAL 133          1HG2      VAL 133   1.481   8.699   8.699
 1066    H    TYR 134           H        TYR 134   3.551   8.437   8.437
 1067    HA   TYR 134           HA       TYR 134   2.352  10.426  10.426
 1068   1HB   TYR 134          2HB       TYR 134   3.974   7.967   7.967
 1069   2HB   TYR 134          1HB       TYR 134   4.065   9.351   9.351
 1070    HD1  TYR 134           HD2      TYR 134   2.054  10.167  10.167
 1071    HD2  TYR 134           HD1      TYR 134   1.971   6.643   6.643
 1072    HE1  TYR 134           HE2      TYR 134  -0.099   9.504   9.504
 1073    HE2  TYR 134           HE1      TYR 134  -0.183   5.971   5.971
 1074    HH   TYR 134           HH       TYR 134  -2.091   7.099   7.099
 1075    H    VAL 135           H        VAL 135   3.509  12.239  12.239
 1076    HA   VAL 135           HA       VAL 135   6.331  12.218  12.218
 1077    HB   VAL 135           HB       VAL 135   4.167  13.883  13.883
 1078   1HG1  VAL 135          2HG1      VAL 135   6.197  15.431  15.431
 1079   2HG1  VAL 135          1HG1      VAL 135   5.031  16.161  16.161
 1080   3HG1  VAL 135          3HG1      VAL 135   4.470  15.300  15.300
 1081   1HG2  VAL 135          1HG2      VAL 135   7.157  14.053  14.053
 1082   2HG2  VAL 135          3HG2      VAL 135   5.965  13.305  13.305
 1083   3HG2  VAL 135          2HG2      VAL 135   6.006  15.058  15.058
 1084    H    ARG 136           H        ARG 136   7.921  12.899  12.899
 1085    HA   ARG 136           HA       ARG 136   7.489  12.653  12.653
 1086   1HB   ARG 136          2HB       ARG 136   9.637  13.571  13.571
 1087   2HB   ARG 136          1HB       ARG 136   9.542  14.576  14.576
 1088   1HG   ARG 136          2HG       ARG 136   9.945  12.816  12.816
 1089   2HG   ARG 136          1HG       ARG 136   9.313  11.613  11.613
 1090   1HD   ARG 136          2HD       ARG 136  11.989  13.028  13.028
 1091   2HD   ARG 136          1HD       ARG 136  11.690  11.298  11.298
 1092    HE   ARG 136           HE       ARG 136  10.510  11.882  11.882
 1093   1HH1  ARG 136          1HH2      ARG 136  13.551  11.120  11.120
 1094   2HH1  ARG 136          2HH2      ARG 136  14.407  11.818  11.818
 1095   1HH2  ARG 136          2HH1      ARG 136  11.617  13.426  13.426
 1096   2HH2  ARG 136          1HH1      ARG 136  13.312  13.127  13.127
 1097    H    GLU 137           HN       GLU 137   6.584  13.803  13.803
 1098    HA   GLU 137           HA       GLU 137   4.988  16.056  16.056
 1099   1HB   GLU 137          2HB       GLU 137   5.405  14.458  14.458
 1100   2HB   GLU 137          1HB       GLU 137   6.522  15.720  15.720
 1101   1HG   GLU 137          2HG       GLU 137   3.630  16.210  16.210
 1102   2HG   GLU 137          1HG       GLU 137   4.200  15.980  15.980

  Start of MODEL   19
    1   1H    PRO   1          1H        PRO   1 -16.513   8.112   8.112
    2   2H    PRO   1          2H        PRO   1 -16.005   7.370   7.370
    3    HA   PRO   1           HA       PRO   1 -15.663   5.450   5.450
    4   1HB   PRO   1          2HB       PRO   1 -18.102   5.029   5.029
    5   2HB   PRO   1          1HB       PRO   1 -17.587   4.275   4.275
    6   1HG   PRO   1          2HG       PRO   1 -19.608   6.272   6.272
    7   2HG   PRO   1          1HG       PRO   1 -19.098   5.505   5.505
    8   1HD   PRO   1          1HD       PRO   1 -18.592   8.185   8.185
    9   2HD   PRO   1          2HD       PRO   1 -18.066   7.407   7.407
   10    H    ASN   2           H        ASN   2 -16.332   4.374   4.374
   11    HA   ASN   2           HA       ASN   2 -15.804   4.468   4.468
   12   1HB   ASN   2          2HB       ASN   2 -16.940   7.155   7.155
   13   2HB   ASN   2          1HB       ASN   2 -16.005   7.006   7.006
   14   1HD2  ASN   2          2HD2      ASN   2 -18.438   5.020   5.020
   15   2HD2  ASN   2          1HD2      ASN   2 -16.875   5.678   5.678
   16    H    PHE   3           H        PHE   3 -13.807   4.294   4.294
   17    HA   PHE   3           HA       PHE   3 -11.643   6.035   6.035
   18   1HB   PHE   3          2HB       PHE   3 -11.596   3.464   3.464
   19   2HB   PHE   3          1HB       PHE   3 -10.171   4.326   4.326
   20    HD1  PHE   3           HD1      PHE   3 -13.400   3.161   3.161
   21    HD2  PHE   3           HD2      PHE   3  -9.114   3.345   3.345
   22    HE1  PHE   3           HE1      PHE   3 -13.461   1.932   1.932
   23    HE2  PHE   3           HE2      PHE   3  -9.183   2.102   2.102
   24    HZ   PHE   3           HZ       PHE   3 -11.356   1.389   1.389
   25    H    SER   4           H        SER   4 -13.729   5.924   5.924
   26    HA   SER   4           HA       SER   4 -11.916   6.360   6.360
   27   1HB   SER   4          2HB       SER   4 -13.873   6.917   6.917
   28   2HB   SER   4          1HB       SER   4 -14.301   5.598   5.598
   29    HG   SER   4           HG       SER   4 -15.414   7.990   7.990
   30    H    GLY   5           H        GLY   5 -10.687   8.074   8.074
   31   1HA   GLY   5          2HA       GLY   5 -11.424  10.688  10.688
   32   2HA   GLY   5          1HA       GLY   5 -11.111  10.624  10.624
   33    H    ASN   6           H        ASN   6  -9.347  12.202  12.202
   34    HA   ASN   6           HA       ASN   6  -6.972  10.724  10.724
   35   1HB   ASN   6          2HB       ASN   6  -7.712  13.644  13.644
   36   2HB   ASN   6          1HB       ASN   6  -6.014  13.178  13.178
   37   1HD2  ASN   6          2HD2      ASN   6  -6.621  11.660  11.660
   38   2HD2  ASN   6          1HD2      ASN   6  -5.980  11.147  11.147
   39    H    TRP   7           H        TRP   7  -4.881  11.379  11.379
   40    HA   TRP   7           HA       TRP   7  -5.476  11.818  11.818
   41   1HB   TRP   7          2HB       TRP   7  -4.283   9.269   9.269
   42   2HB   TRP   7          1HB       TRP   7  -4.294   9.695   9.695
   43    HD1  TRP   7           HD1      TRP   7  -6.440   8.285   8.285
   44    HE1  TRP   7           HE1      TRP   7  -8.842   7.880   7.880
   45    HE3  TRP   7           HE3      TRP   7  -6.111  10.739  10.739
   46    HZ2  TRP   7           HZ2      TRP   7 -10.405   8.557   8.557
   47    HZ3  TRP   7           HZ3      TRP   7  -8.060  10.890  10.890
   48    HH2  TRP   7           HH2      TRP   7 -10.187   9.796   9.796
   49    H    LYS   8           H        LYS   8  -3.993  13.141  13.141
   50    HA   LYS   8           HA       LYS   8  -1.228  13.022  13.022
   51   1HB   LYS   8          2HB       LYS   8  -2.801  15.347  15.347
   52   2HB   LYS   8          1HB       LYS   8  -1.055  15.403  15.403
   53   1HG   LYS   8          2HG       LYS   8  -1.626  14.616  14.616
   54   2HG   LYS   8          1HG       LYS   8  -3.244  15.213  15.213
   55   1HD   LYS   8          2HD       LYS   8  -2.366  17.423  17.423
   56   2HD   LYS   8          1HD       LYS   8  -0.710  16.849  16.849
   57   1HE   LYS   8          2HE       LYS   8  -2.663  16.512  16.512
   58   2HE   LYS   8          1HE       LYS   8  -1.921  18.089  18.089
   59   1HZ   LYS   8          2HZ       LYS   8   0.261  16.871  16.871
   60   2HZ   LYS   8          1HZ       LYS   8  -0.571  15.514  15.514
   61   3HZ   LYS   8          3HZ       LYS   8  -0.517  16.942  16.942
   62    H    ILE   9           H        ILE   9   0.041  11.991  11.991
   63    HA   ILE   9           HA       ILE   9  -0.630  11.299  11.299
   64    HB   ILE   9           HB       ILE   9   1.064  10.132  10.132
   65   1HG1  ILE   9          2HG1      ILE   9   2.289  11.433  11.433
   66   2HG1  ILE   9          1HG1      ILE   9   1.210  10.039  10.039
   67   1HG2  ILE   9          3HG2      ILE   9   2.604  12.728  12.728
   68   2HG2  ILE   9          2HG2      ILE   9   3.322  11.213  11.213
   69   3HG2  ILE   9          1HG2      ILE   9   2.037  11.970  11.970
   70   1HD1  ILE   9          1HD1      ILE   9   3.159   9.300   9.300
   71   2HD1  ILE   9          3HD1      ILE   9   4.072  10.161  10.161
   72   3HD1  ILE   9          2HD1      ILE   9   3.079   8.775   8.775
   73    H    ILE  10           H        ILE  10   0.174  12.008  12.008
   74    HA   ILE  10           HA       ILE  10   1.187  14.813  14.813
   75    HB   ILE  10           HB       ILE  10  -0.214  15.203  15.203
   76   1HG1  ILE  10          2HG1      ILE  10  -2.164  13.243  13.243
   77   2HG1  ILE  10          1HG1      ILE  10  -0.696  12.309  12.309
   78   1HG2  ILE  10          2HG2      ILE  10  -0.994  15.593  15.593
   79   2HG2  ILE  10          1HG2      ILE  10  -1.976  14.143  14.143
   80   3HG2  ILE  10          3HG2      ILE  10  -2.242  15.547  15.547
   81   1HD1  ILE  10          2HD1      ILE  10   0.236  13.786  13.786
   82   2HD1  ILE  10          1HD1      ILE  10  -1.476  13.948  13.948
   83   3HD1  ILE  10          3HD1      ILE  10  -0.733  12.350  12.350
   84    H    ARG  11           H        ARG  11   1.151  11.590  11.590
   85    HA   ARG  11           HA       ARG  11   3.710  12.254  12.254
   86   1HB   ARG  11          2HB       ARG  11   1.399  12.279  12.279
   87   2HB   ARG  11          1HB       ARG  11   1.885  10.593  10.593
   88   1HG   ARG  11          2HG       ARG  11   3.043  11.581  11.581
   89   2HG   ARG  11          1HG       ARG  11   4.257  11.621  11.621
   90   1HD   ARG  11          2HD       ARG  11   4.241  13.884  13.884
   91   2HD   ARG  11          1HD       ARG  11   2.480  13.959  13.959
   92    HE   ARG  11           HE       ARG  11   3.662  13.259  13.259
   93   1HH1  ARG  11          2HH1      ARG  11   1.168  14.916  14.916
   94   2HH1  ARG  11          1HH1      ARG  11   1.708  16.491  16.491
   95   1HH2  ARG  11          1HH2      ARG  11   5.074  15.671  15.671
   96   2HH2  ARG  11          2HH2      ARG  11   3.919  16.919  16.919
   97    H    SER  12           H        SER  12   4.638  10.067  10.067
   98    HA   SER  12           HA       SER  12   3.747   7.557   7.557
   99   1HB   SER  12          2HB       SER  12   4.184   8.281   8.281
  100   2HB   SER  12          1HB       SER  12   5.690   9.060   9.060
  101    HG   SER  12           HG       SER  12   6.332   7.159   7.159
  102    H    GLU  13           H        GLU  13   5.486   5.883   5.883
  103    HA   GLU  13           HA       GLU  13   7.953   6.622   6.622
  104   1HB   GLU  13          2HB       GLU  13   7.359   5.247   5.247
  105   2HB   GLU  13          1HB       GLU  13   6.474   6.764   6.764
  106   1HG   GLU  13          2HG       GLU  13   5.174   4.482   4.482
  107   2HG   GLU  13          1HG       GLU  13   5.303   4.311   4.311
  108    H    ASN  14           H        ASN  14   9.257   4.652   4.652
  109    HA   ASN  14           HA       ASN  14  10.177   2.599   2.599
  110   1HB   ASN  14          2HB       ASN  14   7.412   1.747   1.747
  111   2HB   ASN  14          1HB       ASN  14   8.728   0.735   0.735
  112   1HD2  ASN  14          2HD2      ASN  14   6.138   2.056   2.056
  113   2HD2  ASN  14          1HD2      ASN  14   5.850   2.052   2.052
  114    H    PHE  15           H        PHE  15   9.931   4.750   4.750
  115    HA   PHE  15           HA       PHE  15   9.182   3.579   3.579
  116   1HB   PHE  15          2HB       PHE  15   9.217   6.071   6.071
  117   2HB   PHE  15          1HB       PHE  15  10.964   5.973   5.973
  118    HD1  PHE  15           HD2      PHE  15  10.115   3.675   3.675
  119    HD2  PHE  15           HD1      PHE  15   9.791   7.893   7.893
  120    HE1  PHE  15           HE2      PHE  15  10.031   4.071   4.071
  121    HE2  PHE  15           HE1      PHE  15   9.691   8.278   8.278
  122    HZ   PHE  15           HZ       PHE  15   9.811   6.352   6.352
  123    H    GLU  16           H        GLU  16  12.378   4.715   4.715
  124    HA   GLU  16           HA       GLU  16  13.893   3.482   3.482
  125   1HB   GLU  16          2HB       GLU  16  14.633   4.178   4.178
  126   2HB   GLU  16          1HB       GLU  16  15.801   3.668   3.668
  127   1HG   GLU  16          2HG       GLU  16  15.625   5.630   5.630
  128   2HG   GLU  16          1HG       GLU  16  13.937   5.874   5.874
  129    H    GLU  17           H        GLU  17  12.710   2.139   2.139
  130    HA   GLU  17           HA       GLU  17  14.349  -0.215  -0.215
  131   1HB   GLU  17          2HB       GLU  17  12.901  -1.137  -1.137
  132   2HB   GLU  17          1HB       GLU  17  13.370   0.520   0.520
  133   1HG   GLU  17          2HG       GLU  17  11.180   0.946   0.946
  134   2HG   GLU  17          1HG       GLU  17  11.047   0.838   0.838
  135    H    LEU  18           H        LEU  18  11.225   0.637   0.637
  136    HA   LEU  18           HA       LEU  18  10.542  -2.094  -2.094
  137   1HB   LEU  18          2HB       LEU  18   8.903  -0.109  -0.109
  138   2HB   LEU  18          1HB       LEU  18   9.426   0.388   0.388
  139    HG   LEU  18           HG       LEU  18   8.886  -1.953  -1.953
  140   1HD1  LEU  18          2HD1      LEU  18   8.023  -2.097  -2.097
  141   2HD1  LEU  18          1HD1      LEU  18   7.057  -2.954  -2.954
  142   3HD1  LEU  18          3HD1      LEU  18   8.769  -3.334  -3.334
  143   1HD2  LEU  18          1HD2      LEU  18   7.048   0.207   0.207
  144   2HD2  LEU  18          3HD2      LEU  18   7.117  -0.754  -0.754
  145   3HD2  LEU  18          2HD2      LEU  18   6.237  -1.357  -1.357
  146    H    LEU  19           H        LEU  19  12.478   0.436   0.436
  147    HA   LEU  19           HA       LEU  19  12.362  -0.789  -0.789
  148   1HB   LEU  19          2HB       LEU  19  14.252   1.414   1.414
  149   2HB   LEU  19          1HB       LEU  19  13.619   1.072   1.072
  150    HG   LEU  19           HG       LEU  19  12.182   2.313   2.313
  151   1HD1  LEU  19          1HD1      LEU  19  13.538   3.397   3.397
  152   2HD1  LEU  19          3HD1      LEU  19  11.851   3.475   3.475
  153   3HD1  LEU  19          2HD1      LEU  19  12.355   4.226   4.226
  154   1HD2  LEU  19          1HD2      LEU  19  10.711   0.554   0.554
  155   2HD2  LEU  19          3HD2      LEU  19  10.081   2.191   2.191
  156   3HD2  LEU  19          2HD2      LEU  19  10.871   1.416   1.416
  157    H    LYS  20           H        LYS  20  14.188  -1.085  -1.085
  158    HA   LYS  20           HA       LYS  20  16.590  -2.163  -2.163
  159   1HB   LYS  20          2HB       LYS  20  15.915  -2.379  -2.379
  160   2HB   LYS  20          1HB       LYS  20  17.507  -2.413  -2.413
  161   1HG   LYS  20          2HG       LYS  20  16.202   0.055   0.055
  162   2HG   LYS  20          1HG       LYS  20  16.112  -0.162  -0.162
  163   1HD   LYS  20          2HD       LYS  20  18.638  -0.309  -0.309
  164   2HD   LYS  20          1HD       LYS  20  18.165   1.040   1.040
  165   1HE   LYS  20          2HE       LYS  20  18.148  -1.556  -1.556
  166   2HE   LYS  20          1HE       LYS  20  19.741  -1.065  -1.065
  167   1HZ   LYS  20          2HZ       LYS  20  19.382   1.098   1.098
  168   2HZ   LYS  20          1HZ       LYS  20  17.907   0.534   0.534
  169   3HZ   LYS  20          3HZ       LYS  20  19.364  -0.185  -0.185
  170    H    VAL  21           H        VAL  21  13.659  -3.226  -3.226
  171    HA   VAL  21           HA       VAL  21  14.380  -6.037  -6.037
  172    HB   VAL  21           HB       VAL  21  12.697  -4.952  -4.952
  173   1HG1  VAL  21          3HG1      VAL  21  11.704  -3.445  -3.445
  174   2HG1  VAL  21          2HG1      VAL  21  10.981  -4.818  -4.818
  175   3HG1  VAL  21          1HG1      VAL  21  10.480  -4.407  -4.407
  176   1HG2  VAL  21          1HG2      VAL  21  12.094  -7.325  -7.325
  177   2HG2  VAL  21          3HG2      VAL  21  12.347  -7.236  -7.236
  178   3HG2  VAL  21          2HG2      VAL  21  10.806  -6.730  -6.730
  179    H    LEU  22           H        LEU  22  12.586  -3.923  -3.923
  180    HA   LEU  22           HA       LEU  22  11.618  -5.919  -5.919
  181   1HB   LEU  22          2HB       LEU  22  11.797  -2.973  -2.973
  182   2HB   LEU  22          1HB       LEU  22  11.821  -3.586  -3.586
  183    HG   LEU  22           HG       LEU  22   9.712  -4.728  -4.728
  184   1HD1  LEU  22          2HD1      LEU  22  10.148  -5.343  -5.343
  185   2HD1  LEU  22          1HD1      LEU  22   9.748  -3.685  -3.685
  186   3HD1  LEU  22          3HD1      LEU  22   8.528  -4.720  -4.720
  187   1HD2  LEU  22          1HD2      LEU  22   9.890  -2.158  -2.158
  188   2HD2  LEU  22          3HD2      LEU  22   8.326  -2.820  -2.820
  189   3HD2  LEU  22          2HD2      LEU  22   9.356  -2.039  -2.039
  190    H    GLY  23           H        GLY  23  14.378  -3.719  -3.719
  191   1HA   GLY  23          2HA       GLY  23  15.487  -5.083  -5.083
  192   2HA   GLY  23          1HA       GLY  23  16.014  -3.519  -3.519
  193    H    VAL  24           H        VAL  24  18.181  -4.389  -4.389
  194    HA   VAL  24           HA       VAL  24  19.004  -5.776  -5.776
  195    HB   VAL  24           HB       VAL  24  20.504  -7.296  -7.296
  196   1HG1  VAL  24          2HG1      VAL  24  18.320  -8.076  -8.076
  197   2HG1  VAL  24          1HG1      VAL  24  17.543  -7.516  -7.516
  198   3HG1  VAL  24          3HG1      VAL  24  18.707  -8.839  -8.839
  199   1HG2  VAL  24          2HG2      VAL  24  18.930  -6.091  -6.091
  200   2HG2  VAL  24          1HG2      VAL  24  20.680  -6.090  -6.090
  201   3HG2  VAL  24          3HG2      VAL  24  19.836  -7.597  -7.597
  202    H    ASN  25           H        ASN  25  19.980  -4.056  -4.056
  203    HA   ASN  25           HA       ASN  25  22.686  -3.520  -3.520
  204   1HB   ASN  25          2HB       ASN  25  21.168  -3.049  -3.049
  205   2HB   ASN  25          1HB       ASN  25  21.130  -1.448  -1.448
  206   1HD2  ASN  25          2HD2      ASN  25  24.346  -0.658  -0.658
  207   2HD2  ASN  25          1HD2      ASN  25  22.841  -0.120  -0.120
  208    H    VAL  26           H        VAL  26  22.718  -0.608  -0.608
  209    HA   VAL  26           HA       VAL  26  21.464   0.062   0.062
  210    HB   VAL  26           HB       VAL  26  23.499   1.661   1.661
  211   1HG1  VAL  26          1HG1      VAL  26  23.352  -1.280  -1.280
  212   2HG1  VAL  26          3HG1      VAL  26  24.911  -0.497  -0.497
  213   3HG1  VAL  26          2HG1      VAL  26  23.494   0.033   0.033
  214   1HG2  VAL  26          2HG2      VAL  26  24.519  -0.321  -0.321
  215   2HG2  VAL  26          1HG2      VAL  26  24.485   1.437   1.437
  216   3HG2  VAL  26          3HG2      VAL  26  25.578   0.661   0.661
  217    H    MET  27           H        MET  27  22.807   1.411   1.411
  218    HA   MET  27           HA       MET  27  21.574   4.005   4.005
  219   1HB   MET  27          2HB       MET  27  23.488   3.149   3.149
  220   2HB   MET  27          1HB       MET  27  22.119   2.878   2.878
  221   1HG   MET  27          2HG       MET  27  21.467   5.181   5.181
  222   2HG   MET  27          1HG       MET  27  22.578   5.501   5.501
  223   1HE   MET  27          1HE       MET  27  24.157   6.853   6.853
  224   2HE   MET  27          3HE       MET  27  25.244   7.142   7.142
  225   3HE   MET  27          2HE       MET  27  23.572   7.695   7.695
  226    H    LEU  28           H        LEU  28  20.532   0.919   0.919
  227    HA   LEU  28           HA       LEU  28  18.295   1.676   1.676
  228   1HB   LEU  28          2HB       LEU  28  19.359  -0.714  -0.714
  229   2HB   LEU  28          1HB       LEU  28  17.603  -0.718  -0.718
  230    HG   LEU  28           HG       LEU  28  18.588  -1.766  -1.766
  231   1HD1  LEU  28          2HD1      LEU  28  16.520  -0.109  -0.109
  232   2HD1  LEU  28          1HD1      LEU  28  17.600   0.875   0.875
  233   3HD1  LEU  28          3HD1      LEU  28  17.166  -0.754  -0.754
  234   1HD2  LEU  28          3HD2      LEU  28  20.719  -0.436  -0.436
  235   2HD2  LEU  28          2HD2      LEU  28  20.002  -0.515  -0.515
  236   3HD2  LEU  28          1HD2      LEU  28  19.826   0.946   0.946
  237    H    ARG  29           H        ARG  29  18.726   1.888   1.888
  238    HA   ARG  29           HA       ARG  29  15.800   1.913   1.913
  239   1HB   ARG  29          2HB       ARG  29  18.111   2.141   2.141
  240   2HB   ARG  29          1HB       ARG  29  16.409   2.001   2.001
  241   1HG   ARG  29          2HG       ARG  29  16.582  -0.242  -0.242
  242   2HG   ARG  29          1HG       ARG  29  16.970  -0.129  -0.129
  243   1HD   ARG  29          2HD       ARG  29  19.313  -0.026  -0.026
  244   2HD   ARG  29          1HD       ARG  29  19.054   0.268   0.268
  245    HE   ARG  29           HE       ARG  29  18.230  -2.328  -2.328
  246   1HH1  ARG  29          1HH2      ARG  29  20.682  -0.734  -0.734
  247   2HH1  ARG  29          2HH2      ARG  29  20.851  -1.987  -1.987
  248   1HH2  ARG  29          2HH1      ARG  29  18.185  -3.852  -3.852
  249   2HH2  ARG  29          1HH1      ARG  29  19.446  -3.746  -3.746
  250    H    LYS  30           H        LYS  30  18.634   4.015   4.015
  251    HA   LYS  30           HA       LYS  30  17.145   6.264   6.264
  252   1HB   LYS  30          2HB       LYS  30  19.708   5.805   5.805
  253   2HB   LYS  30          1HB       LYS  30  19.730   6.550   6.550
  254   1HG   LYS  30          2HG       LYS  30  19.522   8.618   8.618
  255   2HG   LYS  30          1HG       LYS  30  18.127   8.133   8.133
  256   1HD   LYS  30          2HD       LYS  30  19.773   8.791   8.791
  257   2HD   LYS  30          1HD       LYS  30  19.810   7.028   7.028
  258   1HE   LYS  30          2HE       LYS  30  22.059   7.357   7.357
  259   2HE   LYS  30          1HE       LYS  30  21.612   7.520   7.520
  260   1HZ   LYS  30          3HZ       LYS  30  21.563   9.854   9.854
  261   2HZ   LYS  30          2HZ       LYS  30  23.016   9.352   9.352
  262   3HZ   LYS  30          1HZ       LYS  30  21.698   9.816   9.816
  263    H    ILE  31           H        ILE  31  17.682   5.050   5.050
  264    HA   ILE  31           HA       ILE  31  17.031   7.577   7.577
  265    HB   ILE  31           HB       ILE  31  17.063   4.738   4.738
  266   1HG1  ILE  31          2HG1      ILE  31  19.084   6.937   6.937
  267   2HG1  ILE  31          1HG1      ILE  31  19.237   5.818   5.818
  268   1HG2  ILE  31          3HG2      ILE  31  16.519   7.425   7.425
  269   2HG2  ILE  31          2HG2      ILE  31  17.416   6.246   6.246
  270   3HG2  ILE  31          1HG2      ILE  31  15.796   5.861   5.861
  271   1HD1  ILE  31          2HD1      ILE  31  18.753   4.696   4.696
  272   2HD1  ILE  31          1HD1      ILE  31  20.371   5.269   5.269
  273   3HD1  ILE  31          3HD1      ILE  31  19.626   3.989   3.989
  274    H    ALA  32           H        ALA  32  15.276   4.806   4.806
  275    HA   ALA  32           HA       ALA  32  12.779   5.537   5.537
  276   1HB   ALA  32          3HB       ALA  32  13.512   3.489   3.489
  277   2HB   ALA  32          2HB       ALA  32  11.842   3.764   3.764
  278   3HB   ALA  32          1HB       ALA  32  13.032   3.206   3.206
  279    H    VAL  33           H        VAL  33  14.408   6.222   6.222
  280    HA   VAL  33           HA       VAL  33  12.084   7.194   7.194
  281    HB   VAL  33           HB       VAL  33  14.990   7.888   7.888
  282   1HG1  VAL  33          1HG1      VAL  33  12.817   8.887   8.887
  283   2HG1  VAL  33          3HG1      VAL  33  12.969   7.400   7.400
  284   3HG1  VAL  33          2HG1      VAL  33  14.302   8.554   8.554
  285   1HG2  VAL  33          1HG2      VAL  33  14.022   5.289   5.289
  286   2HG2  VAL  33          3HG2      VAL  33  15.432   5.797   5.797
  287   3HG2  VAL  33          2HG2      VAL  33  13.863   5.664   5.664
  288    H    ALA  34           H        ALA  34  14.656   8.529   8.529
  289    HA   ALA  34           HA       ALA  34  13.782  11.287  11.287
  290   1HB   ALA  34          3HB       ALA  34  15.862   9.862   9.862
  291   2HB   ALA  34          2HB       ALA  34  15.366  11.475  11.475
  292   3HB   ALA  34          1HB       ALA  34  16.049  11.232  11.232
  293    H    ALA  35           H        ALA  35  13.251   8.644   8.644
  294    HA   ALA  35           HA       ALA  35  12.051  10.116  10.116
  295   1HB   ALA  35          3HB       ALA  35  11.665   7.252   7.252
  296   2HB   ALA  35          2HB       ALA  35  11.039   7.902   7.902
  297   3HB   ALA  35          1HB       ALA  35  12.780   7.815   7.815
  298    H    ALA  36           H        ALA  36  10.743   8.622   8.622
  299    HA   ALA  36           HA       ALA  36   7.982   9.027   9.027
  300   1HB   ALA  36          1HB       ALA  36   9.609   8.275   8.275
  301   2HB   ALA  36          3HB       ALA  36   8.381   9.426   9.426
  302   3HB   ALA  36          2HB       ALA  36   7.903   7.935   7.935
  303    H    SER  37           H        SER  37   9.890  10.976  10.976
  304    HA   SER  37           HA       SER  37   9.680  13.238  13.238
  305   1HB   SER  37          2HB       SER  37  10.857  13.412  13.412
  306   2HB   SER  37          1HB       SER  37   9.298  13.530  13.530
  307    HG   SER  37           HG       SER  37   9.512  15.584  15.584
  308    H    LYS  38           H        LYS  38   7.370  12.016  12.016
  309    HA   LYS  38           HA       LYS  38   5.100  12.451  12.451
  310   1HB   LYS  38          2HB       LYS  38   5.467  15.107  15.107
  311   2HB   LYS  38          1HB       LYS  38   4.275  14.694  14.694
  312   1HG   LYS  38          2HG       LYS  38   6.409  14.200  14.200
  313   2HG   LYS  38          1HG       LYS  38   7.201  15.275  15.275
  314   1HD   LYS  38          2HD       LYS  38   5.138  16.834  16.834
  315   2HD   LYS  38          1HD       LYS  38   4.980  15.880  15.880
  316   1HE   LYS  38          2HE       LYS  38   7.292  16.414  16.414
  317   2HE   LYS  38          1HE       LYS  38   7.500  17.322  17.322
  318   1HZ   LYS  38          3HZ       LYS  38   5.411  17.959  17.959
  319   2HZ   LYS  38          2HZ       LYS  38   6.950  18.678  18.678
  320   3HZ   LYS  38          1HZ       LYS  38   5.909  18.906  18.906
  321    HA   PRO  39           HA       PRO  39   4.509  11.349  11.349
  322   1HB   PRO  39          2HB       PRO  39   3.671   8.769   8.769
  323   2HB   PRO  39          1HB       PRO  39   5.356   9.232   9.232
  324   1HG   PRO  39          2HG       PRO  39   4.008   8.499   8.499
  325   2HG   PRO  39          1HG       PRO  39   5.706   8.311   8.311
  326   1HD   PRO  39          2HD       PRO  39   4.706  10.330  10.330
  327   2HD   PRO  39          1HD       PRO  39   6.279  10.363  10.363
  328    H    ALA  40           H        ALA  40   2.433  10.711  10.711
  329    HA   ALA  40           HA       ALA  40   0.099  11.488  11.488
  330   1HB   ALA  40          3HB       ALA  40   0.768  12.789  12.789
  331   2HB   ALA  40          2HB       ALA  40   0.135  11.393  11.393
  332   3HB   ALA  40          1HB       ALA  40  -0.924  12.327  12.327
  333    H    VAL  41           H        VAL  41  -2.007  10.427  10.427
  334    HA   VAL  41           HA       VAL  41  -1.667   7.718   7.718
  335    HB   VAL  41           HB       VAL  41  -2.555   8.308   8.308
  336   1HG1  VAL  41          1HG1      VAL  41  -2.958   5.796   5.796
  337   2HG1  VAL  41          3HG1      VAL  41  -3.072   5.840   5.840
  338   3HG1  VAL  41          2HG1      VAL  41  -4.203   6.772   6.772
  339   1HG2  VAL  41          1HG2      VAL  41  -0.425   6.559   6.559
  340   2HG2  VAL  41          3HG2      VAL  41  -0.189   7.956   7.956
  341   3HG2  VAL  41          2HG2      VAL  41  -0.880   6.469   6.469
  342    H    GLU  42           H        GLU  42  -3.901   6.731   6.731
  343    HA   GLU  42           HA       GLU  42  -6.178   8.601   8.601
  344   1HB   GLU  42          2HB       GLU  42  -5.023   9.166   9.166
  345   2HB   GLU  42          1HB       GLU  42  -5.159   7.478   7.478
  346   1HG   GLU  42          2HG       GLU  42  -7.751   8.010   8.010
  347   2HG   GLU  42          1HG       GLU  42  -7.229   9.610   9.610
  348    H    ILE  43           H        ILE  43  -7.598   7.238   7.238
  349    HA   ILE  43           HA       ILE  43  -7.549   4.371   4.371
  350    HB   ILE  43           HB       ILE  43  -8.807   5.888   5.888
  351   1HG1  ILE  43          2HG1      ILE  43  -7.143   3.624   3.624
  352   2HG1  ILE  43          1HG1      ILE  43  -6.273   4.649   4.649
  353   1HG2  ILE  43          3HG2      ILE  43  -9.281   3.077   3.077
  354   2HG2  ILE  43          2HG2      ILE  43  -9.260   3.411   3.411
  355   3HG2  ILE  43          1HG2      ILE  43 -10.423   4.231   4.231
  356   1HD1  ILE  43          3HD1      ILE  43  -7.687   6.155   6.155
  357   2HD1  ILE  43          2HD1      ILE  43  -6.432   5.085   5.085
  358   3HD1  ILE  43          1HD1      ILE  43  -6.028   6.312   6.312
  359    H    LYS  44           H        LYS  44  -9.120   3.437   3.437
  360    HA   LYS  44           HA       LYS  44 -11.488   5.086   5.086
  361   1HB   LYS  44          2HB       LYS  44 -10.836   2.573   2.573
  362   2HB   LYS  44          1HB       LYS  44 -11.473   4.093   4.093
  363   1HG   LYS  44          2HG       LYS  44  -9.219   5.119   5.119
  364   2HG   LYS  44          1HG       LYS  44  -8.583   3.609   3.609
  365   1HD   LYS  44          2HD       LYS  44  -9.105   2.460   2.460
  366   2HD   LYS  44          1HD       LYS  44  -9.919   3.892   3.892
  367   1HE   LYS  44          2HE       LYS  44  -7.122   4.289   4.289
  368   2HE   LYS  44          1HE       LYS  44  -7.330   3.314   3.314
  369   1HZ   LYS  44          3HZ       LYS  44  -8.722   5.898   5.898
  370   2HZ   LYS  44          2HZ       LYS  44  -7.131   5.825   5.825
  371   3HZ   LYS  44          1HZ       LYS  44  -8.387   5.044   5.044
  372    H    GLN  45           H        GLN  45 -12.815   4.525   4.525
  373    HA   GLN  45           HA       GLN  45 -13.168   1.645   1.645
  374   1HB   GLN  45          2HB       GLN  45 -13.001   2.590   2.590
  375   2HB   GLN  45          1HB       GLN  45 -13.417   4.186   4.186
  376   1HG   GLN  45          2HG       GLN  45 -15.132   3.593   3.593
  377   2HG   GLN  45          1HG       GLN  45 -15.859   3.380   3.380
  378   1HE2  GLN  45          2HE2      GLN  45 -16.040   0.323   0.323
  379   2HE2  GLN  45          1HE2      GLN  45 -16.031   1.965   1.965
  380    H    GLU  46           H        GLU  46 -14.847   0.532   0.532
  381    HA   GLU  46           HA       GLU  46 -17.356   1.993   1.993
  382   1HB   GLU  46          2HB       GLU  46 -15.868  -0.013  -0.013
  383   2HB   GLU  46          1HB       GLU  46 -17.567   0.385   0.385
  384   1HG   GLU  46          2HG       GLU  46 -16.870   2.821   2.821
  385   2HG   GLU  46          1HG       GLU  46 -15.197   2.263   2.263
  386    H    GLY  47           H        GLY  47 -17.361   0.899   0.899
  387   1HA   GLY  47          2HA       GLY  47 -18.923  -0.556  -0.556
  388   2HA   GLY  47          1HA       GLY  47 -18.953  -1.592  -1.592
  389    H    ASP  48           H        ASP  48 -18.129  -3.554  -3.554
  390    HA   ASP  48           HA       ASP  48 -16.105  -3.819  -3.819
  391   1HB   ASP  48          2HB       ASP  48 -16.018  -6.229  -6.229
  392   2HB   ASP  48          1HB       ASP  48 -17.551  -5.696  -5.696
  393    H    THR  49           H        THR  49 -15.826  -2.800  -2.800
  394    HA   THR  49           HA       THR  49 -13.242  -4.169  -4.169
  395    HB   THR  49           HB       THR  49 -15.070  -2.477  -2.477
  396    HG1  THR  49           HG1      THR  49 -15.481  -4.700  -4.700
  397   1HG2  THR  49          3HG2      THR  49 -12.171  -3.080  -3.080
  398   2HG2  THR  49          2HG2      THR  49 -13.227  -3.174  -3.174
  399   3HG2  THR  49          1HG2      THR  49 -13.100  -1.668  -1.668
  400    H    PHE  50           H        PHE  50 -11.313  -3.056  -3.056
  401    HA   PHE  50           HA       PHE  50 -11.450  -0.113  -0.113
  402   1HB   PHE  50          2HB       PHE  50  -9.932  -2.069  -2.069
  403   2HB   PHE  50          1HB       PHE  50  -9.795  -0.313  -0.313
  404    HD1  PHE  50           HD1      PHE  50 -11.962  -3.212  -3.212
  405    HD2  PHE  50           HD2      PHE  50 -11.649   1.061   1.061
  406    HE1  PHE  50           HE1      PHE  50 -13.997  -3.150  -3.150
  407    HE2  PHE  50           HE2      PHE  50 -13.674   1.118   1.118
  408    HZ   PHE  50           HZ       PHE  50 -14.861  -0.987  -0.987
  409    H    TYR  51           H        TYR  51 -10.045   0.870   0.870
  410    HA   TYR  51           HA       TYR  51  -7.814  -0.692  -0.692
  411   1HB   TYR  51          2HB       TYR  51  -9.593   0.276   0.276
  412   2HB   TYR  51          1HB       TYR  51  -9.145   1.871   1.871
  413    HD1  TYR  51           HD1      TYR  51  -6.533   2.431   2.431
  414    HD2  TYR  51           HD2      TYR  51  -8.614  -0.539  -0.539
  415    HE1  TYR  51           HE1      TYR  51  -4.790   2.550   2.550
  416    HE2  TYR  51           HE2      TYR  51  -6.876  -0.406  -0.406
  417    HH   TYR  51           HH       TYR  51  -5.198   1.251   1.251
  418    H    ILE  52           H        ILE  52  -5.700   0.197   0.197
  419    HA   ILE  52           HA       ILE  52  -5.502   2.732   2.732
  420    HB   ILE  52           HB       ILE  52  -3.354   0.720   0.720
  421   1HG1  ILE  52          2HG1      ILE  52  -5.483  -0.655  -0.655
  422   2HG1  ILE  52          1HG1      ILE  52  -4.567  -0.607  -0.607
  423   1HG2  ILE  52          3HG2      ILE  52  -4.723   2.931   2.931
  424   2HG2  ILE  52          2HG2      ILE  52  -4.006   1.651   1.651
  425   3HG2  ILE  52          1HG2      ILE  52  -3.003   2.570   2.570
  426   1HD1  ILE  52          3HD1      ILE  52  -6.674   1.466   1.466
  427   2HD1  ILE  52          2HD1      ILE  52  -7.210  -0.186  -0.186
  428   3HD1  ILE  52          1HD1      ILE  52  -6.171   0.632   0.632
  429    H    LYS  53           H        LYS  53  -4.659   4.157   4.157
  430    HA   LYS  53           HA       LYS  53  -2.405   3.194   3.194
  431   1HB   LYS  53          2HB       LYS  53  -4.718   4.379   4.379
  432   2HB   LYS  53          1HB       LYS  53  -3.694   5.796   5.796
  433   1HG   LYS  53          2HG       LYS  53  -1.952   4.186   4.186
  434   2HG   LYS  53          1HG       LYS  53  -3.462   3.560   3.560
  435   1HD   LYS  53          2HD       LYS  53  -4.002   5.561   5.561
  436   2HD   LYS  53          1HD       LYS  53  -3.084   6.527   6.527
  437   1HE   LYS  53          2HE       LYS  53  -1.567   6.646   6.646
  438   2HE   LYS  53          1HE       LYS  53  -1.079   5.058   5.058
  439   1HZ   LYS  53          3HZ       LYS  53  -3.260   5.309   5.309
  440   2HZ   LYS  53          2HZ       LYS  53  -1.641   5.347   5.347
  441   3HZ   LYS  53          1HZ       LYS  53  -2.244   3.986   3.986
  442    H    THR  54           H        THR  54  -0.530   3.734   3.734
  443    HA   THR  54           HA       THR  54  -0.384   6.383   6.383
  444    HB   THR  54           HB       THR  54   1.690   4.174   4.174
  445    HG1  THR  54           HG1      THR  54   0.498   3.157   3.157
  446   1HG2  THR  54          3HG2      THR  54   1.675   6.815   6.815
  447   2HG2  THR  54          2HG2      THR  54   1.409   5.787   5.787
  448   3HG2  THR  54          1HG2      THR  54   2.830   5.542   5.542
  449    H    SER  55           H        SER  55   1.216   7.912   7.912
  450    HA   SER  55           HA       SER  55   2.878   7.242   7.242
  451   1HB   SER  55          2HB       SER  55   2.151   9.599   9.599
  452   2HB   SER  55          1HB       SER  55   1.085   8.222   8.222
  453    HG   SER  55           HG       SER  55  -0.339   9.206   9.206
  454    H    THR  56           H        THR  56   4.860   8.143   8.143
  455    HA   THR  56           HA       THR  56   5.371  10.202  10.202
  456    HB   THR  56           HB       THR  56   7.815   9.237   9.237
  457    HG1  THR  56           HG1      THR  56   7.862   7.278   7.278
  458   1HG2  THR  56          3HG2      THR  56   5.586   8.017   8.017
  459   2HG2  THR  56          2HG2      THR  56   7.243   7.420   7.420
  460   3HG2  THR  56          1HG2      THR  56   6.876   9.091   9.091
  461    H    THR  57           H        THR  57   6.958   8.959   8.959
  462    HA   THR  57           HA       THR  57   6.717  11.232  11.232
  463    HB   THR  57           HB       THR  57   8.021  12.463  12.463
  464    HG1  THR  57           HG1      THR  57   9.769  11.651  11.651
  465   1HG2  THR  57          2HG2      THR  57   9.001  10.308  10.308
  466   2HG2  THR  57          1HG2      THR  57  10.216  10.415  10.415
  467   3HG2  THR  57          3HG2      THR  57  10.078  11.702  11.702
  468    H    VAL  58           H        VAL  58   8.850   8.689   8.689
  469    HA   VAL  58           HA       VAL  58   9.446   7.950   7.950
  470    HB   VAL  58           HB       VAL  58  11.137   7.393   7.393
  471   1HG1  VAL  58          3HG1      VAL  58  11.324   6.750   6.750
  472   2HG1  VAL  58          2HG1      VAL  58  12.818   7.120   7.120
  473   3HG1  VAL  58          1HG1      VAL  58  11.803   5.781   5.781
  474   1HG2  VAL  58          2HG2      VAL  58  10.786   9.854   9.854
  475   2HG2  VAL  58          1HG2      VAL  58  12.190   9.382   9.382
  476   3HG2  VAL  58          3HG2      VAL  58  12.218   9.206   9.206
  477    H    ARG  59           H        ARG  59   7.856   6.932   6.932
  478    HA   ARG  59           HA       ARG  59   8.148   4.068   4.068
  479   1HB   ARG  59          2HB       ARG  59   8.534   4.442   4.442
  480   2HB   ARG  59          1HB       ARG  59   7.051   5.382   5.382
  481   1HG   ARG  59          2HG       ARG  59   5.709   3.526   3.526
  482   2HG   ARG  59          1HG       ARG  59   6.747   2.631   2.631
  483   1HD   ARG  59          2HD       ARG  59   7.096   1.489   1.489
  484   2HD   ARG  59          1HD       ARG  59   8.443   2.627   2.627
  485    HE   ARG  59           HE       ARG  59   7.481   3.684   3.684
  486   1HH1  ARG  59          2HH1      ARG  59   4.887   4.440   4.440
  487   2HH1  ARG  59          1HH1      ARG  59   3.752   3.517   3.517
  488   1HH2  ARG  59          1HH2      ARG  59   6.141   1.335   1.335
  489   2HH2  ARG  59          2HH2      ARG  59   4.462   1.759   1.759
  490    H    THR  60           H        THR  60   5.311   5.539   5.539
  491    HA   THR  60           HA       THR  60   3.079   5.658   5.658
  492    HB   THR  60           HB       THR  60   3.973   5.132   5.132
  493    HG1  THR  60           HG1      THR  60   4.935   6.997   6.997
  494   1HG2  THR  60          1HG2      THR  60   1.765   6.715   6.715
  495   2HG2  THR  60          3HG2      THR  60   2.136   6.855   6.855
  496   3HG2  THR  60          2HG2      THR  60   1.597   5.312   5.312
  497    H    THR  61           H        THR  61   2.557   3.701   3.701
  498    HA   THR  61           HA       THR  61   2.355   1.328   1.328
  499    HB   THR  61           HB       THR  61   2.333  -0.001  -0.001
  500    HG1  THR  61           HG1      THR  61   3.328   1.142   1.142
  501   1HG2  THR  61          2HG2      THR  61   4.802   1.582   1.582
  502   2HG2  THR  61          1HG2      THR  61   4.811   0.138   0.138
  503   3HG2  THR  61          3HG2      THR  61   4.303   0.031   0.031
  504    H    GLU  62           H        GLU  62   0.455  -0.148  -0.148
  505    HA   GLU  62           HA       GLU  62  -1.701   1.225   1.225
  506   1HB   GLU  62          2HB       GLU  62  -3.253   1.383   1.383
  507   2HB   GLU  62          1HB       GLU  62  -1.786   2.259   2.259
  508   1HG   GLU  62          2HG       GLU  62  -1.232  -0.282  -0.282
  509   2HG   GLU  62          1HG       GLU  62  -2.962  -0.132  -0.132
  510    H    ILE  63           H        ILE  63  -3.580  -0.174  -0.174
  511    HA   ILE  63           HA       ILE  63  -3.264  -3.007  -3.007
  512    HB   ILE  63           HB       ILE  63  -3.467  -3.870  -3.870
  513   1HG1  ILE  63          2HG1      ILE  63  -3.520  -0.976  -0.976
  514   2HG1  ILE  63          1HG1      ILE  63  -4.913  -2.053  -2.053
  515   1HG2  ILE  63          3HG2      ILE  63  -1.217  -3.115  -3.115
  516   2HG2  ILE  63          2HG2      ILE  63  -1.394  -1.675  -1.675
  517   3HG2  ILE  63          1HG2      ILE  63  -1.321  -3.270  -3.270
  518   1HD1  ILE  63          3HD1      ILE  63  -3.072  -3.588  -3.588
  519   2HD1  ILE  63          2HD1      ILE  63  -2.674  -1.965  -1.965
  520   3HD1  ILE  63          1HD1      ILE  63  -4.308  -2.595  -2.595
  521    H    ASN  64           H        ASN  64  -5.324  -4.258  -4.258
  522    HA   ASN  64           HA       ASN  64  -7.714  -2.648  -2.648
  523   1HB   ASN  64          2HB       ASN  64  -8.863  -3.344  -3.344
  524   2HB   ASN  64          1HB       ASN  64  -7.533  -2.224  -2.224
  525   1HD2  ASN  64          2HD2      ASN  64  -5.384  -4.714  -4.714
  526   2HD2  ASN  64          1HD2      ASN  64  -5.341  -3.355  -3.355
  527    H    PHE  65           H        PHE  65  -9.253  -3.979  -3.979
  528    HA   PHE  65           HA       PHE  65  -9.385  -6.836  -6.836
  529   1HB   PHE  65          2HB       PHE  65  -8.674  -7.652  -7.652
  530   2HB   PHE  65          1HB       PHE  65  -7.386  -6.706  -6.706
  531    HD1  PHE  65           HD2      PHE  65  -6.951  -4.353  -4.353
  532    HD2  PHE  65           HD1      PHE  65  -9.792  -6.910  -6.910
  533    HE1  PHE  65           HE2      PHE  65  -7.007  -2.807  -2.807
  534    HE2  PHE  65           HE1      PHE  65  -9.858  -5.370  -5.370
  535    HZ   PHE  65           HZ       PHE  65  -8.471  -3.314  -3.314
  536    H    LYS  66           H        LYS  66 -10.635  -7.929  -7.929
  537    HA   LYS  66           HA       LYS  66 -12.931  -6.176  -6.176
  538   1HB   LYS  66          2HB       LYS  66 -14.357  -8.281  -8.281
  539   2HB   LYS  66          1HB       LYS  66 -13.814  -7.580  -7.580
  540   1HG   LYS  66          2HG       LYS  66 -11.909  -9.189  -9.189
  541   2HG   LYS  66          1HG       LYS  66 -12.546  -9.925  -9.925
  542   1HD   LYS  66          2HD       LYS  66 -14.197  -9.653  -9.653
  543   2HD   LYS  66          1HD       LYS  66 -13.198 -11.070 -11.070
  544   1HE   LYS  66          2HE       LYS  66 -14.404 -11.367 -11.367
  545   2HE   LYS  66          1HE       LYS  66 -15.458 -10.022 -10.022
  546   1HZ   LYS  66          1HZ       LYS  66 -15.104 -12.415 -12.415
  547   2HZ   LYS  66          3HZ       LYS  66 -16.321 -12.297 -12.297
  548   3HZ   LYS  66          2HZ       LYS  66 -16.293 -11.208 -11.208
  549    H    VAL  67           H        VAL  67 -13.880  -6.809  -6.809
  550    HA   VAL  67           HA       VAL  67 -11.848  -8.001  -8.001
  551    HB   VAL  67           HB       VAL  67 -14.513  -7.447  -7.447
  552   1HG1  VAL  67          1HG1      VAL  67 -11.641  -6.703  -6.703
  553   2HG1  VAL  67          3HG1      VAL  67 -13.011  -6.228  -6.228
  554   3HG1  VAL  67          2HG1      VAL  67 -12.620  -7.934  -7.934
  555   1HG2  VAL  67          2HG2      VAL  67 -12.966  -5.361  -5.361
  556   2HG2  VAL  67          1HG2      VAL  67 -14.710  -5.532  -5.532
  557   3HG2  VAL  67          3HG2      VAL  67 -13.730  -4.920  -4.920
  558    H    GLY  68           H        GLY  68 -11.763 -10.229 -10.229
  559   1HA   GLY  68          2HA       GLY  68 -13.117 -12.114 -12.114
  560   2HA   GLY  68          1HA       GLY  68 -14.306 -11.754 -11.754
  561    H    GLU  69           H        GLU  69 -12.018 -11.226 -11.226
  562    HA   GLU  69           HA       GLU  69 -11.255 -14.092 -14.092
  563   1HB   GLU  69          2HB       GLU  69 -12.284 -12.033 -12.033
  564   2HB   GLU  69          1HB       GLU  69 -11.358 -13.433 -13.433
  565   1HG   GLU  69          2HG       GLU  69 -13.727 -13.777 -13.777
  566   2HG   GLU  69          1HG       GLU  69 -13.949 -13.637 -13.637
  567    H    GLU  70           H        GLU  70  -9.224 -14.419 -14.419
  568    HA   GLU  70           HA       GLU  70  -7.240 -12.360 -12.360
  569   1HB   GLU  70          2HB       GLU  70  -5.628 -14.098 -14.098
  570   2HB   GLU  70          1HB       GLU  70  -6.691 -14.682 -14.682
  571   1HG   GLU  70          2HG       GLU  70  -7.982 -15.144 -15.144
  572   2HG   GLU  70          1HG       GLU  70  -6.330 -15.748 -15.748
  573    H    PHE  71           H        PHE  71  -5.534 -11.885 -11.885
  574    HA   PHE  71           HA       PHE  71  -6.375 -12.034 -12.034
  575   1HB   PHE  71          2HB       PHE  71  -6.466  -9.537  -9.537
  576   2HB   PHE  71          1HB       PHE  71  -7.788 -10.184 -10.184
  577    HD1  PHE  71           HD2      PHE  71  -7.523 -10.178 -10.178
  578    HD2  PHE  71           HD1      PHE  71  -4.988  -7.928  -7.928
  579    HE1  PHE  71           HE2      PHE  71  -6.811  -8.750  -8.750
  580    HE2  PHE  71           HE1      PHE  71  -4.279  -6.500  -6.500
  581    HZ   PHE  71           HZ       PHE  71  -5.187  -6.910  -6.910
  582    H    GLU  72           H        GLU  72  -4.813 -10.576 -10.576
  583    HA   GLU  72           HA       GLU  72  -2.106 -10.843 -10.843
  584   1HB   GLU  72          2HB       GLU  72  -2.541 -10.254 -10.254
  585   2HB   GLU  72          1HB       GLU  72  -1.182 -11.052 -11.052
  586   1HG   GLU  72          2HG       GLU  72  -2.666 -12.985 -12.985
  587   2HG   GLU  72          1HG       GLU  72  -3.961 -12.207 -12.207
  588    H    GLU  73           H        GLU  73  -0.755  -9.021  -9.021
  589    HA   GLU  73           HA       GLU  73  -1.553  -6.473  -6.473
  590   1HB   GLU  73          2HB       GLU  73  -1.725  -5.294  -5.294
  591   2HB   GLU  73          1HB       GLU  73  -3.037  -6.441  -6.441
  592   1HG   GLU  73          2HG       GLU  73  -2.316  -7.867  -7.867
  593   2HG   GLU  73          1HG       GLU  73  -0.614  -7.524  -7.524
  594    H    GLN  74           H        GLN  74  -0.053  -4.704  -4.704
  595    HA   GLN  74           HA       GLN  74   2.696  -5.888  -5.888
  596   1HB   GLN  74          2HB       GLN  74   1.581  -3.109  -3.109
  597   2HB   GLN  74          1HB       GLN  74   3.293  -3.335  -3.335
  598   1HG   GLN  74          2HG       GLN  74   2.191  -5.100  -5.100
  599   2HG   GLN  74          1HG       GLN  74   2.274  -3.387  -3.387
  600   1HE2  GLN  74          2HE2      GLN  74   5.893  -4.948  -4.948
  601   2HE2  GLN  74          1HE2      GLN  74   4.523  -5.208  -5.208
  602    H    THR  75           H        THR  75   4.281  -5.213  -5.213
  603    HA   THR  75           HA       THR  75   2.980  -4.902  -4.902
  604    HB   THR  75           HB       THR  75   4.643  -6.761  -6.761
  605    HG1  THR  75           HG1      THR  75   4.280  -6.392  -6.392
  606   1HG2  THR  75          1HG2      THR  75   6.262  -4.566  -4.566
  607   2HG2  THR  75          3HG2      THR  75   7.006  -5.279  -5.279
  608   3HG2  THR  75          2HG2      THR  75   6.679  -6.278  -6.278
  609    H    VAL  76           H        VAL  76   5.698  -3.775  -3.775
  610    HA   VAL  76           HA       VAL  76   5.118  -0.974  -0.974
  611    HB   VAL  76           HB       VAL  76   6.445  -1.940  -1.940
  612   1HG1  VAL  76          2HG1      VAL  76   5.394   0.740   0.740
  613   2HG1  VAL  76          1HG1      VAL  76   5.802   0.394   0.394
  614   3HG1  VAL  76          3HG1      VAL  76   7.053   0.335   0.335
  615   1HG2  VAL  76          1HG2      VAL  76   3.570  -1.218  -1.218
  616   2HG2  VAL  76          3HG2      VAL  76   4.178  -2.738  -2.738
  617   3HG2  VAL  76          2HG2      VAL  76   4.217  -1.274  -1.274
  618    H    ASP  77           H        ASP  77   7.606  -3.405  -3.405
  619    HA   ASP  77           HA       ASP  77   9.755  -1.436  -1.436
  620   1HB   ASP  77          2HB       ASP  77  11.174  -3.515  -3.515
  621   2HB   ASP  77          1HB       ASP  77  10.376  -3.350  -3.350
  622    H    GLY  78           H        GLY  78   8.029  -3.876  -3.876
  623   1HA   GLY  78          2HA       GLY  78   7.677  -2.968  -2.968
  624   2HA   GLY  78          1HA       GLY  78   9.440  -2.963  -2.963
  625    H    ARG  79           H        ARG  79   7.163  -5.320  -5.320
  626    HA   ARG  79           HA       ARG  79   8.185  -7.361  -7.361
  627   1HB   ARG  79          2HB       ARG  79   8.282  -7.328  -7.328
  628   2HB   ARG  79          1HB       ARG  79   7.933  -8.860  -8.860
  629   1HG   ARG  79          2HG       ARG  79  10.261  -7.121  -7.121
  630   2HG   ARG  79          1HG       ARG  79  10.405  -8.347  -8.347
  631   1HD   ARG  79          2HD       ARG  79   9.441  -8.895  -8.895
  632   2HD   ARG  79          1HD       ARG  79  11.081  -9.198  -9.198
  633    HE   ARG  79           HE       ARG  79   9.091 -10.493 -10.493
  634   1HH1  ARG  79          2HH1      ARG  79   8.938 -11.064 -11.064
  635   2HH1  ARG  79          1HH1      ARG  79   9.733 -12.602 -12.602
  636   1HH2  ARG  79          1HH2      ARG  79  10.967 -12.313 -12.313
  637   2HH2  ARG  79          2HH2      ARG  79  10.882 -13.309 -13.309
  638    HA   PRO  80           HA       PRO  80   3.861  -8.340  -8.340
  639   1HB   PRO  80          2HB       PRO  80   4.014 -10.905 -10.905
  640   2HB   PRO  80          1HB       PRO  80   4.286  -9.458  -9.458
  641   1HG   PRO  80          2HG       PRO  80   6.271 -11.416 -11.416
  642   2HG   PRO  80          1HG       PRO  80   6.374 -10.367 -10.367
  643   1HD   PRO  80          2HD       PRO  80   7.632  -9.913  -9.913
  644   2HD   PRO  80          1HD       PRO  80   7.470  -8.737  -8.737
  645    H    CYS  81           H        CYS  81   2.330  -9.295  -9.295
  646    HA   CYS  81           HA       CYS  81   2.900 -11.699 -11.699
  647   1HB   CYS  81          2HB       CYS  81   2.551 -10.571 -10.571
  648   2HB   CYS  81          1HB       CYS  81   4.063 -10.120 -10.120
  649    HG   CYS  81           HG       CYS  81   2.115  -8.085  -8.085
  650    H    LYS  82           H        LYS  82   0.992 -12.638 -12.638
  651    HA   LYS  82           HA       LYS  82  -1.510 -11.413 -11.413
  652   1HB   LYS  82          2HB       LYS  82  -1.104 -13.803 -13.803
  653   2HB   LYS  82          1HB       LYS  82  -0.943 -14.096 -14.096
  654   1HG   LYS  82          2HG       LYS  82  -3.341 -12.981 -12.981
  655   2HG   LYS  82          1HG       LYS  82  -3.391 -13.507 -13.507
  656   1HD   LYS  82          2HD       LYS  82  -4.246 -15.380 -15.380
  657   2HD   LYS  82          1HD       LYS  82  -2.535 -15.789 -15.789
  658   1HE   LYS  82          2HE       LYS  82  -2.260 -14.684 -14.684
  659   2HE   LYS  82          1HE       LYS  82  -4.019 -14.723 -14.723
  660   1HZ   LYS  82          2HZ       LYS  82  -2.297 -17.090 -17.090
  661   2HZ   LYS  82          1HZ       LYS  82  -2.963 -16.678 -16.678
  662   3HZ   LYS  82          3HZ       LYS  82  -3.982 -17.096 -17.096
  663    H    SER  83           H        SER  83  -2.563 -10.076 -10.076
  664    HA   SER  83           HA       SER  83  -2.052 -10.257 -10.257
  665   1HB   SER  83          2HB       SER  83  -1.753  -8.039  -8.039
  666   2HB   SER  83          1HB       SER  83  -3.088  -8.131  -8.131
  667    HG   SER  83           HG       SER  83  -3.554  -6.918  -6.918
  668    H    LEU  84           H        LEU  84  -3.993  -9.910  -9.910
  669    HA   LEU  84           HA       LEU  84  -6.585 -10.753 -10.753
  670   1HB   LEU  84          2HB       LEU  84  -5.531 -12.877 -12.877
  671   2HB   LEU  84          1HB       LEU  84  -5.244 -12.202 -12.202
  672    HG   LEU  84           HG       LEU  84  -7.672 -11.970 -11.970
  673   1HD1  LEU  84          3HD1      LEU  84  -8.273 -11.663 -11.663
  674   2HD1  LEU  84          2HD1      LEU  84  -7.961 -13.378 -13.378
  675   3HD1  LEU  84          1HD1      LEU  84  -9.267 -12.867 -12.867
  676   1HD2  LEU  84          2HD2      LEU  84  -6.354 -14.156 -14.156
  677   2HD2  LEU  84          1HD2      LEU  84  -8.115 -14.257 -14.257
  678   3HD2  LEU  84          3HD2      LEU  84  -7.181 -14.758 -14.758
  679    H    VAL  85           H        VAL  85  -8.380 -10.122 -10.122
  680    HA   VAL  85           HA       VAL  85  -7.517  -8.522  -8.522
  681    HB   VAL  85           HB       VAL  85  -9.222  -7.349  -7.349
  682   1HG1  VAL  85          2HG1      VAL  85  -8.716  -6.614  -6.614
  683   2HG1  VAL  85          1HG1      VAL  85  -8.108  -5.362  -5.362
  684   3HG1  VAL  85          3HG1      VAL  85  -9.796  -5.861  -5.861
  685   1HG2  VAL  85          2HG2      VAL  85  -6.302  -7.045  -7.045
  686   2HG2  VAL  85          1HG2      VAL  85  -7.001  -7.495  -7.495
  687   3HG2  VAL  85          3HG2      VAL  85  -7.164  -5.845  -5.845
  688    H    LYS  86           H        LYS  86  -8.861  -8.723  -8.723
  689    HA   LYS  86           HA       LYS  86 -11.699  -9.488  -9.488
  690   1HB   LYS  86          2HB       LYS  86 -11.366 -10.499 -10.499
  691   2HB   LYS  86          1HB       LYS  86 -11.046 -11.456 -11.456
  692   1HG   LYS  86          2HG       LYS  86  -8.630 -10.744 -10.744
  693   2HG   LYS  86          1HG       LYS  86  -9.021  -9.987  -9.987
  694   1HD   LYS  86          2HD       LYS  86  -9.247 -11.994 -11.994
  695   2HD   LYS  86          1HD       LYS  86  -9.896 -12.807 -12.807
  696   1HE   LYS  86          2HE       LYS  86  -7.683 -12.946 -12.946
  697   2HE   LYS  86          1HE       LYS  86  -6.994 -11.992 -11.992
  698   1HZ   LYS  86          3HZ       LYS  86  -8.337 -14.616 -14.616
  699   2HZ   LYS  86          2HZ       LYS  86  -6.654 -14.400 -14.400
  700   3HZ   LYS  86          1HZ       LYS  86  -7.538 -13.720 -13.720
  701    H    TRP  87           H        TRP  87 -13.156  -8.627  -8.627
  702    HA   TRP  87           HA       TRP  87 -12.292  -5.950  -5.950
  703   1HB   TRP  87          2HB       TRP  87 -14.848  -7.525  -7.525
  704   2HB   TRP  87          1HB       TRP  87 -14.633  -5.988  -5.988
  705    HD1  TRP  87           HD1      TRP  87 -15.551  -7.466  -7.466
  706    HE1  TRP  87           HE1      TRP  87 -15.806  -5.641  -5.641
  707    HE3  TRP  87           HE3      TRP  87 -13.470  -3.540  -3.540
  708    HZ2  TRP  87           HZ2      TRP  87 -15.196  -2.854  -2.854
  709    HZ3  TRP  87           HZ3      TRP  87 -13.290  -1.318  -1.318
  710    HH2  TRP  87           HH2      TRP  87 -14.148  -0.976  -0.976
  711    H    GLU  88           H        GLU  88 -12.876  -5.271  -5.271
  712    HA   GLU  88           HA       GLU  88 -12.175  -7.337  -7.337
  713   1HB   GLU  88          2HB       GLU  88 -10.219  -5.787  -5.787
  714   2HB   GLU  88          1HB       GLU  88 -11.073  -4.538  -4.538
  715   1HG   GLU  88          2HG       GLU  88  -9.633  -5.417  -5.417
  716   2HG   GLU  88          1HG       GLU  88 -11.137  -6.284  -6.284
  717    H    SER  89           H        SER  89 -13.258  -4.048  -4.048
  718    HA   SER  89           HA       SER  89 -15.310  -4.310  -4.310
  719   1HB   SER  89          2HB       SER  89 -14.884  -2.077  -2.077
  720   2HB   SER  89          1HB       SER  89 -13.298  -2.833  -2.833
  721    HG   SER  89           HG       SER  89 -14.107  -0.645  -0.645
  722    H    GLU  90           H        GLU  90 -16.344  -1.629  -1.629
  723    HA   GLU  90           HA       GLU  90 -17.880  -2.416  -2.416
  724   1HB   GLU  90          2HB       GLU  90 -17.855   0.319   0.319
  725   2HB   GLU  90          1HB       GLU  90 -19.149  -0.407  -0.407
  726   1HG   GLU  90          2HG       GLU  90 -18.919  -2.288  -2.288
  727   2HG   GLU  90          1HG       GLU  90 -18.391  -0.878  -0.878
  728    H    ASN  91           H        ASN  91 -15.048  -0.452  -0.452
  729    HA   ASN  91           HA       ASN  91 -14.873  -0.006  -0.006
  730   1HB   ASN  91          2HB       ASN  91 -14.401   2.220   2.220
  731   2HB   ASN  91          1HB       ASN  91 -14.378   2.336   2.336
  732   1HD2  ASN  91          2HD2      ASN  91 -17.812   3.040   3.040
  733   2HD2  ASN  91          1HD2      ASN  91 -16.272   3.210   3.210
  734    H    LYS  92           H        LYS  92 -13.373  -1.694  -1.694
  735    HA   LYS  92           HA       LYS  92 -10.680  -0.600  -0.600
  736   1HB   LYS  92          2HB       LYS  92 -11.046  -0.127  -0.127
  737   2HB   LYS  92          1HB       LYS  92 -11.585  -1.778  -1.778
  738   1HG   LYS  92          2HG       LYS  92  -9.386  -2.658  -2.658
  739   2HG   LYS  92          1HG       LYS  92  -8.817  -1.112  -1.112
  740   1HD   LYS  92          2HD       LYS  92  -9.116  -0.078  -0.078
  741   2HD   LYS  92          1HD       LYS  92  -9.755  -1.591  -1.591
  742   1HE   LYS  92          2HE       LYS  92  -7.474  -2.574  -2.574
  743   2HE   LYS  92          1HE       LYS  92  -6.941  -0.899  -0.899
  744   1HZ   LYS  92          1HZ       LYS  92  -8.367  -2.177  -2.177
  745   2HZ   LYS  92          3HZ       LYS  92  -6.713  -2.478  -2.478
  746   3HZ   LYS  92          2HZ       LYS  92  -7.260  -0.889  -0.889
  747    H    MET  93           H        MET  93  -9.925  -2.040  -2.040
  748    HA   MET  93           HA       MET  93 -10.476  -4.942  -4.942
  749   1HB   MET  93          2HB       MET  93  -9.891  -5.078  -5.078
  750   2HB   MET  93          1HB       MET  93 -11.495  -4.543  -4.543
  751   1HG   MET  93          2HG       MET  93 -11.102  -2.354  -2.354
  752   2HG   MET  93          1HG       MET  93  -9.374  -2.468  -2.468
  753   1HE   MET  93          1HE       MET  93 -11.875  -4.631  -4.631
  754   2HE   MET  93          3HE       MET  93 -12.283  -2.963  -2.963
  755   3HE   MET  93          2HE       MET  93 -11.646  -4.049  -4.049
  756    H    VAL  94           H        VAL  94  -8.817  -6.409  -6.409
  757    HA   VAL  94           HA       VAL  94  -6.078  -5.274  -5.274
  758    HB   VAL  94           HB       VAL  94  -6.842  -8.140  -8.140
  759   1HG1  VAL  94          2HG1      VAL  94  -4.544  -6.349  -6.349
  760   2HG1  VAL  94          1HG1      VAL  94  -4.937  -7.473  -7.473
  761   3HG1  VAL  94          3HG1      VAL  94  -4.572  -8.081  -8.081
  762   1HG2  VAL  94          1HG2      VAL  94  -7.404  -5.729  -5.729
  763   2HG2  VAL  94          3HG2      VAL  94  -8.307  -7.239  -7.239
  764   3HG2  VAL  94          2HG2      VAL  94  -6.822  -7.176  -7.176
  765    H    CYS  95           H        CYS  95  -4.354  -6.790  -6.790
  766    HA   CYS  95           HA       CYS  95  -5.417  -8.108  -8.108
  767   1HB   CYS  95          2HB       CYS  95  -4.995  -5.752  -5.752
  768   2HB   CYS  95          1HB       CYS  95  -3.331  -5.904  -5.904
  769    HG   CYS  95           HG       CYS  95  -2.854  -7.579  -7.579
  770    H    GLU  96           H        GLU  96  -4.160  -9.736  -9.736
  771    HA   GLU  96           HA       GLU  96  -1.590 -10.273 -10.273
  772   1HB   GLU  96          2HB       GLU  96  -3.318 -12.265 -12.265
  773   2HB   GLU  96          1HB       GLU  96  -1.952 -12.623 -12.623
  774   1HG   GLU  96          2HG       GLU  96  -4.066 -11.035 -11.035
  775   2HG   GLU  96          1HG       GLU  96  -4.595 -12.637 -12.637
  776    H    GLN  97           H        GLN  97   0.102 -11.304 -11.304
  777    HA   GLN  97           HA       GLN  97  -0.361 -10.917 -10.917
  778   1HB   GLN  97          2HB       GLN  97   0.294  -8.667  -8.667
  779   2HB   GLN  97          1HB       GLN  97   1.904  -9.286  -9.286
  780   1HG   GLN  97          2HG       GLN  97   1.205  -9.540  -9.540
  781   2HG   GLN  97          1HG       GLN  97  -0.308  -8.740  -8.740
  782   1HE2  GLN  97          2HE2      GLN  97   1.173  -5.604  -5.604
  783   2HE2  GLN  97          1HE2      GLN  97  -0.166  -6.626  -6.626
  784    H    LYS  98           H        LYS  98   0.953 -12.167 -12.167
  785    HA   LYS  98           HA       LYS  98   3.537 -13.109 -13.109
  786   1HB   LYS  98          2HB       LYS  98   2.970 -15.446 -15.446
  787   2HB   LYS  98          1HB       LYS  98   1.954 -14.872 -14.872
  788   1HG   LYS  98          2HG       LYS  98   0.071 -14.747 -14.747
  789   2HG   LYS  98          1HG       LYS  98   0.982 -14.341 -14.341
  790   1HD   LYS  98          2HD       LYS  98   0.121 -16.569 -16.569
  791   2HD   LYS  98          1HD       LYS  98   1.852 -16.718 -16.718
  792   1HE   LYS  98          2HE       LYS  98   0.118 -16.757 -16.757
  793   2HE   LYS  98          1HE       LYS  98  -0.015 -18.156 -18.156
  794   1HZ   LYS  98          2HZ       LYS  98   2.481 -18.228 -18.228
  795   2HZ   LYS  98          1HZ       LYS  98   2.414 -17.106 -17.106
  796   3HZ   LYS  98          3HZ       LYS  98   1.704 -18.636 -18.636
  797    H    LEU  99           H        LEU  99   5.046 -13.681 -13.681
  798    HA   LEU  99           HA       LEU  99   4.771 -12.185 -12.185
  799   1HB   LEU  99          2HB       LEU  99   6.521 -14.554 -14.554
  800   2HB   LEU  99          1HB       LEU  99   6.676 -13.614 -13.614
  801    HG   LEU  99           HG       LEU  99   6.628 -12.094 -12.094
  802   1HD1  LEU  99          1HD1      LEU  99   8.130 -14.194 -14.194
  803   2HD1  LEU  99          3HD1      LEU  99   9.173 -13.411 -13.411
  804   3HD1  LEU  99          2HD1      LEU  99   8.851 -12.624 -12.624
  805   1HD2  LEU  99          1HD2      LEU  99   6.923 -11.331 -11.331
  806   2HD2  LEU  99          3HD2      LEU  99   7.853 -10.552 -10.552
  807   3HD2  LEU  99          2HD2      LEU  99   8.599 -11.800 -11.800
  808    H    LEU 100           H        LEU 100   4.879 -13.153 -13.153
  809    HA   LEU 100           HA       LEU 100   2.831 -15.275 -15.275
  810   1HB   LEU 100          2HB       LEU 100   3.928 -13.164 -13.164
  811   2HB   LEU 100          1HB       LEU 100   2.956 -14.513 -14.513
  812    HG   LEU 100           HG       LEU 100   2.028 -12.728 -12.728
  813   1HD1  LEU 100          2HD1      LEU 100   1.905 -12.341 -12.341
  814   2HD1  LEU 100          1HD1      LEU 100   0.535 -11.825 -11.825
  815   3HD1  LEU 100          3HD1      LEU 100   2.136 -11.142 -11.142
  816   1HD2  LEU 100          3HD2      LEU 100   0.917 -14.945 -14.945
  817   2HD2  LEU 100          2HD2      LEU 100   0.606 -14.536 -14.536
  818   3HD2  LEU 100          1HD2      LEU 100  -0.185 -13.627 -13.627
  819    H    LYS 101           H        LYS 101   6.197 -14.903 -14.903
  820    HA   LYS 101           HA       LYS 101   6.575 -17.566 -17.566
  821   1HB   LYS 101          2HB       LYS 101   6.719 -15.767 -15.767
  822   2HB   LYS 101          1HB       LYS 101   8.254 -15.332 -15.332
  823   1HG   LYS 101          2HG       LYS 101   7.765 -18.228 -18.228
  824   2HG   LYS 101          1HG       LYS 101   8.094 -17.210 -17.210
  825   1HD   LYS 101          2HD       LYS 101  10.256 -16.794 -16.794
  826   2HD   LYS 101          1HD       LYS 101   9.864 -16.814 -16.814
  827   1HE   LYS 101          2HE       LYS 101  10.078 -19.111 -19.111
  828   2HE   LYS 101          1HE       LYS 101   9.635 -19.378 -19.378
  829   1HZ   LYS 101          2HZ       LYS 101  11.794 -18.303 -18.303
  830   2HZ   LYS 101          1HZ       LYS 101  12.215 -18.368 -18.368
  831   3HZ   LYS 101          3HZ       LYS 101  11.938 -19.803 -19.803
  832    H    GLY 102           H        GLY 102   8.446 -18.544 -18.544
  833   1HA   GLY 102          2HA       GLY 102  10.253 -18.826 -18.826
  834   2HA   GLY 102          1HA       GLY 102  10.615 -17.116 -17.116
  835    H    GLU 103           H        GLU 103  11.099 -17.158 -17.158
  836    HA   GLU 103           HA       GLU 103   8.946 -16.040 -16.040
  837   1HB   GLU 103          2HB       GLU 103   8.238 -18.449 -18.449
  838   2HB   GLU 103          1HB       GLU 103   9.735 -18.835 -18.835
  839   1HG   GLU 103          2HG       GLU 103   9.120 -17.523 -17.523
  840   2HG   GLU 103          1HG       GLU 103   7.792 -16.760 -16.760
  841    H    GLY 104           H        GLY 104   9.755 -14.977 -14.977
  842   1HA   GLY 104          2HA       GLY 104  12.278 -15.767 -15.767
  843   2HA   GLY 104          1HA       GLY 104  12.348 -14.244 -14.244
  844    HA   PRO 105           HA       PRO 105  10.513 -12.383 -12.383
  845   1HB   PRO 105          2HB       PRO 105   9.641 -10.032 -10.032
  846   2HB   PRO 105          1HB       PRO 105  11.347 -10.369 -10.369
  847   1HG   PRO 105          2HG       PRO 105   9.951 -10.273 -10.273
  848   2HG   PRO 105          1HG       PRO 105  11.675 -10.084 -10.084
  849   1HD   PRO 105          2HD       PRO 105  10.376 -12.428 -12.428
  850   2HD   PRO 105          1HD       PRO 105  12.072 -12.281 -12.281
  851    H    LYS 106           H        LYS 106   8.304 -11.036 -11.036
  852    HA   LYS 106           HA       LYS 106   6.069 -12.249 -12.249
  853   1HB   LYS 106          2HB       LYS 106   6.398 -13.603 -13.603
  854   2HB   LYS 106          1HB       LYS 106   6.334 -12.144 -12.144
  855   1HG   LYS 106          2HG       LYS 106   4.059 -11.837 -11.837
  856   2HG   LYS 106          1HG       LYS 106   4.066 -12.754 -12.754
  857   1HD   LYS 106          2HD       LYS 106   3.769 -14.747 -14.747
  858   2HD   LYS 106          1HD       LYS 106   4.857 -14.313 -14.313
  859   1HE   LYS 106          2HE       LYS 106   2.455 -14.581 -14.581
  860   2HE   LYS 106          1HE       LYS 106   3.135 -12.996 -12.996
  861   1HZ   LYS 106          3HZ       LYS 106   1.669 -13.507 -13.507
  862   2HZ   LYS 106          2HZ       LYS 106   0.857 -13.070 -13.070
  863   3HZ   LYS 106          1HZ       LYS 106   2.005 -12.020 -12.020
  864    H    THR 107           H        THR 107   4.346 -10.783 -10.783
  865    HA   THR 107           HA       THR 107   4.665  -8.147  -8.147
  866    HB   THR 107           HB       THR 107   3.338  -7.516  -7.516
  867    HG1  THR 107           HG1      THR 107   3.703  -9.059  -9.059
  868   1HG2  THR 107          3HG2      THR 107   5.445  -6.567  -6.567
  869   2HG2  THR 107          2HG2      THR 107   6.340  -7.583  -7.583
  870   3HG2  THR 107          1HG2      THR 107   5.272  -6.318  -6.318
  871    H    SER 108           H        SER 108   2.850  -7.111  -7.111
  872    HA   SER 108           HA       SER 108   0.151  -8.009  -8.009
  873   1HB   SER 108          2HB       SER 108   1.389  -8.604  -8.604
  874   2HB   SER 108          1HB       SER 108  -0.353  -8.499  -8.499
  875    HG   SER 108           HG       SER 108   0.455 -10.643 -10.643
  876    H    TRP 109           H        TRP 109  -1.275  -6.258  -6.258
  877    HA   TRP 109           HA       TRP 109  -0.246  -4.129  -4.129
  878   1HB   TRP 109          2HB       TRP 109  -0.903  -2.381  -2.381
  879   2HB   TRP 109          1HB       TRP 109   0.538  -3.312  -3.312
  880    HD1  TRP 109           HD1      TRP 109   0.495  -4.791  -4.791
  881    HE1  TRP 109           HE1      TRP 109  -1.228  -5.174  -5.174
  882    HE3  TRP 109           HE3      TRP 109  -3.585  -2.504  -2.504
  883    HZ2  TRP 109           HZ2      TRP 109  -3.962  -4.586  -4.586
  884    HZ3  TRP 109           HZ3      TRP 109  -5.733  -2.439  -2.439
  885    HH2  TRP 109           HH2      TRP 109  -5.929  -3.471  -3.471
  886    H    THR 110           H        THR 110  -1.990  -2.343  -2.343
  887    HA   THR 110           HA       THR 110  -4.725  -3.527  -3.527
  888    HB   THR 110           HB       THR 110  -5.237  -3.027  -3.027
  889    HG1  THR 110           HG1      THR 110  -4.375  -1.236  -1.236
  890   1HG2  THR 110          3HG2      THR 110  -3.300  -4.861  -4.861
  891   2HG2  THR 110          2HG2      THR 110  -2.483  -3.884  -3.884
  892   3HG2  THR 110          1HG2      THR 110  -4.017  -4.665  -4.665
  893    H    MET 111           H        MET 111  -6.388  -1.764  -1.764
  894    HA   MET 111           HA       MET 111  -5.588   1.020   1.020
  895   1HB   MET 111          2HB       MET 111  -6.981   1.326   1.326
  896   2HB   MET 111          1HB       MET 111  -5.585   0.289   0.289
  897   1HG   MET 111          2HG       MET 111  -6.920  -1.687  -1.687
  898   2HG   MET 111          1HG       MET 111  -8.300  -0.819  -0.819
  899   1HE   MET 111          2HE       MET 111  -5.655  -0.530  -0.530
  900   2HE   MET 111          1HE       MET 111  -6.413  -0.697  -0.697
  901   3HE   MET 111          3HE       MET 111  -6.280   0.895   0.895
  902    H    GLU 112           H        GLU 112  -7.108   2.337   2.337
  903    HA   GLU 112           HA       GLU 112  -9.788   1.162   1.162
  904   1HB   GLU 112          2HB       GLU 112  -9.668   2.137   2.137
  905   2HB   GLU 112          1HB       GLU 112  -8.503   0.840   0.840
  906   1HG   GLU 112          2HG       GLU 112  -6.753   2.518   2.518
  907   2HG   GLU 112          1HG       GLU 112  -7.918   3.807   3.807
  908    H    LEU 113           H        LEU 113 -11.426   2.758   2.758
  909    HA   LEU 113           HA       LEU 113 -10.721   5.429   5.429
  910   1HB   LEU 113          2HB       LEU 113 -12.555   3.551   3.551
  911   2HB   LEU 113          1HB       LEU 113 -13.565   4.600   4.600
  912    HG   LEU 113           HG       LEU 113 -13.449   5.224   5.224
  913   1HD1  LEU 113          2HD1      LEU 113 -13.054   6.960   6.960
  914   2HD1  LEU 113          1HD1      LEU 113 -12.451   7.689   7.689
  915   3HD1  LEU 113          3HD1      LEU 113 -14.124   7.153   7.153
  916   1HD2  LEU 113          2HD2      LEU 113 -10.672   4.916   4.916
  917   2HD2  LEU 113          1HD2      LEU 113 -11.479   5.427   5.427
  918   3HD2  LEU 113          3HD2      LEU 113 -10.935   6.631   6.631
  919    H    THR 114           H        THR 114 -11.487   7.266   7.266
  920    HA   THR 114           HA       THR 114 -12.237   6.665   6.665
  921    HB   THR 114           HB       THR 114 -11.682   8.932   8.932
  922    HG1  THR 114           HG1      THR 114 -11.469  10.474  10.474
  923   1HG2  THR 114          2HG2      THR 114  -9.747   7.463   7.463
  924   2HG2  THR 114          1HG2      THR 114  -9.784   7.993   7.993
  925   3HG2  THR 114          3HG2      THR 114  -9.408   9.146   9.146
  926    H    ASN 115           H        ASN 115 -14.039   7.862   7.862
  927    HA   ASN 115           HA       ASN 115 -16.478   7.569   7.569
  928   1HB   ASN 115          2HB       ASN 115 -17.471   8.894   8.894
  929   2HB   ASN 115          1HB       ASN 115 -16.450   7.561   7.561
  930   1HD2  ASN 115          2HD2      ASN 115 -15.345  11.404  11.404
  931   2HD2  ASN 115          1HD2      ASN 115 -16.709  11.074  11.074
  932    H    ASP 116           H        ASP 116 -14.193  10.181  10.181
  933    HA   ASP 116           HA       ASP 116 -16.164  12.143  12.143
  934   1HB   ASP 116          2HB       ASP 116 -14.230  12.794  12.794
  935   2HB   ASP 116          1HB       ASP 116 -13.145  12.381  12.381
  936    H    GLY 117           H        GLY 117 -13.742   9.950   9.950
  937   1HA   GLY 117          2HA       GLY 117 -14.312   9.284   9.284
  938   2HA   GLY 117          1HA       GLY 117 -14.274  11.010  11.010
  939    H    GLU 118           H        GLU 118 -11.912  10.821  10.821
  940    HA   GLU 118           HA       GLU 118  -9.760  11.123  11.123
  941   1HB   GLU 118          2HB       GLU 118  -9.730  10.255  10.255
  942   2HB   GLU 118          1HB       GLU 118  -8.303  10.750  10.750
  943   1HG   GLU 118          2HG       GLU 118  -9.133  12.972  12.972
  944   2HG   GLU 118          1HG       GLU 118 -10.744  12.514  12.514
  945    H    LEU 119           H        LEU 119  -7.774   9.561   9.561
  946    HA   LEU 119           HA       LEU 119  -8.610   6.714   6.714
  947   1HB   LEU 119          2HB       LEU 119  -9.102   7.570   7.570
  948   2HB   LEU 119          1HB       LEU 119  -7.393   7.945   7.945
  949    HG   LEU 119           HG       LEU 119  -8.329   5.166   5.166
  950   1HD1  LEU 119          2HD1      LEU 119  -8.326   6.581   6.581
  951   2HD1  LEU 119          1HD1      LEU 119  -7.933   4.862   4.862
  952   3HD1  LEU 119          3HD1      LEU 119  -9.495   5.431   5.431
  953   1HD2  LEU 119          3HD2      LEU 119  -5.825   6.468   6.468
  954   2HD2  LEU 119          2HD2      LEU 119  -6.002   5.251   5.251
  955   3HD2  LEU 119          1HD2      LEU 119  -6.155   4.790   4.790
  956    H    ILE 120           H        ILE 120  -7.093   5.872   5.872
  957    HA   ILE 120           HA       ILE 120  -4.252   6.747   6.747
  958    HB   ILE 120           HB       ILE 120  -5.066   7.141   7.141
  959   1HG1  ILE 120          2HG1      ILE 120  -3.233   4.725   4.725
  960   2HG1  ILE 120          1HG1      ILE 120  -2.700   6.361   6.361
  961   1HG2  ILE 120          1HG2      ILE 120  -5.647   4.169   4.169
  962   2HG2  ILE 120          3HG2      ILE 120  -5.700   5.182   5.182
  963   3HG2  ILE 120          2HG2      ILE 120  -6.834   5.467   5.467
  964   1HD1  ILE 120          2HD1      ILE 120  -4.096   5.662   5.662
  965   2HD1  ILE 120          1HD1      ILE 120  -2.342   5.645   5.645
  966   3HD1  ILE 120          3HD1      ILE 120  -3.235   7.150   7.150
  967    H    LEU 121           H        LEU 121  -2.659   5.066   5.066
  968    HA   LEU 121           HA       LEU 121  -3.801   2.348   2.348
  969   1HB   LEU 121          2HB       LEU 121  -3.520   3.481   3.481
  970   2HB   LEU 121          1HB       LEU 121  -1.846   3.861   3.861
  971    HG   LEU 121           HG       LEU 121  -2.372   1.006   1.006
  972   1HD1  LEU 121          3HD1      LEU 121  -3.310   2.373   2.373
  973   2HD1  LEU 121          2HD1      LEU 121  -2.383   0.887   0.887
  974   3HD1  LEU 121          1HD1      LEU 121  -3.867   0.873   0.873
  975   1HD2  LEU 121          3HD2      LEU 121  -0.494   2.721   2.721
  976   2HD2  LEU 121          2HD2      LEU 121  -0.129   1.811   1.811
  977   3HD2  LEU 121          1HD2      LEU 121  -0.451   0.959   0.959
  978    H    THR 122           H        THR 122  -2.543   0.701   0.701
  979    HA   THR 122           HA       THR 122   0.124   1.448   1.448
  980    HB   THR 122           HB       THR 122  -0.829  -1.053  -1.053
  981    HG1  THR 122           HG1      THR 122  -2.689  -0.296  -0.296
  982   1HG2  THR 122          1HG2      THR 122  -0.328   1.698   1.698
  983   2HG2  THR 122          3HG2      THR 122  -0.671   0.274   0.274
  984   3HG2  THR 122          2HG2      THR 122   0.780   0.326   0.326
  985    H    MET 123           H        MET 123   1.597  -0.593  -0.593
  986    HA   MET 123           HA       MET 123   1.034  -2.384  -2.384
  987   1HB   MET 123          2HB       MET 123   3.529  -0.666  -0.666
  988   2HB   MET 123          1HB       MET 123   3.155  -1.852  -1.852
  989   1HG   MET 123          2HG       MET 123   1.006  -0.496  -0.496
  990   2HG   MET 123          1HG       MET 123   1.772   0.774   0.774
  991   1HE   MET 123          3HE       MET 123   1.197  -0.980  -0.980
  992   2HE   MET 123          2HE       MET 123   2.307  -0.413  -0.413
  993   3HE   MET 123          1HE       MET 123   2.801  -1.710  -1.710
  994    H    THR 124           H        THR 124   2.807  -4.046  -4.046
  995    HA   THR 124           HA       THR 124   4.398  -4.484  -4.484
  996    HB   THR 124           HB       THR 124   2.553  -6.679  -6.679
  997    HG1  THR 124           HG1      THR 124   1.029  -5.421  -5.421
  998   1HG2  THR 124          3HG2      THR 124   4.601  -7.113  -7.113
  999   2HG2  THR 124          2HG2      THR 124   3.885  -6.097  -6.097
 1000   3HG2  THR 124          1HG2      THR 124   3.087  -7.593  -7.593
 1001    H    ALA 125           H        ALA 125   6.040  -6.012  -6.012
 1002    HA   ALA 125           HA       ALA 125   6.241  -7.447  -7.447
 1003   1HB   ALA 125          3HB       ALA 125   7.084  -4.944  -4.944
 1004   2HB   ALA 125          2HB       ALA 125   8.523  -5.593  -5.593
 1005   3HB   ALA 125          1HB       ALA 125   7.983  -6.261  -6.261
 1006    H    ASP 126           H        ASP 126   6.484  -9.317  -9.317
 1007    HA   ASP 126           HA       ASP 126   7.766 -11.012 -11.012
 1008   1HB   ASP 126          2HB       ASP 126   9.748  -9.178  -9.178
 1009   2HB   ASP 126          1HB       ASP 126  10.110  -9.536  -9.536
 1010    H    ASP 127           H        ASP 127   9.036  -8.227  -8.227
 1011    HA   ASP 127           HA       ASP 127   7.175  -8.796  -8.796
 1012   1HB   ASP 127          2HB       ASP 127   9.562 -10.075 -10.075
 1013   2HB   ASP 127          1HB       ASP 127  10.013  -8.541  -8.541
 1014    H    VAL 128           H        VAL 128   7.846  -6.631  -6.631
 1015    HA   VAL 128           HA       VAL 128   8.394  -4.445  -4.445
 1016    HB   VAL 128           HB       VAL 128   9.282  -3.140  -3.140
 1017   1HG1  VAL 128          3HG1      VAL 128  10.371  -5.892  -5.892
 1018   2HG1  VAL 128          2HG1      VAL 128  11.133  -4.868  -4.868
 1019   3HG1  VAL 128          1HG1      VAL 128  11.046  -4.330  -4.330
 1020   1HG2  VAL 128          3HG2      VAL 128   8.038  -5.319  -5.319
 1021   2HG2  VAL 128          2HG2      VAL 128   8.303  -3.632  -3.632
 1022   3HG2  VAL 128          1HG2      VAL 128   9.619  -4.797  -4.797
 1023    H    VAL 129           H        VAL 129   7.380  -2.311  -2.311
 1024    HA   VAL 129           HA       VAL 129   4.889  -2.850  -2.850
 1025    HB   VAL 129           HB       VAL 129   4.986  -2.350  -2.350
 1026   1HG1  VAL 129          1HG1      VAL 129   3.034  -1.020  -1.020
 1027   2HG1  VAL 129          3HG1      VAL 129   2.462  -1.606  -1.606
 1028   3HG1  VAL 129          2HG1      VAL 129   3.746  -0.399  -0.399
 1029   1HG2  VAL 129          3HG2      VAL 129   3.571  -4.076  -4.076
 1030   2HG2  VAL 129          2HG2      VAL 129   4.237  -4.475  -4.475
 1031   3HG2  VAL 129          1HG2      VAL 129   2.683  -3.651  -3.651
 1032    H    CYS 130           H        CYS 130   4.742  -1.250  -1.250
 1033    HA   CYS 130           HA       CYS 130   5.963   1.394   1.394
 1034   1HB   CYS 130          2HB       CYS 130   6.295  -0.068  -0.068
 1035   2HB   CYS 130          1HB       CYS 130   4.826   0.783   0.783
 1036    HG   CYS 130           HG       CYS 130   6.733   2.814   2.814
 1037    H    THR 131           H        THR 131   4.620   3.013   3.013
 1038    HA   THR 131           HA       THR 131   1.727   2.777   2.777
 1039    HB   THR 131           HB       THR 131   2.958   4.163   4.163
 1040    HG1  THR 131           HG1      THR 131   2.032   2.398   2.398
 1041   1HG2  THR 131          2HG2      THR 131   0.178   3.859   3.859
 1042   2HG2  THR 131          1HG2      THR 131   0.420   3.911   3.911
 1043   3HG2  THR 131          3HG2      THR 131   0.942   5.264   5.264
 1044    H    ARG 132           H        ARG 132   0.695   4.663   4.663
 1045    HA   ARG 132           HA       ARG 132   2.176   7.185   7.185
 1046   1HB   ARG 132          2HB       ARG 132   1.117   5.673   5.673
 1047   2HB   ARG 132          1HB       ARG 132   1.764   7.312   7.312
 1048   1HG   ARG 132          2HG       ARG 132   3.915   6.390   6.390
 1049   2HG   ARG 132          1HG       ARG 132   3.252   4.773   4.773
 1050   1HD   ARG 132          2HD       ARG 132   2.791   5.853   5.853
 1051   2HD   ARG 132          1HD       ARG 132   4.267   6.705   6.705
 1052    HE   ARG 132           HE       ARG 132   4.937   4.135   4.135
 1053   1HH1  ARG 132          2HH1      ARG 132   2.563   4.291   4.291
 1054   2HH1  ARG 132          1HH1      ARG 132   3.504   3.711   3.711
 1055   1HH2  ARG 132          1HH2      ARG 132   6.524   3.941   3.941
 1056   2HH2  ARG 132          2HH2      ARG 132   5.747   3.513   3.513
 1057    H    VAL 133           H        VAL 133   0.628   8.699   8.699
 1058    HA   VAL 133           HA       VAL 133  -2.214   7.952   7.952
 1059    HB   VAL 133           HB       VAL 133  -0.911  10.550  10.550
 1060   1HG1  VAL 133          2HG1      VAL 133  -3.707   9.478   9.478
 1061   2HG1  VAL 133          1HG1      VAL 133  -3.167  10.517  10.517
 1062   3HG1  VAL 133          3HG1      VAL 133  -3.150  11.116  11.116
 1063   1HG2  VAL 133          3HG2      VAL 133  -1.627   8.027   8.027
 1064   2HG2  VAL 133          2HG2      VAL 133  -0.077   8.867   8.867
 1065   3HG2  VAL 133          1HG2      VAL 133  -1.442   9.573   9.573
 1066    H    TYR 134           H        TYR 134  -3.711   8.720   8.720
 1067    HA   TYR 134           HA       TYR 134  -2.654  10.671  10.671
 1068   1HB   TYR 134          2HB       TYR 134  -4.107   8.079   8.079
 1069   2HB   TYR 134          1HB       TYR 134  -4.314   9.387   9.387
 1070    HD1  TYR 134           HD2      TYR 134  -2.405  10.252  10.252
 1071    HD2  TYR 134           HD1      TYR 134  -1.986   6.931   6.931
 1072    HE1  TYR 134           HE2      TYR 134  -0.240   9.664   9.664
 1073    HE2  TYR 134           HE1      TYR 134   0.179   6.340   6.340
 1074    HH   TYR 134           HH       TYR 134   1.804   8.452   8.452
 1075    H    VAL 135           H        VAL 135  -3.868  12.433  12.433
 1076    HA   VAL 135           HA       VAL 135  -6.707  12.269  12.269
 1077    HB   VAL 135           HB       VAL 135  -4.663  14.059  14.059
 1078   1HG1  VAL 135          2HG1      VAL 135  -5.027  15.305  15.305
 1079   2HG1  VAL 135          1HG1      VAL 135  -6.708  15.552  15.552
 1080   3HG1  VAL 135          3HG1      VAL 135  -5.409  16.266  16.266
 1081   1HG2  VAL 135          1HG2      VAL 135  -7.627  13.873  13.873
 1082   2HG2  VAL 135          3HG2      VAL 135  -6.351  13.690  13.690
 1083   3HG2  VAL 135          2HG2      VAL 135  -6.794  15.297  15.297
 1084    H    ARG 136           H        ARG 136  -8.315  12.880  12.880
 1085    HA   ARG 136           HA       ARG 136  -7.836  12.527  12.527
 1086   1HB   ARG 136          2HB       ARG 136 -10.029  13.426  13.426
 1087   2HB   ARG 136          1HB       ARG 136  -9.927  14.421  14.421
 1088   1HG   ARG 136          2HG       ARG 136 -10.263  12.642  12.642
 1089   2HG   ARG 136          1HG       ARG 136  -9.630  11.463  11.463
 1090   1HD   ARG 136          2HD       ARG 136 -12.315  12.865  12.865
 1091   2HD   ARG 136          1HD       ARG 136 -12.026  11.144  11.144
 1092    HE   ARG 136           HE       ARG 136 -10.824  11.728  11.728
 1093   1HH1  ARG 136          2HH1      ARG 136 -13.284   9.940   9.940
 1094   2HH1  ARG 136          1HH1      ARG 136 -14.435  10.636  10.636
 1095   1HH2  ARG 136          1HH2      ARG 136 -12.591  13.527  13.527
 1096   2HH2  ARG 136          2HH2      ARG 136 -14.044  12.668  12.668
 1097    H    GLU 137           HN       GLU 137  -6.861  13.616  13.616
 1098    HA   GLU 137           HA       GLU 137  -5.542  15.267  15.267
 1099   1HB   GLU 137          2HB       GLU 137  -8.045  15.783  15.783
 1100   2HB   GLU 137          1HB       GLU 137  -7.770  17.113  17.113
 1101   1HG   GLU 137          2HG       GLU 137  -5.799  17.781  17.781
 1102   2HG   GLU 137          1HG       GLU 137  -6.412  16.625  16.625

  Start of MODEL   20
    1   1H    PRO   1          1H        PRO   1  16.877   7.114   7.114
    2   2H    PRO   1          2H        PRO   1  16.395   6.412   6.412
    3    HA   PRO   1           HA       PRO   1  16.625   4.375   4.375
    4   1HB   PRO   1          2HB       PRO   1  19.223   4.427   4.427
    5   2HB   PRO   1          1HB       PRO   1  18.761   3.715   3.715
    6   1HG   PRO   1          2HG       PRO   1  20.270   6.110   6.110
    7   2HG   PRO   1          1HG       PRO   1  19.837   5.373   5.373
    8   1HD   PRO   1          1HD       PRO   1  18.779   7.762   7.762
    9   2HD   PRO   1          2HD       PRO   1  18.304   6.984   6.984
   10    H    ASN   2           H        ASN   2  15.415   6.292   6.292
   11    HA   ASN   2           HA       ASN   2  15.770   4.923   4.923
   12   1HB   ASN   2          2HB       ASN   2  16.153   7.923   7.923
   13   2HB   ASN   2          1HB       ASN   2  16.101   7.023   7.023
   14   1HD2  ASN   2          2HD2      ASN   2  19.446   5.912   5.912
   15   2HD2  ASN   2          1HD2      ASN   2  18.001   5.881   5.881
   16    H    PHE   3           H        PHE   3  13.762   4.557   4.557
   17    HA   PHE   3           HA       PHE   3  11.510   6.218   6.218
   18   1HB   PHE   3          2HB       PHE   3  11.607   3.578   3.578
   19   2HB   PHE   3          1HB       PHE   3  10.130   4.389   4.389
   20    HD1  PHE   3           HD1      PHE   3  13.391   3.417   3.417
   21    HD2  PHE   3           HD2      PHE   3   9.103   3.532   3.532
   22    HE1  PHE   3           HE1      PHE   3  13.490   2.287   2.287
   23    HE2  PHE   3           HE2      PHE   3   9.212   2.391   2.391
   24    HZ   PHE   3           HZ       PHE   3  11.406   1.758   1.758
   25    H    SER   4           H        SER   4  13.590   6.154   6.154
   26    HA   SER   4           HA       SER   4  11.750   6.398   6.398
   27   1HB   SER   4          2HB       SER   4  14.138   5.773   5.773
   28   2HB   SER   4          1HB       SER   4  14.596   7.411   7.411
   29    HG   SER   4           HG       SER   4  14.490   7.239   7.239
   30    H    GLY   5           H        GLY   5  10.381   8.019   8.019
   31   1HA   GLY   5          2HA       GLY   5  10.957  10.662  10.662
   32   2HA   GLY   5          1HA       GLY   5  10.681  10.635  10.635
   33    H    ASN   6           H        ASN   6   8.811  12.084  12.084
   34    HA   ASN   6           HA       ASN   6   6.510  10.433  10.433
   35   1HB   ASN   6          2HB       ASN   6   7.095  13.393  13.393
   36   2HB   ASN   6          1HB       ASN   6   5.419  12.841  12.841
   37   1HD2  ASN   6          2HD2      ASN   6   6.003  11.188  11.188
   38   2HD2  ASN   6          1HD2      ASN   6   5.432  10.721  10.721
   39    H    TRP   7           H        TRP   7   4.411  10.946  10.946
   40    HA   TRP   7           HA       TRP   7   5.014  11.615  11.615
   41   1HB   TRP   7          2HB       TRP   7   4.046   8.903   8.903
   42   2HB   TRP   7          1HB       TRP   7   4.056   9.434   9.434
   43    HD1  TRP   7           HD1      TRP   7   6.249   8.035   8.035
   44    HE1  TRP   7           HE1      TRP   7   8.694   7.877   7.877
   45    HE3  TRP   7           HE3      TRP   7   5.835  10.777  10.777
   46    HZ2  TRP   7           HZ2      TRP   7  10.256   8.849   8.849
   47    HZ3  TRP   7           HZ3      TRP   7   7.797  11.190  11.190
   48    HH2  TRP   7           HH2      TRP   7   9.986  10.227  10.227
   49    H    LYS   8           H        LYS   8   3.406  12.782  12.782
   50    HA   LYS   8           HA       LYS   8   0.649  12.313  12.313
   51   1HB   LYS   8          2HB       LYS   8   1.898  14.906  14.906
   52   2HB   LYS   8          1HB       LYS   8   0.202  14.711  14.711
   53   1HG   LYS   8          2HG       LYS   8   1.114  13.821  13.821
   54   2HG   LYS   8          1HG       LYS   8   2.636  14.570  14.570
   55   1HD   LYS   8          2HD       LYS   8   1.783  16.717  16.717
   56   2HD   LYS   8          1HD       LYS   8   0.135  16.195  16.195
   57   1HE   LYS   8          2HE       LYS   8   0.253  16.855  16.855
   58   2HE   LYS   8          1HE       LYS   8   0.062  15.104  15.104
   59   1HZ   LYS   8          3HZ       LYS   8   2.761  16.265  16.265
   60   2HZ   LYS   8          2HZ       LYS   8   1.871  16.137  16.137
   61   3HZ   LYS   8          1HZ       LYS   8   2.230  14.746  14.746
   62    H    ILE   9           H        ILE   9  -0.436  11.263  11.263
   63    HA   ILE   9           HA       ILE   9   0.256  10.909  10.909
   64    HB   ILE   9           HB       ILE   9  -1.346   9.516   9.516
   65   1HG1  ILE   9          2HG1      ILE   9  -2.539  10.955  10.955
   66   2HG1  ILE   9          1HG1      ILE   9  -1.517   9.520   9.520
   67   1HG2  ILE   9          2HG2      ILE   9  -2.350  11.667  11.667
   68   2HG2  ILE   9          1HG2      ILE   9  -3.442  11.662  11.662
   69   3HG2  ILE   9          3HG2      ILE   9  -3.392  10.276  10.276
   70   1HD1  ILE   9          3HD1      ILE   9  -3.330   8.409   8.409
   71   2HD1  ILE   9          2HD1      ILE   9  -4.358   9.765   9.765
   72   3HD1  ILE   9          1HD1      ILE   9  -3.725   8.676   8.676
   73    H    ILE  10           H        ILE  10  -0.297  11.930  11.930
   74    HA   ILE  10           HA       ILE  10  -1.699  14.556  14.556
   75    HB   ILE  10           HB       ILE  10  -0.226  15.397  15.397
   76   1HG1  ILE  10          2HG1      ILE  10   1.922  13.683  13.683
   77   2HG1  ILE  10          1HG1      ILE  10   0.575  12.550  12.550
   78   1HG2  ILE  10          2HG2      ILE  10   0.891  14.324  14.324
   79   2HG2  ILE  10          1HG2      ILE  10   2.003  15.045  15.045
   80   3HG2  ILE  10          3HG2      ILE  10   0.669  15.997  15.997
   81   1HD1  ILE  10          1HD1      ILE  10   0.786  14.872  14.872
   82   2HD1  ILE  10          3HD1      ILE  10   1.141  13.190  13.190
   83   3HD1  ILE  10          2HD1      ILE  10  -0.500  13.665  13.665
   84    H    ARG  11           H        ARG  11  -1.346  11.540  11.540
   85    HA   ARG  11           HA       ARG  11  -3.732  12.264  12.264
   86   1HB   ARG  11          2HB       ARG  11  -1.013  11.684  11.684
   87   2HB   ARG  11          1HB       ARG  11  -2.335  10.856  10.856
   88   1HG   ARG  11          2HG       ARG  11  -2.496  13.809  13.809
   89   2HG   ARG  11          1HG       ARG  11  -1.651  13.215  13.215
   90   1HD   ARG  11          2HD       ARG  11  -3.664  12.057  12.057
   91   2HD   ARG  11          1HD       ARG  11  -4.518  12.532  12.532
   92    HE   ARG  11           HE       ARG  11  -3.740  14.949  14.949
   93   1HH1  ARG  11          1HH2      ARG  11  -6.466  13.264  13.264
   94   2HH1  ARG  11          2HH2      ARG  11  -6.909  13.645  13.645
   95   1HH2  ARG  11          2HH1      ARG  11  -3.810  14.975  14.975
   96   2HH2  ARG  11          1HH1      ARG  11  -5.405  14.615  14.615
   97    H    SER  12           H        SER  12  -4.464  10.192  10.192
   98    HA   SER  12           HA       SER  12  -3.815   7.562   7.562
   99   1HB   SER  12          2HB       SER  12  -4.290   7.929   7.929
  100   2HB   SER  12          1HB       SER  12  -5.728   8.876   8.876
  101    HG   SER  12           HG       SER  12  -6.421   6.851   6.851
  102    H    GLU  13           H        GLU  13  -5.837   6.075   6.075
  103    HA   GLU  13           HA       GLU  13  -8.073   7.426   7.426
  104   1HB   GLU  13          2HB       GLU  13  -7.560   6.547   6.547
  105   2HB   GLU  13          1HB       GLU  13  -6.301   7.643   7.643
  106   1HG   GLU  13          2HG       GLU  13  -5.582   5.042   5.042
  107   2HG   GLU  13          1HG       GLU  13  -6.063   4.881   4.881
  108    H    ASN  14           H        ASN  14  -7.620   5.266   5.266
  109    HA   ASN  14           HA       ASN  14  -9.633   3.401   3.401
  110   1HB   ASN  14          2HB       ASN  14  -7.521   1.649   1.649
  111   2HB   ASN  14          1HB       ASN  14  -8.324   1.702   1.702
  112   1HD2  ASN  14          2HD2      ASN  14  -5.256   2.650   2.650
  113   2HD2  ASN  14          1HD2      ASN  14  -6.598   1.625   1.625
  114    H    PHE  15           H        PHE  15  -9.183   5.239   5.239
  115    HA   PHE  15           HA       PHE  15  -8.627   3.733   3.733
  116   1HB   PHE  15          2HB       PHE  15  -8.762   6.273   6.273
  117   2HB   PHE  15          1HB       PHE  15 -10.506   6.094   6.094
  118    HD1  PHE  15           HD2      PHE  15  -9.796   3.502   3.502
  119    HD2  PHE  15           HD1      PHE  15  -9.456   7.777   7.777
  120    HE1  PHE  15           HE2      PHE  15  -9.905   3.533   3.533
  121    HE2  PHE  15           HE1      PHE  15  -9.551   7.797   7.797
  122    HZ   PHE  15           HZ       PHE  15  -9.776   5.656   5.656
  123    H    GLU  16           H        GLU  16 -11.830   4.898   4.898
  124    HA   GLU  16           HA       GLU  16 -13.362   3.200   3.200
  125   1HB   GLU  16          2HB       GLU  16 -13.874   4.658   4.658
  126   2HB   GLU  16          1HB       GLU  16 -15.057   3.462   3.462
  127   1HG   GLU  16          2HG       GLU  16 -15.000   4.632   4.632
  128   2HG   GLU  16          1HG       GLU  16 -14.131   5.937   5.937
  129    H    GLU  17           H        GLU  17 -11.807   2.591   2.591
  130    HA   GLU  17           HA       GLU  17 -13.140   0.206   0.206
  131   1HB   GLU  17          2HB       GLU  17 -10.290   1.092   1.092
  132   2HB   GLU  17          1HB       GLU  17 -11.099  -0.221  -0.221
  133   1HG   GLU  17          2HG       GLU  17 -12.954   1.621   1.621
  134   2HG   GLU  17          1HG       GLU  17 -11.601   2.722   2.722
  135    H    LEU  18           H        LEU  18 -10.367   0.759   0.759
  136    HA   LEU  18           HA       LEU  18  -9.918  -2.073  -2.073
  137   1HB   LEU  18          2HB       LEU  18  -8.304   0.095   0.095
  138   2HB   LEU  18          1HB       LEU  18  -8.805  -0.120  -0.120
  139    HG   LEU  18           HG       LEU  18  -8.140  -2.520  -2.520
  140   1HD1  LEU  18          3HD1      LEU  18  -7.478  -1.643  -1.643
  141   2HD1  LEU  18          2HD1      LEU  18  -6.500  -2.899  -2.899
  142   3HD1  LEU  18          1HD1      LEU  18  -8.235  -3.137  -3.137
  143   1HD2  LEU  18          1HD2      LEU  18  -6.565  -0.364  -0.364
  144   2HD2  LEU  18          3HD2      LEU  18  -5.977  -2.023  -2.023
  145   3HD2  LEU  18          2HD2      LEU  18  -5.695  -1.078  -1.078
  146    H    LEU  19           H        LEU  19 -12.001   0.313   0.313
  147    HA   LEU  19           HA       LEU  19 -12.267  -1.207  -1.207
  148   1HB   LEU  19          2HB       LEU  19 -13.984   1.138   1.138
  149   2HB   LEU  19          1HB       LEU  19 -13.682   0.553   0.553
  150    HG   LEU  19           HG       LEU  19 -11.814   2.075   2.075
  151   1HD1  LEU  19          3HD1      LEU  19 -13.502   2.798   2.798
  152   2HD1  LEU  19          2HD1      LEU  19 -11.874   2.824   2.824
  153   3HD1  LEU  19          1HD1      LEU  19 -12.247   3.783   3.783
  154   1HD2  LEU  19          2HD2      LEU  19 -11.102   0.057   0.057
  155   2HD2  LEU  19          1HD2      LEU  19 -10.099   0.790   0.790
  156   3HD2  LEU  19          3HD2      LEU  19 -10.350   1.624   1.624
  157    H    LYS  20           H        LYS  20 -13.683  -1.102  -1.102
  158    HA   LYS  20           HA       LYS  20 -16.232  -2.314  -2.314
  159   1HB   LYS  20          2HB       LYS  20 -15.229  -2.351  -2.351
  160   2HB   LYS  20          1HB       LYS  20 -16.889  -2.294  -2.294
  161   1HG   LYS  20          2HG       LYS  20 -15.711   0.035   0.035
  162   2HG   LYS  20          1HG       LYS  20 -15.072  -0.110  -0.110
  163   1HD   LYS  20          2HD       LYS  20 -18.006  -0.212  -0.212
  164   2HD   LYS  20          1HD       LYS  20 -17.183   1.181   1.181
  165   1HE   LYS  20          2HE       LYS  20 -16.742  -1.290  -1.290
  166   2HE   LYS  20          1HE       LYS  20 -18.436  -0.805  -0.805
  167   1HZ   LYS  20          3HZ       LYS  20 -17.630   1.480   1.480
  168   2HZ   LYS  20          2HZ       LYS  20 -16.128   0.771   0.771
  169   3HZ   LYS  20          1HZ       LYS  20 -17.517   0.304   0.304
  170    H    VAL  21           H        VAL  21 -13.105  -3.238  -3.238
  171    HA   VAL  21           HA       VAL  21 -13.794  -6.012  -6.012
  172    HB   VAL  21           HB       VAL  21 -11.938  -4.767  -4.767
  173   1HG1  VAL  21          1HG1      VAL  21 -11.168  -3.504  -3.504
  174   2HG1  VAL  21          3HG1      VAL  21 -10.521  -4.987  -4.987
  175   3HG1  VAL  21          2HG1      VAL  21  -9.853  -4.343  -4.343
  176   1HG2  VAL  21          2HG2      VAL  21 -11.567  -7.342  -7.342
  177   2HG2  VAL  21          1HG2      VAL  21 -11.594  -7.035  -7.035
  178   3HG2  VAL  21          3HG2      VAL  21 -10.153  -6.651  -6.651
  179    H    LEU  22           H        LEU  22 -12.255  -4.171  -4.171
  180    HA   LEU  22           HA       LEU  22 -11.529  -6.363  -6.363
  181   1HB   LEU  22          2HB       LEU  22 -11.714  -3.413  -3.413
  182   2HB   LEU  22          1HB       LEU  22 -11.928  -4.213  -4.213
  183    HG   LEU  22           HG       LEU  22  -9.779  -5.301  -5.301
  184   1HD1  LEU  22          3HD1      LEU  22  -9.914  -5.675  -5.675
  185   2HD1  LEU  22          2HD1      LEU  22  -9.493  -3.981  -3.981
  186   3HD1  LEU  22          1HD1      LEU  22  -8.351  -5.075  -5.075
  187   1HD2  LEU  22          1HD2      LEU  22  -9.844  -2.938  -2.938
  188   2HD2  LEU  22          3HD2      LEU  22  -8.326  -3.319  -3.319
  189   3HD2  LEU  22          2HD2      LEU  22  -9.576  -2.407  -2.407
  190    H    GLY  23           H        GLY  23 -14.275  -4.148  -4.148
  191   1HA   GLY  23          2HA       GLY  23 -15.663  -5.778  -5.778
  192   2HA   GLY  23          1HA       GLY  23 -16.109  -4.142  -4.142
  193    H    VAL  24           H        VAL  24 -18.276  -4.907  -4.907
  194    HA   VAL  24           HA       VAL  24 -18.825  -5.989  -5.989
  195    HB   VAL  24           HB       VAL  24 -20.485  -7.615  -7.615
  196   1HG1  VAL  24          1HG1      VAL  24 -18.146  -8.264  -8.264
  197   2HG1  VAL  24          3HG1      VAL  24 -17.666  -8.054  -8.054
  198   3HG1  VAL  24          2HG1      VAL  24 -18.840  -9.297  -9.297
  199   1HG2  VAL  24          2HG2      VAL  24 -19.201  -6.700  -6.700
  200   2HG2  VAL  24          1HG2      VAL  24 -20.916  -6.698  -6.698
  201   3HG2  VAL  24          3HG2      VAL  24 -20.077  -8.225  -8.225
  202    H    ASN  25           H        ASN  25 -20.131  -4.669  -4.669
  203    HA   ASN  25           HA       ASN  25 -22.709  -3.928  -3.928
  204   1HB   ASN  25          2HB       ASN  25 -21.487  -3.856  -3.856
  205   2HB   ASN  25          1HB       ASN  25 -21.339  -2.165  -2.165
  206   1HD2  ASN  25          2HD2      ASN  25 -24.680  -1.470  -1.470
  207   2HD2  ASN  25          1HD2      ASN  25 -23.110  -0.887  -0.887
  208    H    VAL  26           H        VAL  26 -22.701  -1.072  -1.072
  209    HA   VAL  26           HA       VAL  26 -21.084  -0.040  -0.040
  210    HB   VAL  26           HB       VAL  26 -23.060   1.614   1.614
  211   1HG1  VAL  26          2HG1      VAL  26 -22.866  -1.237  -1.237
  212   2HG1  VAL  26          1HG1      VAL  26 -24.356  -0.372  -0.372
  213   3HG1  VAL  26          3HG1      VAL  26 -22.811   0.233   0.233
  214   1HG2  VAL  26          2HG2      VAL  26 -24.375  -0.617  -0.617
  215   2HG2  VAL  26          1HG2      VAL  26 -24.359   1.102   1.102
  216   3HG2  VAL  26          3HG2      VAL  26 -25.273   0.522   0.522
  217    H    MET  27           H        MET  27 -22.860   0.867   0.867
  218    HA   MET  27           HA       MET  27 -21.593   3.455   3.455
  219   1HB   MET  27          2HB       MET  27 -23.719   2.332   2.332
  220   2HB   MET  27          1HB       MET  27 -22.496   2.023   2.023
  221   1HG   MET  27          2HG       MET  27 -22.154   4.270   4.270
  222   2HG   MET  27          1HG       MET  27 -22.603   4.754   4.754
  223   1HE   MET  27          2HE       MET  27 -23.677   2.866   2.866
  224   2HE   MET  27          1HE       MET  27 -24.082   4.392   4.392
  225   3HE   MET  27          3HE       MET  27 -25.362   3.258   3.258
  226    H    LEU  28           H        LEU  28 -20.753   0.198   0.198
  227    HA   LEU  28           HA       LEU  28 -18.765   0.672   0.672
  228   1HB   LEU  28          2HB       LEU  28 -19.620  -1.480  -1.480
  229   2HB   LEU  28          1HB       LEU  28 -17.897  -1.528  -1.528
  230    HG   LEU  28           HG       LEU  28 -19.164  -2.846  -2.846
  231   1HD1  LEU  28          3HD1      LEU  28 -17.125  -1.266  -1.266
  232   2HD1  LEU  28          2HD1      LEU  28 -18.339  -0.393  -0.393
  233   3HD1  LEU  28          1HD1      LEU  28 -18.004  -2.089  -2.089
  234   1HD2  LEU  28          1HD2      LEU  28 -21.201  -1.223  -1.223
  235   2HD2  LEU  28          3HD2      LEU  28 -20.917  -1.981  -1.981
  236   3HD2  LEU  28          2HD2      LEU  28 -20.423  -0.310  -0.310
  237    H    ARG  29           H        ARG  29 -18.688   1.174   1.174
  238    HA   ARG  29           HA       ARG  29 -15.740   1.340   1.340
  239   1HB   ARG  29          2HB       ARG  29 -17.730   1.887   1.887
  240   2HB   ARG  29          1HB       ARG  29 -15.987   1.695   1.695
  241   1HG   ARG  29          2HG       ARG  29 -16.460  -0.487  -0.487
  242   2HG   ARG  29          1HG       ARG  29 -16.670  -0.611  -0.611
  243   1HD   ARG  29          2HD       ARG  29 -18.853  -1.079  -1.079
  244   2HD   ARG  29          1HD       ARG  29 -19.094   0.433   0.433
  245    HE   ARG  29           HE       ARG  29 -18.137  -2.040  -2.040
  246   1HH1  ARG  29          1HH2      ARG  29 -19.073   1.100   1.100
  247   2HH1  ARG  29          2HH2      ARG  29 -20.308   0.735   0.735
  248   1HH2  ARG  29          2HH1      ARG  29 -20.199  -2.685  -2.685
  249   2HH2  ARG  29          1HH1      ARG  29 -20.946  -1.408  -1.408
  250    H    LYS  30           H        LYS  30 -18.535   3.479   3.479
  251    HA   LYS  30           HA       LYS  30 -17.033   5.846   5.846
  252   1HB   LYS  30          2HB       LYS  30 -19.619   5.307   5.307
  253   2HB   LYS  30          1HB       LYS  30 -19.687   6.008   6.008
  254   1HG   LYS  30          2HG       LYS  30 -19.072   8.107   8.107
  255   2HG   LYS  30          1HG       LYS  30 -18.113   7.474   7.474
  256   1HD   LYS  30          2HD       LYS  30 -20.158   6.885   6.885
  257   2HD   LYS  30          1HD       LYS  30 -21.143   7.453   7.453
  258   1HE   LYS  30          2HE       LYS  30 -19.136   9.353   9.353
  259   2HE   LYS  30          1HE       LYS  30 -20.578   9.031   9.031
  260   1HZ   LYS  30          2HZ       LYS  30 -21.843   9.459   9.459
  261   2HZ   LYS  30          1HZ       LYS  30 -20.403  10.144  10.144
  262   3HZ   LYS  30          3HZ       LYS  30 -21.161  10.807  10.807
  263    H    ILE  31           H        ILE  31 -17.694   4.153   4.153
  264    HA   ILE  31           HA       ILE  31 -17.228   6.491   6.491
  265    HB   ILE  31           HB       ILE  31 -17.250   3.527   3.527
  266   1HG1  ILE  31          2HG1      ILE  31 -19.401   5.487   5.487
  267   2HG1  ILE  31          1HG1      ILE  31 -19.372   4.837   4.837
  268   1HG2  ILE  31          1HG2      ILE  31 -16.919   6.043   6.043
  269   2HG2  ILE  31          3HG2      ILE  31 -17.820   4.707   4.707
  270   3HG2  ILE  31          2HG2      ILE  31 -16.145   4.474   4.474
  271   1HD1  ILE  31          1HD1      ILE  31 -19.173   2.521   2.521
  272   2HD1  ILE  31          3HD1      ILE  31 -19.656   3.333   3.333
  273   3HD1  ILE  31          2HD1      ILE  31 -20.739   3.325   3.325
  274    H    ALA  32           H        ALA  32 -15.326   3.938   3.938
  275    HA   ALA  32           HA       ALA  32 -12.946   4.509   4.509
  276   1HB   ALA  32          2HB       ALA  32 -13.495   2.750   2.750
  277   2HB   ALA  32          1HB       ALA  32 -11.867   2.978   2.978
  278   3HB   ALA  32          3HB       ALA  32 -13.117   2.254   2.254
  279    H    VAL  33           H        VAL  33 -14.362   5.545   5.545
  280    HA   VAL  33           HA       VAL  33 -11.958   6.733   6.733
  281    HB   VAL  33           HB       VAL  33 -14.814   7.468   7.468
  282   1HG1  VAL  33          2HG1      VAL  33 -12.620   8.638   8.638
  283   2HG1  VAL  33          1HG1      VAL  33 -12.531   7.222   7.222
  284   3HG1  VAL  33          3HG1      VAL  33 -13.941   8.279   8.279
  285   1HG2  VAL  33          1HG2      VAL  33 -13.872   4.862   4.862
  286   2HG2  VAL  33          3HG2      VAL  33 -15.181   5.487   5.487
  287   3HG2  VAL  33          2HG2      VAL  33 -13.540   5.422   5.422
  288    H    ALA  34           H        ALA  34 -14.781   7.810   7.810
  289    HA   ALA  34           HA       ALA  34 -13.984  10.591  10.591
  290   1HB   ALA  34          3HB       ALA  34 -16.336   9.356   9.356
  291   2HB   ALA  34          2HB       ALA  34 -15.760   9.478   9.478
  292   3HB   ALA  34          1HB       ALA  34 -15.957  10.935  10.935
  293    H    ALA  35           H        ALA  35 -13.539   7.752   7.752
  294    HA   ALA  35           HA       ALA  35 -12.497   9.039   9.039
  295   1HB   ALA  35          2HB       ALA  35 -12.105   6.272   6.272
  296   2HB   ALA  35          1HB       ALA  35 -11.394   6.764   6.764
  297   3HB   ALA  35          3HB       ALA  35 -13.147   6.739   6.739
  298    H    ALA  36           H        ALA  36 -10.938   7.822   7.822
  299    HA   ALA  36           HA       ALA  36  -8.262   8.366   8.366
  300   1HB   ALA  36          1HB       ALA  36  -9.613   7.460   7.460
  301   2HB   ALA  36          3HB       ALA  36  -8.332   8.597   8.597
  302   3HB   ALA  36          2HB       ALA  36  -7.961   7.144   7.144
  303    H    SER  37           H        SER  37 -10.154  10.103  10.103
  304    HA   SER  37           HA       SER  37 -10.062  12.360  12.360
  305   1HB   SER  37          2HB       SER  37  -9.834  12.493  12.493
  306   2HB   SER  37          1HB       SER  37  -9.764  13.963  13.963
  307    HG   SER  37           HG       SER  37 -11.777  13.289  13.289
  308    H    LYS  38           H        LYS  38  -7.830  11.217  11.217
  309    HA   LYS  38           HA       LYS  38  -5.580  11.621  11.621
  310   1HB   LYS  38          2HB       LYS  38  -5.783  14.198  14.198
  311   2HB   LYS  38          1HB       LYS  38  -4.662  13.822  13.822
  312   1HG   LYS  38          2HG       LYS  38  -6.935  13.463  13.463
  313   2HG   LYS  38          1HG       LYS  38  -7.545  14.590  14.590
  314   1HD   LYS  38          2HD       LYS  38  -4.953  15.233  15.233
  315   2HD   LYS  38          1HD       LYS  38  -6.448  15.476  15.476
  316   1HE   LYS  38          2HE       LYS  38  -6.411  16.491  16.491
  317   2HE   LYS  38          1HE       LYS  38  -5.418  17.363  17.363
  318   1HZ   LYS  38          2HZ       LYS  38  -8.293  16.714  16.714
  319   2HZ   LYS  38          1HZ       LYS  38  -7.694  18.224  18.224
  320   3HZ   LYS  38          3HZ       LYS  38  -7.327  17.637  17.637
  321    HA   PRO  39           HA       PRO  39  -4.830  10.146  10.146
  322   1HB   PRO  39          2HB       PRO  39  -3.925   7.654   7.654
  323   2HB   PRO  39          1HB       PRO  39  -5.609   8.036   8.036
  324   1HG   PRO  39          2HG       PRO  39  -4.335   7.601   7.601
  325   2HG   PRO  39          1HG       PRO  39  -6.015   7.339   7.339
  326   1HD   PRO  39          2HD       PRO  39  -5.095   9.533   9.533
  327   2HD   PRO  39          1HD       PRO  39  -6.641   9.452   9.452
  328    H    ALA  40           H        ALA  40  -2.771   9.841   9.841
  329    HA   ALA  40           HA       ALA  40  -0.465  10.608  10.608
  330   1HB   ALA  40          2HB       ALA  40  -1.083  12.103  12.103
  331   2HB   ALA  40          1HB       ALA  40  -0.701  10.770  10.770
  332   3HB   ALA  40          3HB       ALA  40   0.564  11.478  11.478
  333    H    VAL  41           H        VAL  41   1.683   9.733   9.733
  334    HA   VAL  41           HA       VAL  41   1.490   7.068   7.068
  335    HB   VAL  41           HB       VAL  41   2.383   7.562   7.562
  336   1HG1  VAL  41          1HG1      VAL  41   2.876   5.132   5.132
  337   2HG1  VAL  41          3HG1      VAL  41   3.092   5.162   5.162
  338   3HG1  VAL  41          2HG1      VAL  41   4.101   6.177   6.177
  339   1HG2  VAL  41          1HG2      VAL  41   0.347   5.758   5.758
  340   2HG2  VAL  41          3HG2      VAL  41   0.040   7.082   7.082
  341   3HG2  VAL  41          2HG2      VAL  41   0.824   5.607   5.607
  342    H    GLU  42           H        GLU  42   3.751   6.233   6.233
  343    HA   GLU  42           HA       GLU  42   5.907   8.248   8.248
  344   1HB   GLU  42          2HB       GLU  42   4.781   8.779   8.779
  345   2HB   GLU  42          1HB       GLU  42   4.983   7.109   7.109
  346   1HG   GLU  42          2HG       GLU  42   7.465   7.402   7.402
  347   2HG   GLU  42          1HG       GLU  42   7.186   9.106   9.106
  348    H    ILE  43           H        ILE  43   7.459   7.029   7.029
  349    HA   ILE  43           HA       ILE  43   7.618   4.145   4.145
  350    HB   ILE  43           HB       ILE  43   8.690   5.838   5.838
  351   1HG1  ILE  43          2HG1      ILE  43   7.503   3.650   3.650
  352   2HG1  ILE  43          1HG1      ILE  43   6.603   3.772   3.772
  353   1HG2  ILE  43          1HG2      ILE  43   9.619   3.124   3.124
  354   2HG2  ILE  43          3HG2      ILE  43   9.535   3.487   3.487
  355   3HG2  ILE  43          2HG2      ILE  43  10.557   4.460   4.460
  356   1HD1  ILE  43          2HD1      ILE  43   7.015   6.062   6.062
  357   2HD1  ILE  43          1HD1      ILE  43   5.558   5.072   5.072
  358   3HD1  ILE  43          3HD1      ILE  43   6.015   6.081   6.081
  359    H    LYS  44           H        LYS  44   9.258   3.300   3.300
  360    HA   LYS  44           HA       LYS  44  11.543   5.077   5.077
  361   1HB   LYS  44          2HB       LYS  44  11.213   2.730   2.730
  362   2HB   LYS  44          1HB       LYS  44  11.365   4.422   4.422
  363   1HG   LYS  44          2HG       LYS  44   8.986   4.778   4.778
  364   2HG   LYS  44          1HG       LYS  44   8.768   3.222   3.222
  365   1HD   LYS  44          2HD       LYS  44   9.244   2.027   2.027
  366   2HD   LYS  44          1HD       LYS  44   9.872   3.471   3.471
  367   1HE   LYS  44          2HE       LYS  44   7.067   3.590   3.590
  368   2HE   LYS  44          1HE       LYS  44   7.371   2.593   2.593
  369   1HZ   LYS  44          2HZ       LYS  44   8.508   4.519   4.519
  370   2HZ   LYS  44          1HZ       LYS  44   8.049   5.464   5.464
  371   3HZ   LYS  44          3HZ       LYS  44   6.864   4.814   4.814
  372    H    GLN  45           H        GLN  45  13.181   4.445   4.445
  373    HA   GLN  45           HA       GLN  45  13.351   1.576   1.576
  374   1HB   GLN  45          2HB       GLN  45  13.432   3.254   3.254
  375   2HB   GLN  45          1HB       GLN  45  14.880   3.959   3.959
  376   1HG   GLN  45          2HG       GLN  45  16.033   1.760   1.760
  377   2HG   GLN  45          1HG       GLN  45  14.603   1.126   1.126
  378   1HE2  GLN  45          2HE2      GLN  45  16.247   2.153   2.153
  379   2HE2  GLN  45          1HE2      GLN  45  15.805   0.826   0.826
  380    H    GLU  46           H        GLU  46  14.784   0.243   0.243
  381    HA   GLU  46           HA       GLU  46  17.249   1.398   1.398
  382   1HB   GLU  46          2HB       GLU  46  15.246  -0.530  -0.530
  383   2HB   GLU  46          1HB       GLU  46  16.944  -0.828  -0.828
  384   1HG   GLU  46          2HG       GLU  46  15.920   1.961   1.961
  385   2HG   GLU  46          1HG       GLU  46  15.451   0.769   0.769
  386    H    GLY  47           H        GLY  47  17.480   0.727   0.727
  387   1HA   GLY  47          2HA       GLY  47  19.097  -0.562  -0.562
  388   2HA   GLY  47          1HA       GLY  47  19.062  -1.780  -1.780
  389    H    ASP  48           H        ASP  48  18.247  -3.657  -3.657
  390    HA   ASP  48           HA       ASP  48  16.384  -3.674  -3.674
  391   1HB   ASP  48          2HB       ASP  48  16.251  -6.167  -6.167
  392   2HB   ASP  48          1HB       ASP  48  17.818  -5.569  -5.569
  393    H    THR  49           H        THR  49  15.877  -2.973  -2.973
  394    HA   THR  49           HA       THR  49  13.310  -4.418  -4.418
  395    HB   THR  49           HB       THR  49  14.998  -2.863  -2.863
  396    HG1  THR  49           HG1      THR  49  15.079  -4.839  -4.839
  397   1HG2  THR  49          1HG2      THR  49  12.096  -3.332  -3.332
  398   2HG2  THR  49          3HG2      THR  49  12.951  -3.911  -3.911
  399   3HG2  THR  49          2HG2      THR  49  13.084  -2.220  -2.220
  400    H    PHE  50           H        PHE  50  11.353  -3.320  -3.320
  401    HA   PHE  50           HA       PHE  50  11.465  -0.360  -0.360
  402   1HB   PHE  50          2HB       PHE  50  10.001  -2.255  -2.255
  403   2HB   PHE  50          1HB       PHE  50   9.808  -0.500  -0.500
  404    HD1  PHE  50           HD1      PHE  50  12.087  -3.295  -3.295
  405    HD2  PHE  50           HD2      PHE  50  11.617   0.966   0.966
  406    HE1  PHE  50           HE1      PHE  50  14.163  -3.095  -3.095
  407    HE2  PHE  50           HE2      PHE  50  13.692   1.171   1.171
  408    HZ   PHE  50           HZ       PHE  50  14.975  -0.865  -0.865
  409    H    TYR  51           H        TYR  51  10.194   0.444   0.444
  410    HA   TYR  51           HA       TYR  51   7.865  -1.113  -1.113
  411   1HB   TYR  51          2HB       TYR  51   9.638  -0.308  -0.308
  412   2HB   TYR  51          1HB       TYR  51   9.223   1.342   1.342
  413    HD1  TYR  51           HD1      TYR  51   6.640   1.928   1.928
  414    HD2  TYR  51           HD2      TYR  51   8.565  -1.298  -1.298
  415    HE1  TYR  51           HE1      TYR  51   4.815   1.900   1.900
  416    HE2  TYR  51           HE2      TYR  51   6.755  -1.305  -1.305
  417    HH   TYR  51           HH       TYR  51   5.068   0.257   0.257
  418    H    ILE  52           H        ILE  52   5.770  -0.087  -0.087
  419    HA   ILE  52           HA       ILE  52   5.713   2.573   2.573
  420    HB   ILE  52           HB       ILE  52   3.857   0.408   0.408
  421   1HG1  ILE  52          2HG1      ILE  52   6.689   0.902   0.902
  422   2HG1  ILE  52          1HG1      ILE  52   6.137  -0.545  -0.545
  423   1HG2  ILE  52          1HG2      ILE  52   4.732   3.123   3.123
  424   2HG2  ILE  52          3HG2      ILE  52   4.591   1.981   1.981
  425   3HG2  ILE  52          2HG2      ILE  52   3.201   2.301   2.301
  426   1HD1  ILE  52          1HD1      ILE  52   4.372  -0.670  -0.670
  427   2HD1  ILE  52          3HD1      ILE  52   5.503   0.382   0.382
  428   3HD1  ILE  52          2HD1      ILE  52   6.024  -1.210  -1.210
  429    H    LYS  53           H        LYS  53   4.722   3.713   3.713
  430    HA   LYS  53           HA       LYS  53   2.297   2.583   2.583
  431   1HB   LYS  53          2HB       LYS  53   4.181   3.656   3.656
  432   2HB   LYS  53          1HB       LYS  53   3.700   5.189   5.189
  433   1HG   LYS  53          2HG       LYS  53   1.717   5.275   5.275
  434   2HG   LYS  53          1HG       LYS  53   1.557   3.521   3.521
  435   1HD   LYS  53          2HD       LYS  53   2.057   4.306   4.306
  436   2HD   LYS  53          1HD       LYS  53   3.485   3.475   3.475
  437   1HE   LYS  53          2HE       LYS  53   4.721   5.394   5.394
  438   2HE   LYS  53          1HE       LYS  53   3.338   6.379   6.379
  439   1HZ   LYS  53          3HZ       LYS  53   2.536   5.989   5.989
  440   2HZ   LYS  53          2HZ       LYS  53   4.129   5.500   5.500
  441   3HZ   LYS  53          1HZ       LYS  53   3.819   7.075   7.075
  442    H    THR  54           H        THR  54   0.411   3.086   3.086
  443    HA   THR  54           HA       THR  54   0.232   5.676   5.676
  444    HB   THR  54           HB       THR  54  -1.797   3.420   3.420
  445    HG1  THR  54           HG1      THR  54  -0.380   2.341   2.341
  446   1HG2  THR  54          1HG2      THR  54  -1.858   6.002   6.002
  447   2HG2  THR  54          3HG2      THR  54  -1.457   4.976   4.976
  448   3HG2  THR  54          2HG2      THR  54  -2.918   4.666   4.666
  449    H    SER  55           H        SER  55  -1.267   7.248   7.248
  450    HA   SER  55           HA       SER  55  -2.921   6.541   6.541
  451   1HB   SER  55          2HB       SER  55  -2.281   9.069   9.069
  452   2HB   SER  55          1HB       SER  55  -1.305   7.698   7.698
  453    HG   SER  55           HG       SER  55   0.159   8.924   8.924
  454    H    THR  56           H        THR  56  -4.981   6.958   6.958
  455    HA   THR  56           HA       THR  56  -5.659   9.013   9.013
  456    HB   THR  56           HB       THR  56  -8.027   7.884   7.884
  457    HG1  THR  56           HG1      THR  56  -7.888   5.965   5.965
  458   1HG2  THR  56          3HG2      THR  56  -6.681   7.871   7.871
  459   2HG2  THR  56          2HG2      THR  56  -5.883   6.411   6.411
  460   3HG2  THR  56          1HG2      THR  56  -7.620   6.405   6.405
  461    H    THR  57           H        THR  57  -8.139   9.793   9.793
  462    HA   THR  57           HA       THR  57  -7.747  11.822  11.822
  463    HB   THR  57           HB       THR  57  -9.633  11.801  11.801
  464    HG1  THR  57           HG1      THR  57 -10.060  13.035  13.035
  465   1HG2  THR  57          3HG2      THR  57 -10.003   9.314   9.314
  466   2HG2  THR  57          2HG2      THR  57 -10.803   9.587   9.587
  467   3HG2  THR  57          1HG2      THR  57 -11.481  10.272  10.272
  468    H    VAL  58           H        VAL  58  -9.093   8.557   8.557
  469    HA   VAL  58           HA       VAL  58  -8.697   9.079   9.079
  470    HB   VAL  58           HB       VAL  58 -10.954   7.514   7.514
  471   1HG1  VAL  58          3HG1      VAL  58 -10.055   8.079   8.079
  472   2HG1  VAL  58          2HG1      VAL  58 -11.789   8.012   8.012
  473   3HG1  VAL  58          1HG1      VAL  58 -10.774   6.614   6.614
  474   1HG2  VAL  58          2HG2      VAL  58 -10.853  10.143  10.143
  475   2HG2  VAL  58          1HG2      VAL  58 -12.351   9.364   9.364
  476   3HG2  VAL  58          3HG2      VAL  58 -11.294  10.100  10.100
  477    H    ARG  59           H        ARG  59  -7.871   7.025   7.025
  478    HA   ARG  59           HA       ARG  59  -7.390   4.770   4.770
  479   1HB   ARG  59          2HB       ARG  59  -8.718   4.499   4.499
  480   2HB   ARG  59          1HB       ARG  59  -7.105   4.461   4.461
  481   1HG   ARG  59          2HG       ARG  59  -6.533   2.486   2.486
  482   2HG   ARG  59          1HG       ARG  59  -7.569   2.789   2.789
  483   1HD   ARG  59          2HD       ARG  59  -8.424   0.941   0.941
  484   2HD   ARG  59          1HD       ARG  59  -9.562   2.280   2.280
  485    HE   ARG  59           HE       ARG  59  -8.905   2.991   2.991
  486   1HH1  ARG  59          2HH1      ARG  59  -6.755   2.310   2.310
  487   2HH1  ARG  59          1HH1      ARG  59  -6.848   0.666   0.666
  488   1HH2  ARG  59          1HH2      ARG  59  -9.463  -0.160  -0.160
  489   2HH2  ARG  59          2HH2      ARG  59  -8.380  -0.732  -0.732
  490    H    THR  60           H        THR  60  -5.353   3.451   3.451
  491    HA   THR  60           HA       THR  60  -3.142   4.931   4.931
  492    HB   THR  60           HB       THR  60  -3.023   4.329   4.329
  493    HG1  THR  60           HG1      THR  60  -3.199   6.623   6.623
  494   1HG2  THR  60          2HG2      THR  60  -0.956   4.540   4.540
  495   2HG2  THR  60          1HG2      THR  60  -1.285   6.267   6.267
  496   3HG2  THR  60          3HG2      THR  60  -0.916   5.318   5.318
  497    H    THR  61           H        THR  61  -2.805   3.011   3.011
  498    HA   THR  61           HA       THR  61  -2.347   0.475   0.475
  499    HB   THR  61           HB       THR  61  -2.018  -0.334  -0.334
  500    HG1  THR  61           HG1      THR  61  -2.934   0.997   0.997
  501   1HG2  THR  61          2HG2      THR  61  -3.960  -0.810  -0.810
  502   2HG2  THR  61          1HG2      THR  61  -4.747   0.632   0.632
  503   3HG2  THR  61          3HG2      THR  61  -4.393  -0.730  -0.730
  504    H    GLU  62           H        GLU  62  -0.399  -0.831  -0.831
  505    HA   GLU  62           HA       GLU  62   1.852   0.656   0.656
  506   1HB   GLU  62          2HB       GLU  62   3.277   0.562   0.562
  507   2HB   GLU  62          1HB       GLU  62   1.875   1.595   1.595
  508   1HG   GLU  62          2HG       GLU  62   1.793  -1.308  -1.308
  509   2HG   GLU  62          1HG       GLU  62   2.508  -0.100  -0.100
  510    H    ILE  63           H        ILE  63   3.489  -0.723  -0.723
  511    HA   ILE  63           HA       ILE  63   3.221  -3.612  -3.612
  512    HB   ILE  63           HB       ILE  63   3.835  -4.163  -4.163
  513   1HG1  ILE  63          2HG1      ILE  63   3.233  -1.244  -1.244
  514   2HG1  ILE  63          1HG1      ILE  63   4.873  -1.879  -1.879
  515   1HG2  ILE  63          3HG2      ILE  63   1.405  -3.766  -3.766
  516   2HG2  ILE  63          2HG2      ILE  63   1.398  -2.432  -2.432
  517   3HG2  ILE  63          1HG2      ILE  63   1.634  -4.085  -4.085
  518   1HD1  ILE  63          1HD1      ILE  63   3.484  -3.627  -3.627
  519   2HD1  ILE  63          3HD1      ILE  63   3.075  -1.986  -1.986
  520   3HD1  ILE  63          2HD1      ILE  63   4.763  -2.487  -2.487
  521    H    ASN  64           H        ASN  64   5.358  -4.794  -4.794
  522    HA   ASN  64           HA       ASN  64   7.753  -3.128  -3.128
  523   1HB   ASN  64          2HB       ASN  64   8.743  -4.009  -4.009
  524   2HB   ASN  64          1HB       ASN  64   7.393  -2.910  -2.910
  525   1HD2  ASN  64          2HD2      ASN  64   5.146  -5.482  -5.482
  526   2HD2  ASN  64          1HD2      ASN  64   5.187  -4.038  -4.038
  527    H    PHE  65           H        PHE  65   9.292  -4.362  -4.362
  528    HA   PHE  65           HA       PHE  65   9.477  -7.256  -7.256
  529   1HB   PHE  65          2HB       PHE  65   8.832  -7.955  -7.955
  530   2HB   PHE  65          1HB       PHE  65   7.509  -7.070  -7.070
  531    HD1  PHE  65           HD2      PHE  65   7.073  -4.675  -4.675
  532    HD2  PHE  65           HD1      PHE  65   9.970  -7.106  -7.106
  533    HE1  PHE  65           HE2      PHE  65   7.142  -3.036  -3.036
  534    HE2  PHE  65           HE1      PHE  65  10.045  -5.473  -5.473
  535    HZ   PHE  65           HZ       PHE  65   8.639  -3.437  -3.437
  536    H    LYS  66           H        LYS  66  10.790  -8.181  -8.181
  537    HA   LYS  66           HA       LYS  66  13.062  -6.334  -6.334
  538   1HB   LYS  66          2HB       LYS  66  14.540  -8.421  -8.421
  539   2HB   LYS  66          1HB       LYS  66  13.962  -7.781  -7.781
  540   1HG   LYS  66          2HG       LYS  66  12.040  -9.431  -9.431
  541   2HG   LYS  66          1HG       LYS  66  12.870 -10.157 -10.157
  542   1HD   LYS  66          2HD       LYS  66  13.853 -11.450 -11.450
  543   2HD   LYS  66          1HD       LYS  66  14.913 -10.054 -10.054
  544   1HE   LYS  66          2HE       LYS  66  12.340 -10.020 -10.020
  545   2HE   LYS  66          1HE       LYS  66  13.594 -11.121 -11.121
  546   1HZ   LYS  66          2HZ       LYS  66  15.139  -9.158  -9.158
  547   2HZ   LYS  66          1HZ       LYS  66  13.761  -8.184  -8.184
  548   3HZ   LYS  66          3HZ       LYS  66  13.962  -9.091  -9.091
  549    H    VAL  67           H        VAL  67  14.105  -6.839  -6.839
  550    HA   VAL  67           HA       VAL  67  12.153  -7.967  -7.967
  551    HB   VAL  67           HB       VAL  67  14.841  -7.308  -7.308
  552   1HG1  VAL  67          1HG1      VAL  67  11.952  -6.766  -6.766
  553   2HG1  VAL  67          3HG1      VAL  67  13.239  -5.887  -5.887
  554   3HG1  VAL  67          2HG1      VAL  67  13.155  -7.644  -7.644
  555   1HG2  VAL  67          2HG2      VAL  67  13.252  -5.352  -5.352
  556   2HG2  VAL  67          1HG2      VAL  67  14.997  -5.457  -5.457
  557   3HG2  VAL  67          3HG2      VAL  67  13.979  -4.786  -4.786
  558    H    GLY  68           H        GLY  68  12.130 -10.214 -10.214
  559   1HA   GLY  68          2HA       GLY  68  13.505 -12.029 -12.029
  560   2HA   GLY  68          1HA       GLY  68  14.681 -11.698 -11.698
  561    H    GLU  69           H        GLU  69  12.331 -11.276 -11.276
  562    HA   GLU  69           HA       GLU  69  11.686 -14.183 -14.183
  563   1HB   GLU  69          2HB       GLU  69  12.222 -12.106 -12.106
  564   2HB   GLU  69          1HB       GLU  69  11.779 -13.788 -13.788
  565   1HG   GLU  69          2HG       GLU  69  14.218 -12.959 -12.959
  566   2HG   GLU  69          1HG       GLU  69  14.261 -13.330 -13.330
  567    H    GLU  70           H        GLU  70   9.624 -14.643 -14.643
  568    HA   GLU  70           HA       GLU  70   7.555 -12.675 -12.675
  569   1HB   GLU  70          2HB       GLU  70   7.228 -15.413 -15.413
  570   2HB   GLU  70          1HB       GLU  70   5.975 -14.461 -14.461
  571   1HG   GLU  70          2HG       GLU  70   6.984 -14.732 -14.732
  572   2HG   GLU  70          1HG       GLU  70   8.487 -15.332 -15.332
  573    H    PHE  71           H        PHE  71   5.775 -12.248 -12.248
  574    HA   PHE  71           HA       PHE  71   6.476 -12.486 -12.486
  575   1HB   PHE  71          2HB       PHE  71   6.523 -10.003 -10.003
  576   2HB   PHE  71          1HB       PHE  71   7.895 -10.595 -10.595
  577    HD1  PHE  71           HD2      PHE  71   7.749 -10.491 -10.491
  578    HD2  PHE  71           HD1      PHE  71   5.055  -8.386  -8.386
  579    HE1  PHE  71           HE2      PHE  71   7.096  -9.005  -9.005
  580    HE2  PHE  71           HE1      PHE  71   4.404  -6.900  -6.900
  581    HZ   PHE  71           HZ       PHE  71   5.423  -7.209  -7.209
  582    H    GLU  72           H        GLU  72   4.838 -11.109 -11.109
  583    HA   GLU  72           HA       GLU  72   2.191 -11.367 -11.367
  584   1HB   GLU  72          2HB       GLU  72   2.517 -10.867 -10.867
  585   2HB   GLU  72          1HB       GLU  72   1.186 -11.638 -11.638
  586   1HG   GLU  72          2HG       GLU  72   2.674 -13.556 -13.556
  587   2HG   GLU  72          1HG       GLU  72   3.956 -12.805 -12.805
  588    H    GLU  73           H        GLU  73   0.792  -9.563  -9.563
  589    HA   GLU  73           HA       GLU  73   1.537  -7.037  -7.037
  590   1HB   GLU  73          2HB       GLU  73   1.727  -5.801  -5.801
  591   2HB   GLU  73          1HB       GLU  73   3.050  -6.937  -6.937
  592   1HG   GLU  73          2HG       GLU  73   2.363  -8.342  -8.342
  593   2HG   GLU  73          1HG       GLU  73   0.654  -8.003  -8.003
  594    H    GLN  74           H        GLN  74   0.030  -5.262  -5.262
  595    HA   GLN  74           HA       GLN  74  -2.702  -6.493  -6.493
  596   1HB   GLN  74          2HB       GLN  74  -1.643  -3.711  -3.711
  597   2HB   GLN  74          1HB       GLN  74  -3.344  -3.955  -3.955
  598   1HG   GLN  74          2HG       GLN  74  -3.438  -5.663  -5.663
  599   2HG   GLN  74          1HG       GLN  74  -1.820  -5.139  -5.139
  600   1HE2  GLN  74          2HE2      GLN  74  -5.027  -2.709  -2.709
  601   2HE2  GLN  74          1HE2      GLN  74  -5.207  -4.066  -4.066
  602    H    THR  75           H        THR  75  -4.256  -5.830  -5.830
  603    HA   THR  75           HA       THR  75  -2.916  -5.373  -5.373
  604    HB   THR  75           HB       THR  75  -4.535  -7.294  -7.294
  605    HG1  THR  75           HG1      THR  75  -5.575  -6.908  -6.908
  606   1HG2  THR  75          2HG2      THR  75  -6.234  -5.164  -5.164
  607   2HG2  THR  75          1HG2      THR  75  -6.941  -5.888  -5.888
  608   3HG2  THR  75          3HG2      THR  75  -6.579  -6.891  -6.891
  609    H    VAL  76           H        VAL  76  -5.647  -4.276  -4.276
  610    HA   VAL  76           HA       VAL  76  -5.176  -1.499  -1.499
  611    HB   VAL  76           HB       VAL  76  -6.379  -2.374  -2.374
  612   1HG1  VAL  76          2HG1      VAL  76  -5.477   0.281   0.281
  613   2HG1  VAL  76          1HG1      VAL  76  -5.760   0.024   0.024
  614   3HG1  VAL  76          3HG1      VAL  76  -7.087  -0.155  -0.155
  615   1HG2  VAL  76          1HG2      VAL  76  -3.937  -3.014  -3.014
  616   2HG2  VAL  76          3HG2      VAL  76  -4.245  -1.973  -1.973
  617   3HG2  VAL  76          2HG2      VAL  76  -3.597  -1.287  -1.287
  618    H    ASP  77           H        ASP  77  -7.549  -4.015  -4.015
  619    HA   ASP  77           HA       ASP  77  -9.811  -2.172  -2.172
  620   1HB   ASP  77          2HB       ASP  77  -9.646  -4.590  -4.590
  621   2HB   ASP  77          1HB       ASP  77 -10.186  -5.083  -5.083
  622    H    GLY  78           H        GLY  78  -8.027  -4.578  -4.578
  623   1HA   GLY  78          2HA       GLY  78  -7.765  -3.705  -3.705
  624   2HA   GLY  78          1HA       GLY  78  -9.527  -3.755  -3.755
  625    H    ARG  79           H        ARG  79  -7.195  -6.044  -6.044
  626    HA   ARG  79           HA       ARG  79  -8.150  -8.127  -8.127
  627   1HB   ARG  79          2HB       ARG  79  -8.202  -8.092  -8.092
  628   2HB   ARG  79          1HB       ARG  79  -7.937  -9.618  -9.618
  629   1HG   ARG  79          2HG       ARG  79 -10.148  -7.974  -7.974
  630   2HG   ARG  79          1HG       ARG  79 -10.407  -8.596  -8.596
  631   1HD   ARG  79          2HD       ARG  79  -9.437 -10.394 -10.394
  632   2HD   ARG  79          1HD       ARG  79 -11.155 -10.085 -10.085
  633    HE   ARG  79           HE       ARG  79  -9.631 -11.012 -11.012
  634   1HH1  ARG  79          1HH2      ARG  79 -11.946 -11.736 -11.736
  635   2HH1  ARG  79          2HH2      ARG  79 -12.512 -13.143 -13.143
  636   1HH2  ARG  79          2HH1      ARG  79 -10.288 -12.793 -12.793
  637   2HH2  ARG  79          1HH1      ARG  79 -11.572 -13.742 -13.742
  638    HA   PRO  80           HA       PRO  80  -3.807  -9.005  -9.005
  639   1HB   PRO  80          2HB       PRO  80  -3.869 -11.623 -11.623
  640   2HB   PRO  80          1HB       PRO  80  -4.194 -10.241 -10.241
  641   1HG   PRO  80          2HG       PRO  80  -6.108 -12.208 -12.208
  642   2HG   PRO  80          1HG       PRO  80  -6.249 -11.243 -11.243
  643   1HD   PRO  80          2HD       PRO  80  -7.520 -10.696 -10.696
  644   2HD   PRO  80          1HD       PRO  80  -7.396  -9.585  -9.585
  645    H    CYS  81           H        CYS  81  -2.207  -9.897  -9.897
  646    HA   CYS  81           HA       CYS  81  -2.716 -12.171 -12.171
  647   1HB   CYS  81          2HB       CYS  81  -2.261 -10.850 -10.850
  648   2HB   CYS  81          1HB       CYS  81  -3.819 -10.494 -10.494
  649    HG   CYS  81           HG       CYS  81  -2.701  -8.191  -8.191
  650    H    LYS  82           H        LYS  82  -0.768 -13.056 -13.056
  651    HA   LYS  82           HA       LYS  82   1.685 -11.864 -11.864
  652   1HB   LYS  82          2HB       LYS  82   1.282 -14.275 -14.275
  653   2HB   LYS  82          1HB       LYS  82   1.213 -14.487 -14.487
  654   1HG   LYS  82          2HG       LYS  82   3.589 -13.358 -13.358
  655   2HG   LYS  82          1HG       LYS  82   3.571 -13.907 -13.907
  656   1HD   LYS  82          2HD       LYS  82   2.695 -16.156 -16.156
  657   2HD   LYS  82          1HD       LYS  82   3.737 -15.485 -15.485
  658   1HE   LYS  82          2HE       LYS  82   5.391 -16.555 -16.555
  659   2HE   LYS  82          1HE       LYS  82   5.314 -15.142 -15.142
  660   1HZ   LYS  82          2HZ       LYS  82   3.794 -17.665 -17.665
  661   2HZ   LYS  82          1HZ       LYS  82   5.171 -17.199 -17.199
  662   3HZ   LYS  82          3HZ       LYS  82   3.735 -16.307 -16.307
  663    H    SER  83           H        SER  83   2.769 -10.449 -10.449
  664    HA   SER  83           HA       SER  83   2.390 -10.506 -10.506
  665   1HB   SER  83          2HB       SER  83   2.000  -8.335  -8.335
  666   2HB   SER  83          1HB       SER  83   3.296  -8.443  -8.443
  667    HG   SER  83           HG       SER  83   3.784  -7.134  -7.134
  668    H    LEU  84           H        LEU  84   4.403  -9.925  -9.925
  669    HA   LEU  84           HA       LEU  84   6.978 -10.717 -10.717
  670   1HB   LEU  84          2HB       LEU  84   6.067 -12.896 -12.896
  671   2HB   LEU  84          1HB       LEU  84   5.773 -12.237 -12.237
  672    HG   LEU  84           HG       LEU  84   8.187 -11.864 -11.864
  673   1HD1  LEU  84          1HD1      LEU  84   8.727 -11.509 -11.509
  674   2HD1  LEU  84          3HD1      LEU  84   8.509 -13.235 -13.235
  675   3HD1  LEU  84          2HD1      LEU  84   9.804 -12.659 -12.659
  676   1HD2  LEU  84          2HD2      LEU  84   6.917 -14.202 -14.202
  677   2HD2  LEU  84          1HD2      LEU  84   8.650 -14.057 -14.057
  678   3HD2  LEU  84          3HD2      LEU  84   8.069 -14.668 -14.668
  679    H    VAL  85           H        VAL  85   8.761  -9.971  -9.971
  680    HA   VAL  85           HA       VAL  85   7.867  -8.359  -8.359
  681    HB   VAL  85           HB       VAL  85   9.560  -7.233  -7.233
  682   1HG1  VAL  85          2HG1      VAL  85   9.013  -6.404  -6.404
  683   2HG1  VAL  85          1HG1      VAL  85   8.389  -5.208  -5.208
  684   3HG1  VAL  85          3HG1      VAL  85  10.088  -5.675  -5.675
  685   1HG2  VAL  85          3HG2      VAL  85   6.622  -7.072  -7.072
  686   2HG2  VAL  85          2HG2      VAL  85   7.409  -7.380  -7.380
  687   3HG2  VAL  85          1HG2      VAL  85   7.429  -5.758  -5.758
  688    H    LYS  86           H        LYS  86   9.274  -8.312  -8.312
  689    HA   LYS  86           HA       LYS  86  12.098  -9.124  -9.124
  690   1HB   LYS  86          2HB       LYS  86  11.804  -9.982  -9.982
  691   2HB   LYS  86          1HB       LYS  86  11.442 -11.029 -11.029
  692   1HG   LYS  86          2HG       LYS  86   9.040 -10.329 -10.329
  693   2HG   LYS  86          1HG       LYS  86   9.455  -9.408  -9.408
  694   1HD   LYS  86          2HD       LYS  86  10.303 -11.505 -11.505
  695   2HD   LYS  86          1HD       LYS  86   9.769 -12.401 -12.401
  696   1HE   LYS  86          2HE       LYS  86   7.550 -12.224 -12.224
  697   2HE   LYS  86          1HE       LYS  86   7.751 -10.630 -10.630
  698   1HZ   LYS  86          2HZ       LYS  86   8.951 -12.992 -12.992
  699   2HZ   LYS  86          1HZ       LYS  86   7.300 -12.660 -12.660
  700   3HZ   LYS  86          3HZ       LYS  86   8.463 -11.523 -11.523
  701    H    TRP  87           H        TRP  87  13.553  -8.174  -8.174
  702    HA   TRP  87           HA       TRP  87  12.646  -5.458  -5.458
  703   1HB   TRP  87          2HB       TRP  87  15.279  -6.920  -6.920
  704   2HB   TRP  87          1HB       TRP  87  15.038  -5.320  -5.320
  705    HD1  TRP  87           HD1      TRP  87  15.846  -7.079  -7.079
  706    HE1  TRP  87           HE1      TRP  87  15.953  -5.433  -5.433
  707    HE3  TRP  87           HE3      TRP  87  13.749  -2.984  -2.984
  708    HZ2  TRP  87           HZ2      TRP  87  15.237  -2.728  -2.728
  709    HZ3  TRP  87           HZ3      TRP  87  13.444  -0.889  -0.889
  710    HH2  TRP  87           HH2      TRP  87  14.186  -0.762  -0.762
  711    H    GLU  88           H        GLU  88  13.177  -4.625  -4.625
  712    HA   GLU  88           HA       GLU  88  12.745  -6.653  -6.653
  713   1HB   GLU  88          2HB       GLU  88  10.688  -5.198  -5.198
  714   2HB   GLU  88          1HB       GLU  88  11.564  -3.881  -3.881
  715   1HG   GLU  88          2HG       GLU  88  10.241  -4.753  -4.753
  716   2HG   GLU  88          1HG       GLU  88  11.830  -5.471  -5.471
  717    H    SER  89           H        SER  89  13.684  -3.366  -3.366
  718    HA   SER  89           HA       SER  89  15.882  -3.491  -3.491
  719   1HB   SER  89          2HB       SER  89  15.456  -1.199  -1.199
  720   2HB   SER  89          1HB       SER  89  13.926  -2.061  -2.061
  721    HG   SER  89           HG       SER  89  14.457   0.079   0.079
  722    H    GLU  90           H        GLU  90  16.782  -0.810  -0.810
  723    HA   GLU  90           HA       GLU  90  18.171  -1.637  -1.637
  724   1HB   GLU  90          2HB       GLU  90  19.215   0.636   0.636
  725   2HB   GLU  90          1HB       GLU  90  19.365  -0.293  -0.293
  726   1HG   GLU  90          2HG       GLU  90  17.663   0.950   0.950
  727   2HG   GLU  90          1HG       GLU  90  17.065   1.610   1.610
  728    H    ASN  91           H        ASN  91  15.347   0.300   0.300
  729    HA   ASN  91           HA       ASN  91  14.982   0.678   0.678
  730   1HB   ASN  91          2HB       ASN  91  14.518   2.916   2.916
  731   2HB   ASN  91          1HB       ASN  91  14.437   3.002   3.002
  732   1HD2  ASN  91          2HD2      ASN  91  17.884   3.909   3.909
  733   2HD2  ASN  91          1HD2      ASN  91  16.353   4.073   4.073
  734    H    LYS  92           H        LYS  92  13.658  -1.024  -1.024
  735    HA   LYS  92           HA       LYS  92  10.895  -0.045  -0.045
  736   1HB   LYS  92          2HB       LYS  92  11.438   0.494   0.494
  737   2HB   LYS  92          1HB       LYS  92  11.901  -1.181  -1.181
  738   1HG   LYS  92          2HG       LYS  92   9.570  -1.873  -1.873
  739   2HG   LYS  92          1HG       LYS  92   9.140  -0.165  -0.165
  740   1HD   LYS  92          2HD       LYS  92   9.812   0.137   0.137
  741   2HD   LYS  92          1HD       LYS  92  10.196  -1.582  -1.582
  742   1HE   LYS  92          2HE       LYS  92   7.472  -0.735  -0.735
  743   2HE   LYS  92          1HE       LYS  92   7.834  -0.732  -0.732
  744   1HZ   LYS  92          2HZ       LYS  92   8.465  -3.081  -3.081
  745   2HZ   LYS  92          1HZ       LYS  92   6.898  -2.857  -2.857
  746   3HZ   LYS  92          3HZ       LYS  92   8.216  -3.000  -3.000
  747    H    MET  93           H        MET  93  10.290  -1.557  -1.557
  748    HA   MET  93           HA       MET  93  10.861  -4.425  -4.425
  749   1HB   MET  93          2HB       MET  93  10.284  -4.731  -4.731
  750   2HB   MET  93          1HB       MET  93  11.869  -4.105  -4.105
  751   1HG   MET  93          2HG       MET  93  11.406  -1.992  -1.992
  752   2HG   MET  93          1HG       MET  93   9.695  -2.113  -2.113
  753   1HE   MET  93          2HE       MET  93  12.275  -4.140  -4.140
  754   2HE   MET  93          1HE       MET  93  12.446  -2.679  -2.679
  755   3HE   MET  93          3HE       MET  93  11.799  -4.155  -4.155
  756    H    VAL  94           H        VAL  94   9.201  -5.945  -5.945
  757    HA   VAL  94           HA       VAL  94   6.451  -4.794  -4.794
  758    HB   VAL  94           HB       VAL  94   7.028  -7.632  -7.632
  759   1HG1  VAL  94          1HG1      VAL  94   4.841  -5.885  -5.885
  760   2HG1  VAL  94          3HG1      VAL  94   5.419  -6.046  -6.046
  761   3HG1  VAL  94          2HG1      VAL  94   4.976  -7.480  -7.480
  762   1HG2  VAL  94          1HG2      VAL  94   8.034  -5.217  -5.217
  763   2HG2  VAL  94          3HG2      VAL  94   8.759  -6.818  -6.818
  764   3HG2  VAL  94          2HG2      VAL  94   7.397  -6.561  -6.561
  765    H    CYS  95           H        CYS  95   4.732  -6.373  -6.373
  766    HA   CYS  95           HA       CYS  95   5.813  -7.935  -7.935
  767   1HB   CYS  95          2HB       CYS  95   5.394  -5.671  -5.671
  768   2HB   CYS  95          1HB       CYS  95   3.744  -5.739  -5.739
  769    HG   CYS  95           HG       CYS  95   3.598  -7.970  -7.970
  770    H    GLU  96           H        GLU  96   4.570  -9.642  -9.642
  771    HA   GLU  96           HA       GLU  96   1.991 -10.023 -10.023
  772   1HB   GLU  96          2HB       GLU  96   2.363 -12.469 -12.469
  773   2HB   GLU  96          1HB       GLU  96   3.606 -11.759 -11.759
  774   1HG   GLU  96          2HG       GLU  96   4.119 -11.658 -11.658
  775   2HG   GLU  96          1HG       GLU  96   4.183 -13.255 -13.255
  776    H    GLN  97           H        GLN  97   0.270 -11.137 -11.137
  777    HA   GLN  97           HA       GLN  97   0.755 -11.042 -11.042
  778   1HB   GLN  97          2HB       GLN  97   0.219  -8.669  -8.669
  779   2HB   GLN  97          1HB       GLN  97  -1.432  -9.275  -9.275
  780   1HG   GLN  97          2HG       GLN  97  -0.909  -9.992  -9.992
  781   2HG   GLN  97          1HG       GLN  97   0.402  -8.824  -8.824
  782   1HE2  GLN  97          2HE2      GLN  97  -1.721  -6.009  -6.009
  783   2HE2  GLN  97          1HE2      GLN  97  -0.131  -6.583  -6.583
  784    H    LYS  98           H        LYS  98  -0.659 -12.308 -12.308
  785    HA   LYS  98           HA       LYS  98  -3.208 -13.139 -13.139
  786   1HB   LYS  98          2HB       LYS  98  -2.714 -15.531 -15.531
  787   2HB   LYS  98          1HB       LYS  98  -1.615 -14.874 -14.874
  788   1HG   LYS  98          2HG       LYS  98   0.198 -15.011 -15.011
  789   2HG   LYS  98          1HG       LYS  98  -0.722 -14.540 -14.540
  790   1HD   LYS  98          2HD       LYS  98  -0.289 -16.765 -16.765
  791   2HD   LYS  98          1HD       LYS  98  -1.838 -16.919 -16.919
  792   1HE   LYS  98          2HE       LYS  98  -0.263 -18.559 -18.559
  793   2HE   LYS  98          1HE       LYS  98  -0.622 -17.347 -17.347
  794   1HZ   LYS  98          2HZ       LYS  98   1.670 -16.966 -16.966
  795   2HZ   LYS  98          1HZ       LYS  98   1.818 -18.005 -18.005
  796   3HZ   LYS  98          3HZ       LYS  98   1.429 -16.371 -16.371
  797    H    LEU  99           H        LEU  99  -4.772 -13.837 -13.837
  798    HA   LEU  99           HA       LEU  99  -4.578 -12.517 -12.517
  799   1HB   LEU  99          2HB       LEU  99  -6.292 -14.850 -14.850
  800   2HB   LEU  99          1HB       LEU  99  -6.506 -13.980 -13.980
  801    HG   LEU  99           HG       LEU  99  -6.379 -12.346 -12.346
  802   1HD1  LEU  99          2HD1      LEU  99  -8.535 -14.325 -14.325
  803   2HD1  LEU  99          1HD1      LEU  99  -8.974 -12.793 -12.793
  804   3HD1  LEU  99          3HD1      LEU  99  -7.876 -13.901 -13.901
  805   1HD2  LEU  99          2HD2      LEU  99  -6.656 -11.417 -11.417
  806   2HD2  LEU  99          1HD2      LEU  99  -8.000 -11.012 -11.012
  807   3HD2  LEU  99          3HD2      LEU  99  -8.180 -12.296 -12.296
  808    H    LEU 100           H        LEU 100  -4.722 -13.603 -13.603
  809    HA   LEU 100           HA       LEU 100  -2.722 -15.782 -15.782
  810   1HB   LEU 100          2HB       LEU 100  -3.785 -13.733 -13.733
  811   2HB   LEU 100          1HB       LEU 100  -2.854 -15.133 -15.133
  812    HG   LEU 100           HG       LEU 100  -1.849 -13.292 -13.292
  813   1HD1  LEU 100          3HD1      LEU 100  -1.698 -13.015 -13.015
  814   2HD1  LEU 100          2HD1      LEU 100  -0.400 -12.397 -12.397
  815   3HD1  LEU 100          1HD1      LEU 100  -2.040 -11.776 -11.776
  816   1HD2  LEU 100          2HD2      LEU 100  -0.802 -15.551 -15.551
  817   2HD2  LEU 100          1HD2      LEU 100  -0.483 -15.151 -15.151
  818   3HD2  LEU 100          3HD2      LEU 100   0.324 -14.254 -14.254
  819    H    LYS 101           H        LYS 101  -6.061 -15.363 -15.363
  820    HA   LYS 101           HA       LYS 101  -6.503 -18.012 -18.012
  821   1HB   LYS 101          2HB       LYS 101  -6.926 -15.936 -15.936
  822   2HB   LYS 101          1HB       LYS 101  -8.455 -15.879 -15.879
  823   1HG   LYS 101          2HG       LYS 101  -7.581 -18.572 -18.572
  824   2HG   LYS 101          1HG       LYS 101  -8.050 -17.452 -17.452
  825   1HD   LYS 101          2HD       LYS 101 -10.097 -16.990 -16.990
  826   2HD   LYS 101          1HD       LYS 101  -9.706 -18.616 -18.616
  827   1HE   LYS 101          2HE       LYS 101  -9.799 -18.232 -18.232
  828   2HE   LYS 101          1HE       LYS 101 -11.343 -18.154 -18.154
  829   1HZ   LYS 101          3HZ       LYS 101  -9.463 -20.332 -20.332
  830   2HZ   LYS 101          2HZ       LYS 101 -10.424 -20.424 -20.424
  831   3HZ   LYS 101          1HZ       LYS 101 -11.154 -20.305 -20.305
  832    H    GLY 102           H        GLY 102  -7.910 -19.140 -19.140
  833   1HA   GLY 102          2HA       GLY 102  -9.500 -19.572 -19.572
  834   2HA   GLY 102          1HA       GLY 102 -10.153 -17.960 -17.960
  835    H    GLU 103           H        GLU 103 -10.364 -17.778 -17.778
  836    HA   GLU 103           HA       GLU 103  -8.226 -16.298 -16.298
  837   1HB   GLU 103          2HB       GLU 103  -7.213 -18.584 -18.584
  838   2HB   GLU 103          1HB       GLU 103  -8.575 -19.085 -19.085
  839   1HG   GLU 103          2HG       GLU 103  -7.972 -17.637 -17.637
  840   2HG   GLU 103          1HG       GLU 103  -6.919 -16.677 -16.677
  841    H    GLY 104           H        GLY 104  -8.963 -15.212 -15.212
  842   1HA   GLY 104          2HA       GLY 104 -11.335 -16.160 -16.160
  843   2HA   GLY 104          1HA       GLY 104 -11.531 -14.641 -14.641
  844    HA   PRO 105           HA       PRO 105  -9.575 -12.705 -12.705
  845   1HB   PRO 105          2HB       PRO 105  -8.902 -10.304 -10.304
  846   2HB   PRO 105          1HB       PRO 105 -10.562 -10.733 -10.733
  847   1HG   PRO 105          2HG       PRO 105  -9.348 -10.552 -10.552
  848   2HG   PRO 105          1HG       PRO 105 -11.052 -10.451 -10.451
  849   1HD   PRO 105          2HD       PRO 105  -9.714 -12.720 -12.720
  850   2HD   PRO 105          1HD       PRO 105 -11.375 -12.662 -12.662
  851    H    LYS 106           H        LYS 106  -7.416 -11.242 -11.242
  852    HA   LYS 106           HA       LYS 106  -5.221 -12.383 -12.383
  853   1HB   LYS 106          2HB       LYS 106  -5.353 -13.625 -13.625
  854   2HB   LYS 106          1HB       LYS 106  -5.284 -12.105 -12.105
  855   1HG   LYS 106          2HG       LYS 106  -3.058 -11.693 -11.693
  856   2HG   LYS 106          1HG       LYS 106  -3.132 -12.840 -12.840
  857   1HD   LYS 106          2HD       LYS 106  -2.914 -14.693 -14.693
  858   2HD   LYS 106          1HD       LYS 106  -3.556 -13.836 -13.836
  859   1HE   LYS 106          2HE       LYS 106  -0.870 -13.270 -13.270
  860   2HE   LYS 106          1HE       LYS 106  -1.102 -14.222 -14.222
  861   1HZ   LYS 106          3HZ       LYS 106  -2.373 -12.141 -12.141
  862   2HZ   LYS 106          2HZ       LYS 106  -1.509 -11.338 -11.338
  863   3HZ   LYS 106          1HZ       LYS 106  -0.677 -12.132 -12.132
  864    H    THR 107           H        THR 107  -3.539 -10.861 -10.861
  865    HA   THR 107           HA       THR 107  -4.000  -8.149  -8.149
  866    HB   THR 107           HB       THR 107  -2.750  -7.555  -7.555
  867    HG1  THR 107           HG1      THR 107  -4.387  -9.808  -9.808
  868   1HG2  THR 107          1HG2      THR 107  -5.698  -7.924  -7.924
  869   2HG2  THR 107          3HG2      THR 107  -5.065  -7.063  -7.063
  870   3HG2  THR 107          2HG2      THR 107  -4.741  -6.459  -6.459
  871    H    SER 108           H        SER 108  -2.216  -6.953  -6.953
  872    HA   SER 108           HA       SER 108   0.505  -7.820  -7.820
  873   1HB   SER 108          2HB       SER 108   0.869  -7.876  -7.876
  874   2HB   SER 108          1HB       SER 108   0.480  -9.331  -9.331
  875    HG   SER 108           HG       SER 108  -1.555  -9.253  -9.253
  876    H    TRP 109           H        TRP 109   1.672  -5.913  -5.913
  877    HA   TRP 109           HA       TRP 109   0.756  -3.691  -3.691
  878   1HB   TRP 109          2HB       TRP 109   1.365  -2.108  -2.108
  879   2HB   TRP 109          1HB       TRP 109  -0.097  -3.054  -3.054
  880    HD1  TRP 109           HD1      TRP 109  -0.150  -4.775  -4.775
  881    HE1  TRP 109           HE1      TRP 109   1.478  -5.340  -5.340
  882    HE3  TRP 109           HE3      TRP 109   4.002  -2.259  -2.259
  883    HZ2  TRP 109           HZ2      TRP 109   4.181  -4.800  -4.800
  884    HZ3  TRP 109           HZ3      TRP 109   6.087  -2.312  -2.312
  885    HH2  TRP 109           HH2      TRP 109   6.185  -3.575  -3.575
  886    H    THR 110           H        THR 110   2.407  -1.997  -1.997
  887    HA   THR 110           HA       THR 110   5.184  -3.069  -3.069
  888    HB   THR 110           HB       THR 110   5.753  -2.366  -2.366
  889    HG1  THR 110           HG1      THR 110   4.471  -1.076  -1.076
  890   1HG2  THR 110          3HG2      THR 110   3.702  -4.266  -4.266
  891   2HG2  THR 110          2HG2      THR 110   3.226  -3.350  -3.350
  892   3HG2  THR 110          1HG2      THR 110   4.787  -4.167  -4.167
  893    H    MET 111           H        MET 111   6.820  -1.287  -1.287
  894    HA   MET 111           HA       MET 111   5.843   1.441   1.441
  895   1HB   MET 111          2HB       MET 111   7.377   1.618   1.618
  896   2HB   MET 111          1HB       MET 111   5.904   0.684   0.684
  897   1HG   MET 111          2HG       MET 111   7.087  -1.392  -1.392
  898   2HG   MET 111          1HG       MET 111   8.538  -0.584  -0.584
  899   1HE   MET 111          2HE       MET 111   5.866  -0.381  -0.381
  900   2HE   MET 111          1HE       MET 111   6.572  -0.883  -0.883
  901   3HE   MET 111          3HE       MET 111   6.502   0.832   0.832
  902    H    GLU 112           H        GLU 112   7.025   2.644   2.644
  903    HA   GLU 112           HA       GLU 112   9.802   1.717   1.717
  904   1HB   GLU 112          2HB       GLU 112   7.920   1.943   1.943
  905   2HB   GLU 112          1HB       GLU 112   8.249   3.671   3.671
  906   1HG   GLU 112          2HG       GLU 112  10.790   2.545   2.545
  907   2HG   GLU 112          1HG       GLU 112   9.834   1.560   1.560
  908    H    LEU 113           H        LEU 113  11.477   3.308   3.308
  909    HA   LEU 113           HA       LEU 113  10.867   5.878   5.878
  910   1HB   LEU 113          2HB       LEU 113  12.580   3.865   3.865
  911   2HB   LEU 113          1HB       LEU 113  13.665   4.921   4.921
  912    HG   LEU 113           HG       LEU 113  13.500   5.374   5.374
  913   1HD1  LEU 113          3HD1      LEU 113  14.206   7.067   7.067
  914   2HD1  LEU 113          2HD1      LEU 113  12.567   7.705   7.705
  915   3HD1  LEU 113          1HD1      LEU 113  13.589   7.740   7.740
  916   1HD2  LEU 113          1HD2      LEU 113  10.962   4.996   4.996
  917   2HD2  LEU 113          3HD2      LEU 113  11.569   6.362   6.362
  918   3HD2  LEU 113          2HD2      LEU 113  10.836   6.630   6.630
  919    H    THR 114           H        THR 114  11.719   7.771   7.771
  920    HA   THR 114           HA       THR 114  12.611   7.319   7.319
  921    HB   THR 114           HB       THR 114  12.165   9.709   9.709
  922    HG1  THR 114           HG1      THR 114  12.639  10.665  10.665
  923   1HG2  THR 114          3HG2      THR 114  10.298   8.051   8.051
  924   2HG2  THR 114          2HG2      THR 114   9.943   8.390   8.390
  925   3HG2  THR 114          1HG2      THR 114   9.762   9.660   9.660
  926    H    ASN 115           H        ASN 115  14.252   9.185   9.185
  927    HA   ASN 115           HA       ASN 115  16.710   8.626   8.626
  928   1HB   ASN 115          2HB       ASN 115  17.736  10.130  10.130
  929   2HB   ASN 115          1HB       ASN 115  16.763   8.840   8.840
  930   1HD2  ASN 115          2HD2      ASN 115  14.614  11.097  11.097
  931   2HD2  ASN 115          1HD2      ASN 115  15.224   9.517   9.517
  932    H    ASP 116           H        ASP 116  14.380  11.231  11.231
  933    HA   ASP 116           HA       ASP 116  16.246  13.074  13.074
  934   1HB   ASP 116          2HB       ASP 116  14.227  14.564  14.564
  935   2HB   ASP 116          1HB       ASP 116  14.636  14.085  14.085
  936    H    GLY 117           H        GLY 117  13.962  10.621  10.621
  937   1HA   GLY 117          2HA       GLY 117  14.279   9.850   9.850
  938   2HA   GLY 117          1HA       GLY 117  14.193  11.542  11.542
  939    H    GLU 118           H        GLU 118  11.937  11.360  11.360
  940    HA   GLU 118           HA       GLU 118   9.694  11.539  11.539
  941   1HB   GLU 118          2HB       GLU 118   9.950  11.035  11.035
  942   2HB   GLU 118          1HB       GLU 118   8.380  10.962  10.962
  943   1HG   GLU 118          2HG       GLU 118   8.432  13.224  13.224
  944   2HG   GLU 118          1HG       GLU 118  10.184  13.328  13.328
  945    H    LEU 119           H        LEU 119   7.756   9.884   9.884
  946    HA   LEU 119           HA       LEU 119   8.746   7.098   7.098
  947   1HB   LEU 119          2HB       LEU 119   9.146   7.916   7.916
  948   2HB   LEU 119          1HB       LEU 119   7.411   8.160   8.160
  949    HG   LEU 119           HG       LEU 119   8.561   5.486   5.486
  950   1HD1  LEU 119          1HD1      LEU 119   8.476   6.825   6.825
  951   2HD1  LEU 119          3HD1      LEU 119   8.088   5.107   5.107
  952   3HD1  LEU 119          2HD1      LEU 119   9.654   5.682   5.682
  953   1HD2  LEU 119          3HD2      LEU 119   5.951   6.556   6.556
  954   2HD2  LEU 119          2HD2      LEU 119   6.233   5.437   5.437
  955   3HD2  LEU 119          1HD2      LEU 119   6.396   4.883   4.883
  956    H    ILE 120           H        ILE 120   7.284   6.123   6.123
  957    HA   ILE 120           HA       ILE 120   4.431   6.980   6.980
  958    HB   ILE 120           HB       ILE 120   5.322   6.990   6.990
  959   1HG1  ILE 120          2HG1      ILE 120   3.609   4.508   4.508
  960   2HG1  ILE 120          1HG1      ILE 120   2.970   6.149   6.149
  961   1HG2  ILE 120          2HG2      ILE 120   6.134   4.155   4.155
  962   2HG2  ILE 120          1HG2      ILE 120   6.046   4.743   4.743
  963   3HG2  ILE 120          3HG2      ILE 120   7.171   5.483   5.483
  964   1HD1  ILE 120          3HD1      ILE 120   3.891   6.614   6.614
  965   2HD1  ILE 120          2HD1      ILE 120   4.395   4.928   4.928
  966   3HD1  ILE 120          1HD1      ILE 120   2.681   5.331   5.331
  967    H    LEU 121           H        LEU 121   2.787   5.297   5.297
  968    HA   LEU 121           HA       LEU 121   3.827   2.717   2.717
  969   1HB   LEU 121          2HB       LEU 121   3.437   4.083   4.083
  970   2HB   LEU 121          1HB       LEU 121   1.911   4.671   4.671
  971    HG   LEU 121           HG       LEU 121   1.900   2.853   2.853
  972   1HD1  LEU 121          2HD1      LEU 121   0.043   3.686   3.686
  973   2HD1  LEU 121          1HD1      LEU 121   0.178   2.016   2.016
  974   3HD1  LEU 121          3HD1      LEU 121  -0.254   2.359   2.359
  975   1HD2  LEU 121          1HD2      LEU 121   3.490   1.387   1.387
  976   2HD2  LEU 121          3HD2      LEU 121   2.125   0.602   0.602
  977   3HD2  LEU 121          2HD2      LEU 121   2.047   0.982   0.982
  978    H    THR 122           H        THR 122   2.950   1.275   1.275
  979    HA   THR 122           HA       THR 122   0.203   1.787   1.787
  980    HB   THR 122           HB       THR 122   1.404  -0.585  -0.585
  981    HG1  THR 122           HG1      THR 122   3.198   0.416   0.416
  982   1HG2  THR 122          1HG2      THR 122  -0.346   0.821   0.821
  983   2HG2  THR 122          3HG2      THR 122   0.811   2.145   2.145
  984   3HG2  THR 122          2HG2      THR 122   1.060   0.656   0.656
  985    H    MET 123           H        MET 123  -1.200  -0.233  -0.233
  986    HA   MET 123           HA       MET 123  -0.664  -2.204  -2.204
  987   1HB   MET 123          2HB       MET 123  -3.218  -0.577  -0.577
  988   2HB   MET 123          1HB       MET 123  -2.847  -1.824  -1.824
  989   1HG   MET 123          2HG       MET 123  -0.751  -0.358  -0.358
  990   2HG   MET 123          1HG       MET 123  -1.661   0.924   0.924
  991   1HE   MET 123          1HE       MET 123  -1.252  -1.571  -1.571
  992   2HE   MET 123          3HE       MET 123  -2.413  -1.224  -1.224
  993   3HE   MET 123          2HE       MET 123  -2.924  -2.106  -2.106
  994    H    THR 124           H        THR 124  -2.268  -3.998  -3.998
  995    HA   THR 124           HA       THR 124  -3.774  -4.255  -4.255
  996    HB   THR 124           HB       THR 124  -1.913  -6.467  -6.467
  997    HG1  THR 124           HG1      THR 124  -0.334  -5.347  -5.347
  998   1HG2  THR 124          2HG2      THR 124  -3.859  -6.917  -6.917
  999   2HG2  THR 124          1HG2      THR 124  -3.210  -5.740  -5.740
 1000   3HG2  THR 124          3HG2      THR 124  -2.308  -7.213  -7.213
 1001    H    ALA 125           H        ALA 125  -5.371  -5.897  -5.897
 1002    HA   ALA 125           HA       ALA 125  -5.668  -7.486  -7.486
 1003   1HB   ALA 125          1HB       ALA 125  -6.542  -5.117  -5.117
 1004   2HB   ALA 125          3HB       ALA 125  -7.857  -5.500  -5.500
 1005   3HB   ALA 125          2HB       ALA 125  -7.627  -6.463  -6.463
 1006    H    ASP 126           H        ASP 126  -5.818  -9.280  -9.280
 1007    HA   ASP 126           HA       ASP 126  -7.022 -10.931 -10.931
 1008   1HB   ASP 126          2HB       ASP 126  -9.075  -9.178  -9.178
 1009   2HB   ASP 126          1HB       ASP 126  -9.332  -9.428  -9.428
 1010    H    ASP 127           H        ASP 127  -8.227  -8.069  -8.069
 1011    HA   ASP 127           HA       ASP 127  -6.231  -8.501  -8.501
 1012   1HB   ASP 127          2HB       ASP 127  -9.188  -8.963  -8.963
 1013   2HB   ASP 127          1HB       ASP 127  -8.202  -8.424  -8.424
 1014    H    VAL 128           H        VAL 128  -7.114  -6.423  -6.423
 1015    HA   VAL 128           HA       VAL 128  -7.521  -4.191  -4.191
 1016    HB   VAL 128           HB       VAL 128  -8.658  -2.955  -2.955
 1017   1HG1  VAL 128          2HG1      VAL 128  -9.680  -5.772  -5.772
 1018   2HG1  VAL 128          1HG1      VAL 128 -10.632  -4.508  -4.508
 1019   3HG1  VAL 128          3HG1      VAL 128 -10.121  -4.320  -4.320
 1020   1HG2  VAL 128          2HG2      VAL 128  -7.608  -5.198  -5.198
 1021   2HG2  VAL 128          1HG2      VAL 128  -7.882  -3.515  -3.515
 1022   3HG2  VAL 128          3HG2      VAL 128  -9.232  -4.648  -4.648
 1023    H    VAL 129           H        VAL 129  -6.689  -2.073  -2.073
 1024    HA   VAL 129           HA       VAL 129  -4.362  -2.622  -2.622
 1025    HB   VAL 129           HB       VAL 129  -4.139  -2.021  -2.021
 1026   1HG1  VAL 129          2HG1      VAL 129  -2.442  -0.719  -0.719
 1027   2HG1  VAL 129          1HG1      VAL 129  -1.688  -1.229  -1.229
 1028   3HG1  VAL 129          3HG1      VAL 129  -3.006  -0.057  -0.057
 1029   1HG2  VAL 129          2HG2      VAL 129  -2.835  -3.740  -3.740
 1030   2HG2  VAL 129          1HG2      VAL 129  -3.426  -4.162  -4.162
 1031   3HG2  VAL 129          3HG2      VAL 129  -1.898  -3.300  -3.300
 1032    H    CYS 130           H        CYS 130  -4.476  -1.067  -1.067
 1033    HA   CYS 130           HA       CYS 130  -5.651   1.565   1.565
 1034   1HB   CYS 130          2HB       CYS 130  -6.455   0.205   0.205
 1035   2HB   CYS 130          1HB       CYS 130  -4.925   0.655   0.655
 1036    HG   CYS 130           HG       CYS 130  -6.225   2.686   2.686
 1037    H    THR 131           H        THR 131  -4.119   3.007   3.007
 1038    HA   THR 131           HA       THR 131  -1.407   2.868   2.868
 1039    HB   THR 131           HB       THR 131  -2.429   4.476   4.476
 1040    HG1  THR 131           HG1      THR 131  -1.381   2.861   2.861
 1041   1HG2  THR 131          3HG2      THR 131   0.337   3.952   3.952
 1042   2HG2  THR 131          2HG2      THR 131   0.051   4.593   4.593
 1043   3HG2  THR 131          1HG2      THR 131  -0.459   5.512   5.512
 1044    H    ARG 132           H        ARG 132  -0.436   4.751   4.751
 1045    HA   ARG 132           HA       ARG 132  -2.043   7.152   7.152
 1046   1HB   ARG 132          2HB       ARG 132  -0.914   5.483   5.483
 1047   2HB   ARG 132          1HB       ARG 132  -1.734   7.035   7.035
 1048   1HG   ARG 132          2HG       ARG 132  -3.716   5.907   5.907
 1049   2HG   ARG 132          1HG       ARG 132  -2.895   4.385   4.385
 1050   1HD   ARG 132          2HD       ARG 132  -3.675   6.458   6.458
 1051   2HD   ARG 132          1HD       ARG 132  -4.542   4.954   4.954
 1052    HE   ARG 132           HE       ARG 132  -1.679   4.709   4.709
 1053   1HH1  ARG 132          1HH2      ARG 132  -4.358   5.547   5.547
 1054   2HH1  ARG 132          2HH2      ARG 132  -4.369   4.150   4.150
 1055   1HH2  ARG 132          2HH1      ARG 132  -1.957   2.460   2.460
 1056   2HH2  ARG 132          1HH1      ARG 132  -3.010   2.403   2.403
 1057    H    VAL 133           H        VAL 133  -0.435   8.296   8.296
 1058    HA   VAL 133           HA       VAL 133   2.393   7.918   7.918
 1059    HB   VAL 133           HB       VAL 133   0.905  10.386  10.386
 1060   1HG1  VAL 133          2HG1      VAL 133   3.800   9.646   9.646
 1061   2HG1  VAL 133          1HG1      VAL 133   3.256  10.575  10.575
 1062   3HG1  VAL 133          3HG1      VAL 133   3.035  11.218  11.218
 1063   1HG2  VAL 133          1HG2      VAL 133   2.156   8.075   8.075
 1064   2HG2  VAL 133          3HG2      VAL 133   0.432   8.424   8.424
 1065   3HG2  VAL 133          2HG2      VAL 133   1.494   9.526   9.526
 1066    H    TYR 134           H        TYR 134   3.650   8.561   8.561
 1067    HA   TYR 134           HA       TYR 134   2.402  10.445  10.445
 1068   1HB   TYR 134          2HB       TYR 134   4.183   8.057   8.057
 1069   2HB   TYR 134          1HB       TYR 134   4.132   9.327   9.327
 1070    HD1  TYR 134           HD2      TYR 134   2.030   9.843   9.843
 1071    HD2  TYR 134           HD1      TYR 134   2.325   6.590   6.590
 1072    HE1  TYR 134           HE2      TYR 134  -0.049   8.869   8.869
 1073    HE2  TYR 134           HE1      TYR 134   0.264   5.575   5.575
 1074    HH   TYR 134           HH       TYR 134  -1.865   7.290   7.290
 1075    H    VAL 135           H        VAL 135   3.490  12.251  12.251
 1076    HA   VAL 135           HA       VAL 135   6.312  12.474  12.474
 1077    HB   VAL 135           HB       VAL 135   4.088  14.076  14.076
 1078   1HG1  VAL 135          1HG1      VAL 135   4.290  15.294  15.294
 1079   2HG1  VAL 135          3HG1      VAL 135   5.979  15.646  15.646
 1080   3HG1  VAL 135          2HG1      VAL 135   4.698  16.330  16.330
 1081   1HG2  VAL 135          3HG2      VAL 135   6.112  13.620  13.620
 1082   2HG2  VAL 135          2HG2      VAL 135   5.786  15.352  15.352
 1083   3HG2  VAL 135          1HG2      VAL 135   7.053  14.641  14.641
 1084    H    ARG 136           H        ARG 136   7.812  13.116  13.116
 1085    HA   ARG 136           HA       ARG 136   7.311  12.601  12.601
 1086   1HB   ARG 136          2HB       ARG 136   9.443  13.806  13.806
 1087   2HB   ARG 136          1HB       ARG 136   9.207  14.690  14.690
 1088   1HG   ARG 136          2HG       ARG 136   9.685  12.862  12.862
 1089   2HG   ARG 136          1HG       ARG 136   9.192  11.705  11.705
 1090   1HD   ARG 136          2HD       ARG 136  11.729  13.366  13.366
 1091   2HD   ARG 136          1HD       ARG 136  11.609  11.614  11.614
 1092    HE   ARG 136           HE       ARG 136  10.393  12.205  12.205
 1093   1HH1  ARG 136          1HH2      ARG 136  13.274  11.089  11.089
 1094   2HH1  ARG 136          2HH2      ARG 136  14.253  11.747  11.747
 1095   1HH2  ARG 136          1HH1      ARG 136  13.376  13.258  13.258
 1096   2HH2  ARG 136          2HH1      ARG 136  11.726  13.755  13.755
 1097    H    GLU 137           HN       GLU 137   6.176  13.475  13.475
 1098    HA   GLU 137           HA       GLU 137   4.639  14.907  14.907
 1099   1HB   GLU 137          2HB       GLU 137   7.061  15.603  15.603
 1100   2HB   GLU 137          1HB       GLU 137   6.724  17.006  17.006
 1101   1HG   GLU 137          2HG       GLU 137   4.554  17.225  17.225
 1102   2HG   GLU 137          1HG       GLU 137   5.379  16.166  16.166

  Start of MODEL   21
    1   1H    PRO   1          1H        PRO   1 -18.091   4.739   4.739
    2   2H    PRO   1          2H        PRO   1 -17.323   4.348   4.348
    3    HA   PRO   1           HA       PRO   1 -15.702   3.298   3.298
    4   1HB   PRO   1          2HB       PRO   1 -17.115   1.515   1.515
    5   2HB   PRO   1          1HB       PRO   1 -16.327   1.138   1.138
    6   1HG   PRO   1          2HG       PRO   1 -19.132   1.285   1.285
    7   2HG   PRO   1          1HG       PRO   1 -18.338   0.917   0.917
    8   1HD   PRO   1          1HD       PRO   1 -19.723   3.318   3.318
    9   2HD   PRO   1          2HD       PRO   1 -18.944   2.936   2.936
   10    H    ASN   2           H        ASN   2 -15.070   5.158   5.158
   11    HA   ASN   2           HA       ASN   2 -15.617   4.820   4.820
   12   1HB   ASN   2          2HB       ASN   2 -16.043   7.372   7.372
   13   2HB   ASN   2          1HB       ASN   2 -15.874   7.328   7.328
   14   1HD2  ASN   2          2HD2      ASN   2 -19.516   6.918   6.918
   15   2HD2  ASN   2          1HD2      ASN   2 -18.306   7.965   7.965
   16    H    PHE   3           H        PHE   3 -13.679   4.595   4.595
   17    HA   PHE   3           HA       PHE   3 -11.365   6.147   6.147
   18   1HB   PHE   3          2HB       PHE   3 -11.494   3.582   3.582
   19   2HB   PHE   3          1HB       PHE   3 -10.014   4.397   4.397
   20    HD1  PHE   3           HD1      PHE   3 -13.180   3.276   3.276
   21    HD2  PHE   3           HD2      PHE   3  -8.886   3.446   3.446
   22    HE1  PHE   3           HE1      PHE   3 -13.167   2.047   2.047
   23    HE2  PHE   3           HE2      PHE   3  -8.880   2.202   2.202
   24    HZ   PHE   3           HZ       PHE   3 -11.020   1.497   1.497
   25    H    SER   4           H        SER   4 -13.632   6.213   6.213
   26    HA   SER   4           HA       SER   4 -11.976   6.579   6.579
   27   1HB   SER   4          2HB       SER   4 -13.999   7.208   7.208
   28   2HB   SER   4          1HB       SER   4 -14.412   5.921   5.921
   29    HG   SER   4           HG       SER   4 -15.585   8.178   8.178
   30    H    GLY   5           H        GLY   5 -10.686   8.257   8.257
   31   1HA   GLY   5          2HA       GLY   5 -11.358  10.896  10.896
   32   2HA   GLY   5          1HA       GLY   5 -10.966  10.808  10.808
   33    H    ASN   6           H        ASN   6  -9.201  12.340  12.340
   34    HA   ASN   6           HA       ASN   6  -6.921  10.818  10.818
   35   1HB   ASN   6          2HB       ASN   6  -7.580  13.743  13.743
   36   2HB   ASN   6          1HB       ASN   6  -5.894  13.248  13.248
   37   1HD2  ASN   6          2HD2      ASN   6  -6.618  11.772  11.772
   38   2HD2  ASN   6          1HD2      ASN   6  -5.939  11.241  11.241
   39    H    TRP   7           H        TRP   7  -4.754  11.345  11.345
   40    HA   TRP   7           HA       TRP   7  -5.221  11.803  11.803
   41   1HB   TRP   7          2HB       TRP   7  -4.162   9.208   9.208
   42   2HB   TRP   7          1HB       TRP   7  -4.101   9.647   9.647
   43    HD1  TRP   7           HD1      TRP   7  -6.397   8.294   8.294
   44    HE1  TRP   7           HE1      TRP   7  -8.772   7.973   7.973
   45    HE3  TRP   7           HE3      TRP   7  -5.813  10.772  10.772
   46    HZ2  TRP   7           HZ2      TRP   7 -10.219   8.719   8.719
   47    HZ3  TRP   7           HZ3      TRP   7  -7.694  11.000  11.000
   48    HH2  TRP   7           HH2      TRP   7  -9.876   9.972   9.972
   49    H    LYS   8           H        LYS   8  -3.701  13.145  13.145
   50    HA   LYS   8           HA       LYS   8  -0.973  12.929  12.929
   51   1HB   LYS   8          2HB       LYS   8  -2.479  15.273  15.273
   52   2HB   LYS   8          1HB       LYS   8  -0.727  15.299  15.299
   53   1HG   LYS   8          2HG       LYS   8  -1.437  14.444  14.444
   54   2HG   LYS   8          1HG       LYS   8  -2.879  15.377  15.377
   55   1HD   LYS   8          2HD       LYS   8  -0.208  16.607  16.607
   56   2HD   LYS   8          1HD       LYS   8  -0.767  16.541  16.541
   57   1HE   LYS   8          2HE       LYS   8  -3.020  17.450  17.450
   58   2HE   LYS   8          1HE       LYS   8  -1.900  18.048  18.048
   59   1HZ   LYS   8          3HZ       LYS   8  -1.687  18.550  18.550
   60   2HZ   LYS   8          2HZ       LYS   8  -2.248  19.665  19.665
   61   3HZ   LYS   8          1HZ       LYS   8  -0.632  19.142  19.142
   62    H    ILE   9           H        ILE   9   0.306  11.834  11.834
   63    HA   ILE   9           HA       ILE   9  -0.251  11.127  11.127
   64    HB   ILE   9           HB       ILE   9   1.388   9.969   9.969
   65   1HG1  ILE   9          2HG1      ILE   9   2.748  11.264  11.264
   66   2HG1  ILE   9          1HG1      ILE   9   1.658   9.881   9.881
   67   1HG2  ILE   9          3HG2      ILE   9   2.563  12.687  12.687
   68   2HG2  ILE   9          2HG2      ILE   9   3.719  11.363  11.363
   69   3HG2  ILE   9          1HG2      ILE   9   2.561  11.395  11.395
   70   1HD1  ILE   9          2HD1      ILE   9   3.875   9.595   9.595
   71   2HD1  ILE   9          1HD1      ILE   9   4.368   9.664   9.664
   72   3HD1  ILE   9          3HD1      ILE   9   3.231   8.428   8.428
   73    H    ILE  10           H        ILE  10   0.767  11.778  11.778
   74    HA   ILE  10           HA       ILE  10   1.725  14.602  14.602
   75    HB   ILE  10           HB       ILE  10   0.452  14.940  14.940
   76   1HG1  ILE  10          2HG1      ILE  10  -1.491  13.012  13.012
   77   2HG1  ILE  10          1HG1      ILE  10  -0.092  12.056  12.056
   78   1HG2  ILE  10          1HG2      ILE  10  -0.468  15.266  15.266
   79   2HG2  ILE  10          3HG2      ILE  10  -1.537  13.933  13.933
   80   3HG2  ILE  10          2HG2      ILE  10  -1.558  15.425  15.425
   81   1HD1  ILE  10          2HD1      ILE  10   1.021  13.557  13.557
   82   2HD1  ILE  10          1HD1      ILE  10  -0.635  13.439  13.439
   83   3HD1  ILE  10          3HD1      ILE  10   0.296  11.974  11.974
   84    H    ARG  11           H        ARG  11   1.767  11.372  11.372
   85    HA   ARG  11           HA       ARG  11   4.431  11.988  11.988
   86   1HB   ARG  11          2HB       ARG  11   2.393  12.253  12.253
   87   2HB   ARG  11          1HB       ARG  11   2.514  10.496  10.496
   88   1HG   ARG  11          2HG       ARG  11   4.332  10.610  10.610
   89   2HG   ARG  11          1HG       ARG  11   5.162  11.650  11.650
   90   1HD   ARG  11          2HD       ARG  11   4.849  12.700  12.700
   91   2HD   ARG  11          1HD       ARG  11   4.133  13.629  13.629
   92    HE   ARG  11           HE       ARG  11   2.254  11.772  11.772
   93   1HH1  ARG  11          1HH2      ARG  11   2.455  14.847  14.847
   94   2HH1  ARG  11          2HH2      ARG  11   1.730  15.605  15.605
   95   1HH2  ARG  11          2HH1      ARG  11   1.868  12.754  12.754
   96   2HH2  ARG  11          1HH1      ARG  11   1.397  14.420  14.420
   97    H    SER  12           H        SER  12   5.416   9.832   9.832
   98    HA   SER  12           HA       SER  12   4.383   7.298   7.298
   99   1HB   SER  12          2HB       SER  12   4.462   7.941   7.941
  100   2HB   SER  12          1HB       SER  12   6.060   8.656   8.656
  101    HG   SER  12           HG       SER  12   5.298   6.018   6.018
  102    H    GLU  13           H        GLU  13   5.764   5.704   5.704
  103    HA   GLU  13           HA       GLU  13   8.571   6.483   6.483
  104   1HB   GLU  13          2HB       GLU  13   8.280   5.237   5.237
  105   2HB   GLU  13          1HB       GLU  13   7.440   6.783   6.783
  106   1HG   GLU  13          2HG       GLU  13   5.884   4.452   4.452
  107   2HG   GLU  13          1HG       GLU  13   6.244   4.452   4.452
  108    H    ASN  14           H        ASN  14   9.708   4.329   4.329
  109    HA   ASN  14           HA       ASN  14  10.513   2.200   2.200
  110   1HB   ASN  14          2HB       ASN  14   7.650   1.702   1.702
  111   2HB   ASN  14          1HB       ASN  14   8.860   0.485   0.485
  112   1HD2  ASN  14          2HD2      ASN  14   6.627   1.715   1.715
  113   2HD2  ASN  14          1HD2      ASN  14   6.196   1.726   1.726
  114    H    PHE  15           H        PHE  15  10.301   4.402   4.402
  115    HA   PHE  15           HA       PHE  15   9.621   3.192   3.192
  116   1HB   PHE  15          2HB       PHE  15  10.040   5.707   5.707
  117   2HB   PHE  15          1HB       PHE  15  11.747   5.317   5.317
  118    HD1  PHE  15           HD2      PHE  15  12.226   3.790   3.790
  119    HD2  PHE  15           HD1      PHE  15   8.840   6.377   6.377
  120    HE1  PHE  15           HE2      PHE  15  11.860   3.841   3.841
  121    HE2  PHE  15           HE1      PHE  15   8.492   6.413   6.413
  122    HZ   PHE  15           HZ       PHE  15   9.997   5.137   5.137
  123    H    GLU  16           H        GLU  16  12.864   3.948   3.948
  124    HA   GLU  16           HA       GLU  16  14.304   2.366   2.366
  125   1HB   GLU  16          2HB       GLU  16  16.137   2.434   2.434
  126   2HB   GLU  16          1HB       GLU  16  15.433   4.020   4.020
  127   1HG   GLU  16          2HG       GLU  16  14.125   3.926   3.926
  128   2HG   GLU  16          1HG       GLU  16  14.543   2.232   2.232
  129    H    GLU  17           H        GLU  17  12.624   1.500   1.500
  130    HA   GLU  17           HA       GLU  17  13.839  -1.039  -1.039
  131   1HB   GLU  17          2HB       GLU  17  11.071  -0.020  -0.020
  132   2HB   GLU  17          1HB       GLU  17  11.786  -1.487  -1.487
  133   1HG   GLU  17          2HG       GLU  17  13.788   0.184   0.184
  134   2HG   GLU  17          1HG       GLU  17  12.475   1.361   1.361
  135    H    LEU  18           H        LEU  18  11.061  -0.038  -0.038
  136    HA   LEU  18           HA       LEU  18  10.456  -2.766  -2.766
  137   1HB   LEU  18          2HB       LEU  18   8.678  -1.027  -1.027
  138   2HB   LEU  18          1HB       LEU  18   9.410  -0.124  -0.124
  139    HG   LEU  18           HG       LEU  18   9.079  -2.117  -2.117
  140   1HD1  LEU  18          2HD1      LEU  18   8.050  -3.194  -3.194
  141   2HD1  LEU  18          1HD1      LEU  18   7.186  -3.657  -3.657
  142   3HD1  LEU  18          3HD1      LEU  18   8.904  -4.022  -4.022
  143   1HD2  LEU  18          1HD2      LEU  18   7.339  -0.167  -0.167
  144   2HD2  LEU  18          3HD2      LEU  18   6.915  -1.502  -1.502
  145   3HD2  LEU  18          2HD2      LEU  18   6.392  -1.522  -1.522
  146    H    LEU  19           H        LEU  19  12.647  -0.321  -0.321
  147    HA   LEU  19           HA       LEU  19  12.739  -1.308  -1.308
  148   1HB   LEU  19          2HB       LEU  19  14.183   0.894   0.894
  149   2HB   LEU  19          1HB       LEU  19  14.617   0.436   0.436
  150    HG   LEU  19           HG       LEU  19  12.783   2.363   2.363
  151   1HD1  LEU  19          2HD1      LEU  19  13.869   1.940   1.940
  152   2HD1  LEU  19          1HD1      LEU  19  12.738   0.621   0.621
  153   3HD1  LEU  19          3HD1      LEU  19  12.147   2.277   2.277
  154   1HD2  LEU  19          3HD2      LEU  19  11.165  -0.117  -0.117
  155   2HD2  LEU  19          2HD2      LEU  19  11.074   0.786   0.786
  156   3HD2  LEU  19          1HD2      LEU  19  10.542   1.532   1.532
  157    H    LYS  20           H        LYS  20  14.292  -1.810  -1.810
  158    HA   LYS  20           HA       LYS  20  16.721  -3.007  -3.007
  159   1HB   LYS  20          2HB       LYS  20  15.744  -3.339  -3.339
  160   2HB   LYS  20          1HB       LYS  20  17.392  -3.495  -3.495
  161   1HG   LYS  20          2HG       LYS  20  16.447  -0.881  -0.881
  162   2HG   LYS  20          1HG       LYS  20  16.084  -1.166  -1.166
  163   1HD   LYS  20          2HD       LYS  20  18.806  -1.525  -1.525
  164   2HD   LYS  20          1HD       LYS  20  18.322  -0.171  -0.171
  165   1HE   LYS  20          2HE       LYS  20  17.812  -1.854  -1.854
  166   2HE   LYS  20          1HE       LYS  20  18.577  -3.078  -3.078
  167   1HZ   LYS  20          2HZ       LYS  20  19.935  -0.552  -0.552
  168   2HZ   LYS  20          1HZ       LYS  20  20.039  -1.949  -1.949
  169   3HZ   LYS  20          3HZ       LYS  20  20.625  -1.971  -1.971
  170    H    VAL  21           H        VAL  21  13.557  -3.952  -3.952
  171    HA   VAL  21           HA       VAL  21  14.134  -6.809  -6.809
  172    HB   VAL  21           HB       VAL  21  12.373  -5.732  -5.732
  173   1HG1  VAL  21          3HG1      VAL  21  11.600  -4.112  -4.112
  174   2HG1  VAL  21          2HG1      VAL  21  10.826  -5.436  -5.436
  175   3HG1  VAL  21          1HG1      VAL  21  10.288  -4.998  -4.998
  176   1HG2  VAL  21          2HG2      VAL  21  11.592  -7.853  -7.853
  177   2HG2  VAL  21          1HG2      VAL  21  12.151  -8.083  -8.083
  178   3HG2  VAL  21          3HG2      VAL  21  10.549  -7.412  -7.412
  179    H    LEU  22           H        LEU  22  12.548  -4.514  -4.514
  180    HA   LEU  22           HA       LEU  22  11.686  -6.346  -6.346
  181   1HB   LEU  22          2HB       LEU  22  12.019  -3.425  -3.425
  182   2HB   LEU  22          1HB       LEU  22  12.136  -3.952  -3.952
  183    HG   LEU  22           HG       LEU  22   9.931  -4.935  -4.935
  184   1HD1  LEU  22          2HD1      LEU  22  10.125  -5.742  -5.742
  185   2HD1  LEU  22          1HD1      LEU  22   9.791  -4.094  -4.094
  186   3HD1  LEU  22          3HD1      LEU  22   8.579  -4.992  -4.992
  187   1HD2  LEU  22          3HD2      LEU  22  10.053  -2.208  -2.208
  188   2HD2  LEU  22          2HD2      LEU  22  10.017  -2.534  -2.534
  189   3HD2  LEU  22          1HD2      LEU  22   8.604  -2.890  -2.890
  190    H    GLY  23           H        GLY  23  14.364  -4.070  -4.070
  191   1HA   GLY  23          2HA       GLY  23  15.811  -5.587  -5.587
  192   2HA   GLY  23          1HA       GLY  23  16.122  -3.907  -3.907
  193    H    VAL  24           H        VAL  24  18.299  -4.165  -4.165
  194    HA   VAL  24           HA       VAL  24  18.968  -5.290  -5.290
  195    HB   VAL  24           HB       VAL  24  20.867  -6.654  -6.654
  196   1HG1  VAL  24          3HG1      VAL  24  18.576  -7.572  -7.572
  197   2HG1  VAL  24          2HG1      VAL  24  18.186  -7.576  -7.576
  198   3HG1  VAL  24          1HG1      VAL  24  19.513  -8.568  -8.568
  199   1HG2  VAL  24          1HG2      VAL  24  19.412  -5.996  -5.996
  200   2HG2  VAL  24          3HG2      VAL  24  21.101  -5.670  -5.670
  201   3HG2  VAL  24          2HG2      VAL  24  20.557  -7.330  -7.330
  202    H    ASN  25           H        ASN  25  20.113  -3.702  -3.702
  203    HA   ASN  25           HA       ASN  25  22.616  -2.769  -2.769
  204   1HB   ASN  25          2HB       ASN  25  21.172  -2.502  -2.502
  205   2HB   ASN  25          1HB       ASN  25  20.967  -0.897  -0.897
  206   1HD2  ASN  25          2HD2      ASN  25  24.252   0.103   0.103
  207   2HD2  ASN  25          1HD2      ASN  25  22.731   0.537   0.537
  208    H    VAL  26           H        VAL  26  22.822  -0.123  -0.123
  209    HA   VAL  26           HA       VAL  26  21.091   0.647   0.647
  210    HB   VAL  26           HB       VAL  26  23.750   1.934   1.934
  211   1HG1  VAL  26          2HG1      VAL  26  22.150   2.656   2.656
  212   2HG1  VAL  26          1HG1      VAL  26  22.251   1.044   1.044
  213   3HG1  VAL  26          3HG1      VAL  26  23.679   2.079   2.079
  214   1HG2  VAL  26          1HG2      VAL  26  23.303  -0.912  -0.912
  215   2HG2  VAL  26          3HG2      VAL  26  24.624  -0.221  -0.221
  216   3HG2  VAL  26          2HG2      VAL  26  24.567   0.019   0.019
  217    H    MET  27           H        MET  27  22.885   1.908   1.908
  218    HA   MET  27           HA       MET  27  21.810   4.574   4.574
  219   1HB   MET  27          2HB       MET  27  23.824   3.697   3.697
  220   2HB   MET  27          1HB       MET  27  22.616   3.220   3.220
  221   1HG   MET  27          2HG       MET  27  21.844   5.488   5.488
  222   2HG   MET  27          1HG       MET  27  22.814   6.021   6.021
  223   1HE   MET  27          1HE       MET  27  22.405   4.776   4.776
  224   2HE   MET  27          3HE       MET  27  23.739   5.409   5.409
  225   3HE   MET  27          2HE       MET  27  23.889   3.843   3.843
  226    H    LEU  28           H        LEU  28  20.572   1.556   1.556
  227    HA   LEU  28           HA       LEU  28  18.586   2.509   2.509
  228   1HB   LEU  28          2HB       LEU  28  19.242   0.029   0.029
  229   2HB   LEU  28          1HB       LEU  28  17.537   0.207   0.207
  230    HG   LEU  28           HG       LEU  28  18.733  -0.973  -0.973
  231   1HD1  LEU  28          1HD1      LEU  28  16.941   1.033   1.033
  232   2HD1  LEU  28          3HD1      LEU  28  18.285   1.665   1.665
  233   3HD1  LEU  28          2HD1      LEU  28  17.593   0.091   0.091
  234   1HD2  LEU  28          3HD2      LEU  28  20.925   0.275   0.275
  235   2HD2  LEU  28          2HD2      LEU  28  20.574  -0.030  -0.030
  236   3HD2  LEU  28          1HD2      LEU  28  20.292   1.570   1.570
  237    H    ARG  29           H        ARG  29  18.497   1.937   1.937
  238    HA   ARG  29           HA       ARG  29  15.675   2.469   2.469
  239   1HB   ARG  29          2HB       ARG  29  17.795   2.812   2.812
  240   2HB   ARG  29          1HB       ARG  29  16.075   2.520   2.520
  241   1HG   ARG  29          2HG       ARG  29  16.265   0.276   0.276
  242   2HG   ARG  29          1HG       ARG  29  17.489   0.494   0.494
  243   1HD   ARG  29          2HD       ARG  29  18.291  -0.625  -0.625
  244   2HD   ARG  29          1HD       ARG  29  19.221   0.774   0.774
  245    HE   ARG  29           HE       ARG  29  17.133   0.984   0.984
  246   1HH1  ARG  29          2HH1      ARG  29  17.759   3.540   3.540
  247   2HH1  ARG  29          1HH1      ARG  29  19.335   3.755   3.755
  248   1HH2  ARG  29          1HH2      ARG  29  20.243   0.430   0.430
  249   2HH2  ARG  29          2HH2      ARG  29  20.742   1.995   1.995
  250    H    LYS  30           H        LYS  30  18.571   4.466   4.466
  251    HA   LYS  30           HA       LYS  30  17.267   6.788   6.788
  252   1HB   LYS  30          2HB       LYS  30  19.852   6.133   6.133
  253   2HB   LYS  30          1HB       LYS  30  19.621   7.180   7.180
  254   1HG   LYS  30          2HG       LYS  30  20.356   8.548   8.548
  255   2HG   LYS  30          1HG       LYS  30  18.665   8.922   8.922
  256   1HD   LYS  30          2HD       LYS  30  17.898   7.736   7.736
  257   2HD   LYS  30          1HD       LYS  30  19.393   6.811   6.811
  258   1HE   LYS  30          2HE       LYS  30  19.556   8.406   8.406
  259   2HE   LYS  30          1HE       LYS  30  20.529   9.097   9.097
  260   1HZ   LYS  30          1HZ       LYS  30  17.660   9.734   9.734
  261   2HZ   LYS  30          3HZ       LYS  30  18.805  10.574  10.574
  262   3HZ   LYS  30          2HZ       LYS  30  18.891  10.616  10.616
  263    H    ILE  31           H        ILE  31  18.099   5.939   5.939
  264    HA   ILE  31           HA       ILE  31  17.002   8.349   8.349
  265    HB   ILE  31           HB       ILE  31  17.375   5.604   5.604
  266   1HG1  ILE  31          2HG1      ILE  31  19.205   7.982   7.982
  267   2HG1  ILE  31          1HG1      ILE  31  19.384   6.885   6.885
  268   1HG2  ILE  31          2HG2      ILE  31  16.680   8.319   8.319
  269   2HG2  ILE  31          1HG2      ILE  31  17.642   7.216   7.216
  270   3HG2  ILE  31          3HG2      ILE  31  16.031   6.741   6.741
  271   1HD1  ILE  31          2HD1      ILE  31  19.214   5.818   5.818
  272   2HD1  ILE  31          1HD1      ILE  31  20.749   6.382   6.382
  273   3HD1  ILE  31          3HD1      ILE  31  19.895   5.047   5.047
  274    H    ALA  32           H        ALA  32  15.583   5.342   5.342
  275    HA   ALA  32           HA       ALA  32  13.075   5.726   5.726
  276   1HB   ALA  32          2HB       ALA  32  14.024   3.477   3.477
  277   2HB   ALA  32          1HB       ALA  32  13.645   3.867   3.867
  278   3HB   ALA  32          3HB       ALA  32  12.348   3.725   3.725
  279    H    VAL  33           H        VAL  33  14.394   6.718   6.718
  280    HA   VAL  33           HA       VAL  33  11.776   7.224   7.224
  281    HB   VAL  33           HB       VAL  33  14.423   8.378   8.378
  282   1HG1  VAL  33          2HG1      VAL  33  11.786   7.644   7.644
  283   2HG1  VAL  33          1HG1      VAL  33  13.240   7.882   7.882
  284   3HG1  VAL  33          3HG1      VAL  33  12.605   9.206   9.206
  285   1HG2  VAL  33          2HG2      VAL  33  13.706   5.553   5.553
  286   2HG2  VAL  33          1HG2      VAL  33  15.243   6.279   6.279
  287   3HG2  VAL  33          3HG2      VAL  33  13.992   6.012   6.012
  288    H    ALA  34           H        ALA  34  14.432   9.063   9.063
  289    HA   ALA  34           HA       ALA  34  13.250  11.659  11.659
  290   1HB   ALA  34          1HB       ALA  34  15.706  10.846  10.846
  291   2HB   ALA  34          3HB       ALA  34  15.039  11.018  11.018
  292   3HB   ALA  34          2HB       ALA  34  15.078  12.405  12.405
  293    H    ALA  35           H        ALA  35  13.196   9.157   9.157
  294    HA   ALA  35           HA       ALA  35  11.741  10.568  10.568
  295   1HB   ALA  35          3HB       ALA  35  11.969   7.624   7.624
  296   2HB   ALA  35          2HB       ALA  35  11.109   8.204   8.204
  297   3HB   ALA  35          1HB       ALA  35  12.841   8.492   8.492
  298    H    ALA  36           H        ALA  36  10.659   8.275   8.275
  299    HA   ALA  36           HA       ALA  36   7.839   8.936   8.936
  300   1HB   ALA  36          3HB       ALA  36   9.378   7.081   7.081
  301   2HB   ALA  36          2HB       ALA  36   7.647   7.340   7.340
  302   3HB   ALA  36          1HB       ALA  36   8.266   6.655   6.655
  303    H    SER  37           H        SER  37   9.489  11.210  11.210
  304    HA   SER  37           HA       SER  37   9.272  11.593  11.593
  305   1HB   SER  37          2HB       SER  37  10.649  12.936  12.936
  306   2HB   SER  37          1HB       SER  37   9.166  13.863  13.863
  307    HG   SER  37           HG       SER  37   9.298  14.540  14.540
  308    H    LYS  38           H        LYS  38   7.139  12.172  12.172
  309    HA   LYS  38           HA       LYS  38   4.835  12.345  12.345
  310   1HB   LYS  38          2HB       LYS  38   5.822  14.715  14.715
  311   2HB   LYS  38          1HB       LYS  38   4.114  14.538  14.538
  312   1HG   LYS  38          2HG       LYS  38   5.196  14.051  14.051
  313   2HG   LYS  38          1HG       LYS  38   6.426  15.131  15.131
  314   1HD   LYS  38          2HD       LYS  38   5.023  16.755  16.755
  315   2HD   LYS  38          1HD       LYS  38   4.188  16.472  16.472
  316   1HE   LYS  38          2HE       LYS  38   2.421  15.439  15.439
  317   2HE   LYS  38          1HE       LYS  38   3.442  14.635  14.635
  318   1HZ   LYS  38          2HZ       LYS  38   2.742  17.521  17.521
  319   2HZ   LYS  38          1HZ       LYS  38   1.987  16.328  16.328
  320   3HZ   LYS  38          3HZ       LYS  38   3.629  16.682  16.682
  321    HA   PRO  39           HA       PRO  39   4.243  10.494  10.494
  322   1HB   PRO  39          2HB       PRO  39   3.423   8.020   8.020
  323   2HB   PRO  39          1HB       PRO  39   5.099   8.437   8.437
  324   1HG   PRO  39          2HG       PRO  39   3.812   8.086   8.086
  325   2HG   PRO  39          1HG       PRO  39   5.512   7.892   7.892
  326   1HD   PRO  39          2HD       PRO  39   4.416  10.119  10.119
  327   2HD   PRO  39          1HD       PRO  39   6.010  10.048  10.048
  328    H    ALA  40           H        ALA  40   2.233  10.628  10.628
  329    HA   ALA  40           HA       ALA  40  -0.074  11.265  11.265
  330   1HB   ALA  40          2HB       ALA  40   0.490  12.529  12.529
  331   2HB   ALA  40          1HB       ALA  40   0.037  11.084  11.084
  332   3HB   ALA  40          3HB       ALA  40  -1.166  11.927  11.927
  333    H    VAL  41           H        VAL  41  -2.216  10.210  10.210
  334    HA   VAL  41           HA       VAL  41  -2.065   7.487   7.487
  335    HB   VAL  41           HB       VAL  41  -2.464   8.115   8.115
  336   1HG1  VAL  41          2HG1      VAL  41  -3.380   5.602   5.602
  337   2HG1  VAL  41          1HG1      VAL  41  -3.308   5.798   5.798
  338   3HG1  VAL  41          3HG1      VAL  41  -4.427   6.775   6.775
  339   1HG2  VAL  41          3HG2      VAL  41  -0.828   6.149   6.149
  340   2HG2  VAL  41          2HG2      VAL  41  -0.240   7.479   7.479
  341   3HG2  VAL  41          1HG2      VAL  41  -0.979   6.068   6.068
  342    H    GLU  42           H        GLU  42  -3.918   7.161   7.161
  343    HA   GLU  42           HA       GLU  42  -6.325   8.769   8.769
  344   1HB   GLU  42          2HB       GLU  42  -5.394   9.459   9.459
  345   2HB   GLU  42          1HB       GLU  42  -5.508   7.799   7.799
  346   1HG   GLU  42          2HG       GLU  42  -7.914   7.841   7.841
  347   2HG   GLU  42          1HG       GLU  42  -7.895   9.379   9.379
  348    H    ILE  43           H        ILE  43  -7.690   7.399   7.399
  349    HA   ILE  43           HA       ILE  43  -7.752   4.553   4.553
  350    HB   ILE  43           HB       ILE  43  -8.806   6.042   6.042
  351   1HG1  ILE  43          2HG1      ILE  43  -7.012   3.746   3.746
  352   2HG1  ILE  43          1HG1      ILE  43  -6.285   5.017   5.017
  353   1HG2  ILE  43          2HG2      ILE  43  -9.339   3.251   3.251
  354   2HG2  ILE  43          1HG2      ILE  43  -9.144   3.534   3.534
  355   3HG2  ILE  43          3HG2      ILE  43 -10.413   4.373   4.373
  356   1HD1  ILE  43          3HD1      ILE  43  -7.675   6.176   6.176
  357   2HD1  ILE  43          2HD1      ILE  43  -6.521   4.962   4.962
  358   3HD1  ILE  43          1HD1      ILE  43  -5.975   6.310   6.310
  359    H    LYS  44           H        LYS  44  -9.432   3.700   3.700
  360    HA   LYS  44           HA       LYS  44 -11.832   5.409   5.409
  361   1HB   LYS  44          2HB       LYS  44 -11.368   2.919   2.919
  362   2HB   LYS  44          1HB       LYS  44 -12.030   4.465   4.465
  363   1HG   LYS  44          2HG       LYS  44  -9.745   5.447   5.447
  364   2HG   LYS  44          1HG       LYS  44  -9.091   3.897   3.897
  365   1HD   LYS  44          2HD       LYS  44  -9.321   2.967   2.967
  366   2HD   LYS  44          1HD       LYS  44 -10.811   3.845   3.845
  367   1HE   LYS  44          2HE       LYS  44  -8.365   5.508   5.508
  368   2HE   LYS  44          1HE       LYS  44  -8.438   4.441   4.441
  369   1HZ   LYS  44          3HZ       LYS  44 -10.737   5.351   5.351
  370   2HZ   LYS  44          2HZ       LYS  44 -10.372   6.538   6.538
  371   3HZ   LYS  44          1HZ       LYS  44  -9.466   6.440   6.440
  372    H    GLN  45           H        GLN  45 -13.014   4.821   4.821
  373    HA   GLN  45           HA       GLN  45 -13.344   1.932   1.932
  374   1HB   GLN  45          2HB       GLN  45 -13.034   2.813   2.813
  375   2HB   GLN  45          1HB       GLN  45 -13.441   4.434   4.434
  376   1HG   GLN  45          2HG       GLN  45 -15.073   3.865   3.865
  377   2HG   GLN  45          1HG       GLN  45 -15.908   3.681   3.681
  378   1HE2  GLN  45          2HE2      GLN  45 -15.960   0.600   0.600
  379   2HE2  GLN  45          1HE2      GLN  45 -15.872   2.234   2.234
  380    H    GLU  46           H        GLU  46 -15.050   0.843   0.843
  381    HA   GLU  46           HA       GLU  46 -17.615   2.308   2.308
  382   1HB   GLU  46          2HB       GLU  46 -16.187   0.446   0.446
  383   2HB   GLU  46          1HB       GLU  46 -17.937   0.657   0.657
  384   1HG   GLU  46          2HG       GLU  46 -17.328   2.355   2.355
  385   2HG   GLU  46          1HG       GLU  46 -17.226   3.242   3.242
  386    H    GLY  47           H        GLY  47 -17.706   1.261   1.261
  387   1HA   GLY  47          2HA       GLY  47 -19.109  -0.276  -0.276
  388   2HA   GLY  47          1HA       GLY  47 -19.154  -1.306  -1.306
  389    H    ASP  48           H        ASP  48 -18.257  -3.241  -3.241
  390    HA   ASP  48           HA       ASP  48 -16.143  -3.441  -3.441
  391   1HB   ASP  48          2HB       ASP  48 -16.045  -5.859  -5.859
  392   2HB   ASP  48          1HB       ASP  48 -17.552  -5.350  -5.350
  393    H    THR  49           H        THR  49 -16.015  -2.428  -2.428
  394    HA   THR  49           HA       THR  49 -13.458  -3.784  -3.784
  395    HB   THR  49           HB       THR  49 -15.302  -1.995  -1.995
  396    HG1  THR  49           HG1      THR  49 -15.575  -3.882  -3.882
  397   1HG2  THR  49          2HG2      THR  49 -12.468  -2.653  -2.653
  398   2HG2  THR  49          1HG2      THR  49 -13.512  -3.027  -3.027
  399   3HG2  THR  49          3HG2      THR  49 -13.456  -1.386  -1.386
  400    H    PHE  50           H        PHE  50 -11.518  -2.697  -2.697
  401    HA   PHE  50           HA       PHE  50 -11.566   0.231   0.231
  402   1HB   PHE  50          2HB       PHE  50  -9.957  -1.802  -1.802
  403   2HB   PHE  50          1HB       PHE  50  -9.770  -0.050  -0.050
  404    HD1  PHE  50           HD2      PHE  50 -11.603   1.354   1.354
  405    HD2  PHE  50           HD1      PHE  50 -11.887  -2.926  -2.926
  406    HE1  PHE  50           HE2      PHE  50 -13.532   1.422   1.422
  407    HE2  PHE  50           HE1      PHE  50 -13.830  -2.854  -2.854
  408    HZ   PHE  50           HZ       PHE  50 -14.663  -0.683  -0.683
  409    H    TYR  51           H        TYR  51 -10.392   1.120   1.120
  410    HA   TYR  51           HA       TYR  51  -8.198  -0.406  -0.406
  411   1HB   TYR  51          2HB       TYR  51 -10.116   0.479   0.479
  412   2HB   TYR  51          1HB       TYR  51  -9.628   2.103   2.103
  413    HD1  TYR  51           HD1      TYR  51  -7.165   2.743   2.743
  414    HD2  TYR  51           HD2      TYR  51  -9.156  -0.549  -0.549
  415    HE1  TYR  51           HE1      TYR  51  -5.520   2.814   2.814
  416    HE2  TYR  51           HE2      TYR  51  -7.493  -0.483  -0.483
  417    HH   TYR  51           HH       TYR  51  -5.704   1.933   1.933
  418    H    ILE  52           H        ILE  52  -6.105   0.705   0.705
  419    HA   ILE  52           HA       ILE  52  -5.838   3.234   3.234
  420    HB   ILE  52           HB       ILE  52  -3.871   1.147   1.147
  421   1HG1  ILE  52          2HG1      ILE  52  -6.763   1.071   1.071
  422   2HG1  ILE  52          1HG1      ILE  52  -5.909  -0.205  -0.205
  423   1HG2  ILE  52          2HG2      ILE  52  -4.483   3.692   3.692
  424   2HG2  ILE  52          1HG2      ILE  52  -5.344   2.731   2.731
  425   3HG2  ILE  52          3HG2      ILE  52  -3.607   2.521   2.521
  426   1HD1  ILE  52          2HD1      ILE  52  -4.289   0.251   0.251
  427   2HD1  ILE  52          1HD1      ILE  52  -5.917   0.438   0.438
  428   3HD1  ILE  52          3HD1      ILE  52  -5.460  -1.059  -1.059
  429    H    LYS  53           H        LYS  53  -4.843   4.436   4.436
  430    HA   LYS  53           HA       LYS  53  -2.507   3.236   3.236
  431   1HB   LYS  53          2HB       LYS  53  -4.230   4.229   4.229
  432   2HB   LYS  53          1HB       LYS  53  -4.119   5.752   5.752
  433   1HG   LYS  53          2HG       LYS  53  -1.967   6.215   6.215
  434   2HG   LYS  53          1HG       LYS  53  -1.680   4.535   4.535
  435   1HD   LYS  53          2HD       LYS  53  -2.137   5.629   5.629
  436   2HD   LYS  53          1HD       LYS  53  -3.648   4.820   4.820
  437   1HE   LYS  53          2HE       LYS  53  -4.507   6.917   6.917
  438   2HE   LYS  53          1HE       LYS  53  -2.998   7.729   7.729
  439   1HZ   LYS  53          2HZ       LYS  53  -4.647   6.357   6.357
  440   2HZ   LYS  53          1HZ       LYS  53  -4.917   7.979   7.979
  441   3HZ   LYS  53          3HZ       LYS  53  -3.426   7.515   7.515
  442    H    THR  54           H        THR  54  -0.763   3.584   3.584
  443    HA   THR  54           HA       THR  54  -0.516   6.247   6.247
  444    HB   THR  54           HB       THR  54   1.220   3.787   3.787
  445    HG1  THR  54           HG1      THR  54  -0.366   3.058   3.058
  446   1HG2  THR  54          1HG2      THR  54   1.339   6.517   6.517
  447   2HG2  THR  54          3HG2      THR  54   1.165   5.384   5.384
  448   3HG2  THR  54          2HG2      THR  54   2.504   5.210   5.210
  449    H    SER  55           H        SER  55   0.826   7.757   7.757
  450    HA   SER  55           HA       SER  55   2.906   6.834   6.834
  451   1HB   SER  55          2HB       SER  55   1.883   9.614   9.614
  452   2HB   SER  55          1HB       SER  55   2.336   8.489   8.489
  453    HG   SER  55           HG       SER  55   0.371   7.630   7.630
  454    H    THR  56           H        THR  56   4.934   7.404   7.404
  455    HA   THR  56           HA       THR  56   5.384   9.236   9.236
  456    HB   THR  56           HB       THR  56   7.856   8.152   8.152
  457    HG1  THR  56           HG1      THR  56   5.805   6.204   6.204
  458   1HG2  THR  56          3HG2      THR  56   6.955   8.615   8.615
  459   2HG2  THR  56          2HG2      THR  56   6.154   7.048   7.048
  460   3HG2  THR  56          1HG2      THR  56   7.913   7.147   7.147
  461    H    THR  57           H        THR  57   7.963  10.104  10.104
  462    HA   THR  57           HA       THR  57   7.498  12.369  12.369
  463    HB   THR  57           HB       THR  57   9.325  12.265  12.265
  464    HG1  THR  57           HG1      THR  57  10.473  13.556  13.556
  465   1HG2  THR  57          3HG2      THR  57   9.880   9.852   9.852
  466   2HG2  THR  57          2HG2      THR  57  10.688  10.358  10.358
  467   3HG2  THR  57          1HG2      THR  57  11.290  10.907  10.907
  468    H    VAL  58           H        VAL  58   9.026   9.261   9.261
  469    HA   VAL  58           HA       VAL  58   8.641   9.966   9.966
  470    HB   VAL  58           HB       VAL  58  11.031   8.529   8.529
  471   1HG1  VAL  58          3HG1      VAL  58  10.095   9.319   9.319
  472   2HG1  VAL  58          2HG1      VAL  58  11.827   9.393   9.393
  473   3HG1  VAL  58          1HG1      VAL  58  10.959   7.869   7.869
  474   1HG2  VAL  58          1HG2      VAL  58  10.429  11.391  11.391
  475   2HG2  VAL  58          3HG2      VAL  58  11.743  10.587  10.587
  476   3HG2  VAL  58          2HG2      VAL  58  11.903  10.946  10.946
  477    H    ARG  59           H        ARG  59   7.919   7.726   7.726
  478    HA   ARG  59           HA       ARG  59   7.795   5.495   5.495
  479   1HB   ARG  59          2HB       ARG  59   8.964   5.361   5.361
  480   2HB   ARG  59          1HB       ARG  59   7.310   5.033   5.033
  481   1HG   ARG  59          2HG       ARG  59   7.234   3.007   3.007
  482   2HG   ARG  59          1HG       ARG  59   8.203   3.561   3.561
  483   1HD   ARG  59          2HD       ARG  59  10.210   3.085   3.085
  484   2HD   ARG  59          1HD       ARG  59   9.543   3.330   3.330
  485    HE   ARG  59           HE       ARG  59   8.611   1.089   1.089
  486   1HH1  ARG  59          1HH2      ARG  59   8.473   1.295   1.295
  487   2HH1  ARG  59          2HH2      ARG  59   9.570   0.022   0.022
  488   1HH2  ARG  59          2HH1      ARG  59  10.900  -0.243  -0.243
  489   2HH2  ARG  59          1HH1      ARG  59  10.944  -0.849  -0.849
  490    H    THR  60           H        THR  60   5.839   3.933   3.933
  491    HA   THR  60           HA       THR  60   3.456   5.369   5.369
  492    HB   THR  60           HB       THR  60   3.525   4.310   4.310
  493    HG1  THR  60           HG1      THR  60   3.819   6.398   6.398
  494   1HG2  THR  60          1HG2      THR  60   1.575   5.837   5.837
  495   2HG2  THR  60          3HG2      THR  60   1.502   5.959   5.959
  496   3HG2  THR  60          2HG2      THR  60   1.294   4.393   4.393
  497    H    THR  61           H        THR  61   1.571   3.895   3.895
  498    HA   THR  61           HA       THR  61   2.046   1.030   1.030
  499    HB   THR  61           HB       THR  61   1.373   0.601   0.601
  500    HG1  THR  61           HG1      THR  61   2.263   2.321   2.321
  501   1HG2  THR  61          3HG2      THR  61   3.731   0.491   0.491
  502   2HG2  THR  61          2HG2      THR  61   4.122   1.730   1.730
  503   3HG2  THR  61          1HG2      THR  61   3.578   0.138   0.138
  504    H    GLU  62           H        GLU  62   0.040  -0.210  -0.210
  505    HA   GLU  62           HA       GLU  62  -2.433   1.275   1.275
  506   1HB   GLU  62          2HB       GLU  62  -1.544   0.588   0.588
  507   2HB   GLU  62          1HB       GLU  62  -3.239   0.301   0.301
  508   1HG   GLU  62          2HG       GLU  62  -3.609   2.493   2.493
  509   2HG   GLU  62          1HG       GLU  62  -2.680   2.828   2.828
  510    H    ILE  63           H        ILE  63  -3.320  -0.198  -0.198
  511    HA   ILE  63           HA       ILE  63  -3.372  -3.072  -3.072
  512    HB   ILE  63           HB       ILE  63  -3.726  -3.597  -3.597
  513   1HG1  ILE  63          2HG1      ILE  63  -3.112  -0.664  -0.664
  514   2HG1  ILE  63          1HG1      ILE  63  -4.738  -1.345  -1.345
  515   1HG2  ILE  63          1HG2      ILE  63  -1.409  -3.233  -3.233
  516   2HG2  ILE  63          3HG2      ILE  63  -1.289  -1.854  -1.854
  517   3HG2  ILE  63          2HG2      ILE  63  -1.469  -3.483  -3.483
  518   1HD1  ILE  63          1HD1      ILE  63  -2.631  -2.737  -2.737
  519   2HD1  ILE  63          3HD1      ILE  63  -3.162  -1.164  -1.164
  520   3HD1  ILE  63          2HD1      ILE  63  -4.331  -2.467  -2.467
  521    H    ASN  64           H        ASN  64  -5.482  -4.179  -4.179
  522    HA   ASN  64           HA       ASN  64  -7.747  -2.471  -2.471
  523   1HB   ASN  64          2HB       ASN  64  -8.942  -2.590  -2.590
  524   2HB   ASN  64          1HB       ASN  64  -7.321  -2.018  -2.018
  525   1HD2  ASN  64          2HD2      ASN  64  -8.471  -5.745  -5.745
  526   2HD2  ASN  64          1HD2      ASN  64  -9.319  -4.970  -4.970
  527    H    PHE  65           H        PHE  65  -9.289  -3.727  -3.727
  528    HA   PHE  65           HA       PHE  65  -9.655  -6.562  -6.562
  529   1HB   PHE  65          2HB       PHE  65  -8.894  -7.463  -7.463
  530   2HB   PHE  65          1HB       PHE  65  -7.579  -6.556  -6.556
  531    HD1  PHE  65           HD2      PHE  65  -6.948  -4.311  -4.311
  532    HD2  PHE  65           HD1      PHE  65 -10.001  -6.665  -6.665
  533    HE1  PHE  65           HE2      PHE  65  -6.873  -2.821  -2.821
  534    HE2  PHE  65           HE1      PHE  65  -9.939  -5.180  -5.180
  535    HZ   PHE  65           HZ       PHE  65  -8.376  -3.249  -3.249
  536    H    LYS  66           H        LYS  66 -10.877  -7.581  -7.581
  537    HA   LYS  66           HA       LYS  66 -12.950  -5.661  -5.661
  538   1HB   LYS  66          2HB       LYS  66 -14.628  -7.579  -7.579
  539   2HB   LYS  66          1HB       LYS  66 -14.116  -6.772  -6.772
  540   1HG   LYS  66          2HG       LYS  66 -12.313  -8.608  -8.608
  541   2HG   LYS  66          1HG       LYS  66 -13.249  -9.457  -9.457
  542   1HD   LYS  66          2HD       LYS  66 -14.716 -10.170 -10.170
  543   2HD   LYS  66          1HD       LYS  66 -15.054  -8.509  -8.509
  544   1HE   LYS  66          2HE       LYS  66 -12.802  -8.680  -8.680
  545   2HE   LYS  66          1HE       LYS  66 -13.015 -10.421 -10.421
  546   1HZ   LYS  66          1HZ       LYS  66 -15.243  -8.771  -8.771
  547   2HZ   LYS  66          3HZ       LYS  66 -14.002  -9.221  -9.221
  548   3HZ   LYS  66          2HZ       LYS  66 -14.918 -10.416 -10.416
  549    H    VAL  67           H        VAL  67 -13.923  -6.382  -6.382
  550    HA   VAL  67           HA       VAL  67 -11.929  -7.804  -7.804
  551    HB   VAL  67           HB       VAL  67 -14.495  -7.173  -7.173
  552   1HG1  VAL  67          2HG1      VAL  67 -11.549  -6.815  -6.815
  553   2HG1  VAL  67          1HG1      VAL  67 -12.696  -5.883  -5.883
  554   3HG1  VAL  67          3HG1      VAL  67 -12.741  -7.646  -7.646
  555   1HG2  VAL  67          3HG2      VAL  67 -12.998  -5.093  -5.093
  556   2HG2  VAL  67          2HG2      VAL  67 -14.720  -5.200  -5.200
  557   3HG2  VAL  67          1HG2      VAL  67 -13.594  -4.669  -4.669
  558    H    GLY  68           H        GLY  68 -12.012  -9.992  -9.992
  559   1HA   GLY  68          2HA       GLY  68 -13.528 -11.820 -11.820
  560   2HA   GLY  68          1HA       GLY  68 -14.614 -11.372 -11.372
  561    H    GLU  69           H        GLU  69 -12.025 -10.968 -10.968
  562    HA   GLU  69           HA       GLU  69 -11.428 -13.876 -13.876
  563   1HB   GLU  69          2HB       GLU  69 -11.689 -13.646 -13.646
  564   2HB   GLU  69          1HB       GLU  69 -13.185 -13.206 -13.206
  565   1HG   GLU  69          2HG       GLU  69 -13.107 -11.294 -11.294
  566   2HG   GLU  69          1HG       GLU  69 -11.810 -10.799 -10.799
  567    H    GLU  70           H        GLU  70  -9.478 -14.285 -14.285
  568    HA   GLU  70           HA       GLU  70  -7.356 -12.342 -12.342
  569   1HB   GLU  70          2HB       GLU  70  -7.401 -15.156 -15.156
  570   2HB   GLU  70          1HB       GLU  70  -5.922 -14.196 -14.196
  571   1HG   GLU  70          2HG       GLU  70  -5.655 -14.395 -14.395
  572   2HG   GLU  70          1HG       GLU  70  -7.376 -14.189 -14.189
  573    H    PHE  71           H        PHE  71  -5.743 -11.823 -11.823
  574    HA   PHE  71           HA       PHE  71  -6.609 -11.955 -11.955
  575   1HB   PHE  71          2HB       PHE  71  -6.683  -9.449  -9.449
  576   2HB   PHE  71          1HB       PHE  71  -8.016 -10.103 -10.103
  577    HD1  PHE  71           HD2      PHE  71  -7.835 -10.083 -10.083
  578    HD2  PHE  71           HD1      PHE  71  -5.158  -7.900  -7.900
  579    HE1  PHE  71           HE2      PHE  71  -7.138  -8.683  -8.683
  580    HE2  PHE  71           HE1      PHE  71  -4.461  -6.501  -6.501
  581    HZ   PHE  71           HZ       PHE  71  -5.449  -6.890  -6.890
  582    H    GLU  72           H        GLU  72  -5.035 -10.515 -10.515
  583    HA   GLU  72           HA       GLU  72  -2.333 -10.820 -10.820
  584   1HB   GLU  72          2HB       GLU  72  -2.764 -10.189 -10.189
  585   2HB   GLU  72          1HB       GLU  72  -1.414 -11.014 -11.014
  586   1HG   GLU  72          2HG       GLU  72  -2.922 -12.933 -12.933
  587   2HG   GLU  72          1HG       GLU  72  -4.209 -12.127 -12.127
  588    H    GLU  73           H        GLU  73  -0.959  -9.027  -9.027
  589    HA   GLU  73           HA       GLU  73  -1.694  -6.451  -6.451
  590   1HB   GLU  73          2HB       GLU  73  -1.853  -5.296  -5.296
  591   2HB   GLU  73          1HB       GLU  73  -3.192  -6.404  -6.404
  592   1HG   GLU  73          2HG       GLU  73  -2.534  -7.861  -7.861
  593   2HG   GLU  73          1HG       GLU  73  -0.819  -7.585  -7.585
  594    H    GLN  74           H        GLN  74  -0.161  -4.730  -4.730
  595    HA   GLN  74           HA       GLN  74   2.560  -5.980  -5.980
  596   1HB   GLN  74          2HB       GLN  74   1.470  -3.238  -3.238
  597   2HB   GLN  74          1HB       GLN  74   3.131  -3.367  -3.367
  598   1HG   GLN  74          2HG       GLN  74   3.462  -5.135  -5.135
  599   2HG   GLN  74          1HG       GLN  74   1.937  -4.555  -4.555
  600   1HE2  GLN  74          2HE2      GLN  74   5.282  -2.464  -2.464
  601   2HE2  GLN  74          1HE2      GLN  74   5.287  -4.031  -4.031
  602    H    THR  75           H        THR  75   4.137  -5.322  -5.322
  603    HA   THR  75           HA       THR  75   2.809  -5.001  -5.001
  604    HB   THR  75           HB       THR  75   4.493  -6.844  -6.844
  605    HG1  THR  75           HG1      THR  75   3.914  -6.030  -6.030
  606   1HG2  THR  75          3HG2      THR  75   6.109  -4.624  -4.624
  607   2HG2  THR  75          2HG2      THR  75   6.842  -5.359  -5.359
  608   3HG2  THR  75          1HG2      THR  75   6.530  -6.335  -6.335
  609    H    VAL  76           H        VAL  76   5.482  -3.852  -3.852
  610    HA   VAL  76           HA       VAL  76   4.878  -1.051  -1.051
  611    HB   VAL  76           HB       VAL  76   6.311  -2.030  -2.030
  612   1HG1  VAL  76          1HG1      VAL  76   5.272   0.642   0.642
  613   2HG1  VAL  76          3HG1      VAL  76   5.560   0.313   0.313
  614   3HG1  VAL  76          2HG1      VAL  76   6.895   0.236   0.236
  615   1HG2  VAL  76          2HG2      VAL  76   3.426  -1.691  -1.691
  616   2HG2  VAL  76          1HG2      VAL  76   4.195  -2.799  -2.799
  617   3HG2  VAL  76          3HG2      VAL  76   3.956  -1.108  -1.108
  618    H    ASP  77           H        ASP  77   7.389  -3.461  -3.461
  619    HA   ASP  77           HA       ASP  77   9.531  -1.500  -1.500
  620   1HB   ASP  77          2HB       ASP  77   9.720  -3.823  -3.823
  621   2HB   ASP  77          1HB       ASP  77   9.790  -4.448  -4.448
  622    H    GLY  78           H        GLY  78   7.891  -4.046  -4.046
  623   1HA   GLY  78          2HA       GLY  78   7.310  -3.051  -3.051
  624   2HA   GLY  78          1HA       GLY  78   9.068  -3.002  -3.002
  625    H    ARG  79           H        ARG  79   6.942  -5.446  -5.446
  626    HA   ARG  79           HA       ARG  79   7.957  -7.433  -7.433
  627   1HB   ARG  79          2HB       ARG  79   8.003  -7.464  -7.464
  628   2HB   ARG  79          1HB       ARG  79   7.729  -8.983  -8.983
  629   1HG   ARG  79          2HG       ARG  79   9.918  -7.411  -7.411
  630   2HG   ARG  79          1HG       ARG  79  10.207  -7.849  -7.849
  631   1HD   ARG  79          2HD       ARG  79   9.138  -9.998  -9.998
  632   2HD   ARG  79          1HD       ARG  79  10.803  -9.499  -9.499
  633    HE   ARG  79           HE       ARG  79  10.094 -10.088 -10.088
  634   1HH1  ARG  79          1HH2      ARG  79  12.900 -10.135 -10.135
  635   2HH1  ARG  79          2HH2      ARG  79  13.239 -11.799 -11.799
  636   1HH2  ARG  79          2HH1      ARG  79   9.914 -12.651 -12.651
  637   2HH2  ARG  79          1HH1      ARG  79  11.548 -13.224 -13.224
  638    HA   PRO  80           HA       PRO  80   3.642  -8.439  -8.439
  639   1HB   PRO  80          2HB       PRO  80   3.815 -10.990 -10.990
  640   2HB   PRO  80          1HB       PRO  80   4.080  -9.528  -9.528
  641   1HG   PRO  80          2HG       PRO  80   6.076 -11.485 -11.485
  642   2HG   PRO  80          1HG       PRO  80   6.176 -10.420 -10.420
  643   1HD   PRO  80          2HD       PRO  80   7.426  -9.982  -9.982
  644   2HD   PRO  80          1HD       PRO  80   7.249  -8.788  -8.788
  645    H    CYS  81           H        CYS  81   2.124  -9.384  -9.384
  646    HA   CYS  81           HA       CYS  81   2.673 -11.810 -11.810
  647   1HB   CYS  81          2HB       CYS  81   2.320 -10.671 -10.671
  648   2HB   CYS  81          1HB       CYS  81   3.857 -10.285 -10.285
  649    HG   CYS  81           HG       CYS  81   1.558  -8.290  -8.290
  650    H    LYS  82           H        LYS  82   0.749 -12.730 -12.730
  651    HA   LYS  82           HA       LYS  82  -1.738 -11.441 -11.441
  652   1HB   LYS  82          2HB       LYS  82  -1.353 -13.826 -13.826
  653   2HB   LYS  82          1HB       LYS  82  -1.234 -14.170 -14.170
  654   1HG   LYS  82          2HG       LYS  82  -3.594 -13.056 -13.056
  655   2HG   LYS  82          1HG       LYS  82  -3.639 -13.396 -13.396
  656   1HD   LYS  82          2HD       LYS  82  -2.700 -15.778 -15.778
  657   2HD   LYS  82          1HD       LYS  82  -3.908 -15.237 -15.237
  658   1HE   LYS  82          2HE       LYS  82  -5.615 -15.693 -15.693
  659   2HE   LYS  82          1HE       LYS  82  -4.804 -14.916 -14.916
  660   1HZ   LYS  82          2HZ       LYS  82  -3.347 -16.955 -16.955
  661   2HZ   LYS  82          1HZ       LYS  82  -4.467 -17.685 -17.685
  662   3HZ   LYS  82          3HZ       LYS  82  -4.959 -17.173 -17.173
  663    H    SER  83           H        SER  83  -2.790 -10.150 -10.150
  664    HA   SER  83           HA       SER  83  -2.249 -10.389 -10.389
  665   1HB   SER  83          2HB       SER  83  -1.954  -8.162  -8.162
  666   2HB   SER  83          1HB       SER  83  -3.260  -8.234  -8.234
  667    HG   SER  83           HG       SER  83  -3.808  -7.039  -7.039
  668    H    LEU  84           H        LEU  84  -4.182  -9.930  -9.930
  669    HA   LEU  84           HA       LEU  84  -6.809 -10.703 -10.703
  670   1HB   LEU  84          2HB       LEU  84  -5.896 -12.902 -12.902
  671   2HB   LEU  84          1HB       LEU  84  -5.458 -12.285 -12.285
  672    HG   LEU  84           HG       LEU  84  -7.810 -11.929 -11.929
  673   1HD1  LEU  84          1HD1      LEU  84  -8.172 -12.050 -12.050
  674   2HD1  LEU  84          3HD1      LEU  84  -9.121 -13.349 -13.349
  675   3HD1  LEU  84          2HD1      LEU  84  -9.376 -11.687 -11.687
  676   1HD2  LEU  84          2HD2      LEU  84  -6.972 -14.616 -14.616
  677   2HD2  LEU  84          1HD2      LEU  84  -7.157 -14.082 -14.082
  678   3HD2  LEU  84          3HD2      LEU  84  -8.583 -14.397 -14.397
  679    H    VAL  85           H        VAL  85  -8.496  -9.959  -9.959
  680    HA   VAL  85           HA       VAL  85  -7.519  -8.401  -8.401
  681    HB   VAL  85           HB       VAL  85  -9.410  -7.211  -7.211
  682   1HG1  VAL  85          1HG1      VAL  85  -7.840  -6.208  -6.208
  683   2HG1  VAL  85          3HG1      VAL  85  -8.424  -5.110  -5.110
  684   3HG1  VAL  85          2HG1      VAL  85  -9.569  -6.068  -6.068
  685   1HG2  VAL  85          3HG2      VAL  85  -6.420  -7.304  -7.304
  686   2HG2  VAL  85          2HG2      VAL  85  -7.523  -7.303  -7.303
  687   3HG2  VAL  85          1HG2      VAL  85  -7.201  -5.805  -5.805
  688    H    LYS  86           H        LYS  86  -8.856  -8.435  -8.435
  689    HA   LYS  86           HA       LYS  86 -11.702  -9.211  -9.211
  690   1HB   LYS  86          2HB       LYS  86 -11.311 -10.252 -10.252
  691   2HB   LYS  86          1HB       LYS  86 -10.989 -11.198 -11.198
  692   1HG   LYS  86          2HG       LYS  86  -8.601 -10.626 -10.626
  693   2HG   LYS  86          1HG       LYS  86  -8.919  -9.621  -9.621
  694   1HD   LYS  86          2HD       LYS  86  -9.995 -11.821 -11.821
  695   2HD   LYS  86          1HD       LYS  86  -8.987 -12.612 -12.612
  696   1HE   LYS  86          2HE       LYS  86  -6.984 -11.600 -11.600
  697   2HE   LYS  86          1HE       LYS  86  -7.940 -10.624 -10.624
  698   1HZ   LYS  86          2HZ       LYS  86  -8.749 -12.686 -12.686
  699   2HZ   LYS  86          1HZ       LYS  86  -7.743 -13.586 -13.586
  700   3HZ   LYS  86          3HZ       LYS  86  -7.061 -12.542 -12.542
  701    H    TRP  87           H        TRP  87 -13.042  -8.410  -8.410
  702    HA   TRP  87           HA       TRP  87 -12.105  -5.728  -5.728
  703   1HB   TRP  87          2HB       TRP  87 -14.694  -7.243  -7.243
  704   2HB   TRP  87          1HB       TRP  87 -14.426  -5.699  -5.699
  705    HD1  TRP  87           HD1      TRP  87 -15.431  -7.203  -7.203
  706    HE1  TRP  87           HE1      TRP  87 -15.686  -5.394  -5.394
  707    HE3  TRP  87           HE3      TRP  87 -13.213  -3.306  -3.306
  708    HZ2  TRP  87           HZ2      TRP  87 -15.026  -2.622  -2.622
  709    HZ3  TRP  87           HZ3      TRP  87 -13.009  -1.105  -1.105
  710    HH2  TRP  87           HH2      TRP  87 -13.907  -0.758  -0.758
  711    H    GLU  88           H        GLU  88 -12.568  -5.038  -5.038
  712    HA   GLU  88           HA       GLU  88 -11.933  -7.174  -7.174
  713   1HB   GLU  88          2HB       GLU  88  -9.936  -5.671  -5.671
  714   2HB   GLU  88          1HB       GLU  88 -10.735  -4.417  -4.417
  715   1HG   GLU  88          2HG       GLU  88  -9.279  -5.391  -5.391
  716   2HG   GLU  88          1HG       GLU  88 -10.825  -6.169  -6.169
  717    H    SER  89           H        SER  89 -12.939  -3.851  -3.851
  718    HA   SER  89           HA       SER  89 -14.958  -4.087  -4.087
  719   1HB   SER  89          2HB       SER  89 -14.457  -1.843  -1.843
  720   2HB   SER  89          1HB       SER  89 -12.931  -2.722  -2.722
  721    HG   SER  89           HG       SER  89 -13.410  -0.481  -0.481
  722    H    GLU  90           H        GLU  90 -15.872  -1.334  -1.334
  723    HA   GLU  90           HA       GLU  90 -17.460  -2.015  -2.015
  724   1HB   GLU  90          2HB       GLU  90 -17.379   0.670   0.670
  725   2HB   GLU  90          1HB       GLU  90 -18.695  -0.009  -0.009
  726   1HG   GLU  90          2HG       GLU  90 -18.423  -1.953  -1.953
  727   2HG   GLU  90          1HG       GLU  90 -17.928  -0.546  -0.546
  728    H    ASN  91           H        ASN  91 -14.561  -0.161  -0.161
  729    HA   ASN  91           HA       ASN  91 -14.455   0.449   0.449
  730   1HB   ASN  91          2HB       ASN  91 -13.658   2.546   2.546
  731   2HB   ASN  91          1HB       ASN  91 -13.962   2.739   2.739
  732   1HD2  ASN  91          2HD2      ASN  91 -16.940   3.575   3.575
  733   2HD2  ASN  91          1HD2      ASN  91 -15.287   3.670   3.670
  734    H    LYS  92           H        LYS  92 -12.957  -1.385  -1.385
  735    HA   LYS  92           HA       LYS  92 -10.252  -0.420  -0.420
  736   1HB   LYS  92          2HB       LYS  92 -10.596   0.042   0.042
  737   2HB   LYS  92          1HB       LYS  92 -10.994  -1.652  -1.652
  738   1HG   LYS  92          2HG       LYS  92  -8.696  -2.186  -2.186
  739   2HG   LYS  92          1HG       LYS  92  -8.340  -0.471  -0.471
  740   1HD   LYS  92          2HD       LYS  92  -9.042  -0.748  -0.748
  741   2HD   LYS  92          1HD       LYS  92  -8.992  -2.487  -2.487
  742   1HE   LYS  92          2HE       LYS  92  -6.647  -2.365  -2.365
  743   2HE   LYS  92          1HE       LYS  92  -6.672  -0.606  -0.606
  744   1HZ   LYS  92          1HZ       LYS  92  -7.223  -0.834  -0.834
  745   2HZ   LYS  92          3HZ       LYS  92  -7.112  -2.521  -2.521
  746   3HZ   LYS  92          2HZ       LYS  92  -5.733  -1.559  -1.559
  747    H    MET  93           H        MET  93  -9.601  -1.903  -1.903
  748    HA   MET  93           HA       MET  93 -10.247  -4.775  -4.775
  749   1HB   MET  93          2HB       MET  93  -9.826  -5.011  -5.011
  750   2HB   MET  93          1HB       MET  93 -11.339  -4.270  -4.270
  751   1HG   MET  93          2HG       MET  93 -10.663  -2.134  -2.134
  752   2HG   MET  93          1HG       MET  93  -8.951  -2.530  -2.530
  753   1HE   MET  93          3HE       MET  93 -12.134  -3.781  -3.781
  754   2HE   MET  93          2HE       MET  93 -11.997  -2.220  -2.220
  755   3HE   MET  93          1HE       MET  93 -11.853  -3.701  -3.701
  756    H    VAL  94           H        VAL  94  -8.614  -6.330  -6.330
  757    HA   VAL  94           HA       VAL  94  -5.845  -5.209  -5.209
  758    HB   VAL  94           HB       VAL  94  -6.445  -8.084  -8.084
  759   1HG1  VAL  94          2HG1      VAL  94  -4.209  -6.373  -6.373
  760   2HG1  VAL  94          1HG1      VAL  94  -4.682  -6.701  -6.701
  761   3HG1  VAL  94          3HG1      VAL  94  -4.324  -8.035  -8.035
  762   1HG2  VAL  94          1HG2      VAL  94  -7.294  -5.738  -5.738
  763   2HG2  VAL  94          3HG2      VAL  94  -8.059  -7.318  -7.318
  764   3HG2  VAL  94          2HG2      VAL  94  -6.623  -7.141  -7.141
  765    H    CYS  95           H        CYS  95  -4.191  -6.725  -6.725
  766    HA   CYS  95           HA       CYS  95  -5.399  -8.108  -8.108
  767   1HB   CYS  95          2HB       CYS  95  -5.009  -5.733  -5.733
  768   2HB   CYS  95          1HB       CYS  95  -3.311  -5.925  -5.925
  769    HG   CYS  95           HG       CYS  95  -3.414  -7.952  -7.952
  770    H    GLU  96           H        GLU  96  -4.278  -9.898  -9.898
  771    HA   GLU  96           HA       GLU  96  -1.570 -10.280 -10.280
  772   1HB   GLU  96          2HB       GLU  96  -1.968 -12.719 -12.719
  773   2HB   GLU  96          1HB       GLU  96  -3.107 -12.050 -12.050
  774   1HG   GLU  96          2HG       GLU  96  -4.826 -11.848 -11.848
  775   2HG   GLU  96          1HG       GLU  96  -3.692 -12.184 -12.184
  776    H    GLN  97           H        GLN  97   0.081 -11.267 -11.267
  777    HA   GLN  97           HA       GLN  97  -0.575 -11.093 -11.093
  778   1HB   GLN  97          2HB       GLN  97   0.122  -8.789  -8.789
  779   2HB   GLN  97          1HB       GLN  97   1.735  -9.439  -9.439
  780   1HG   GLN  97          2HG       GLN  97   1.041  -9.891  -9.891
  781   2HG   GLN  97          1HG       GLN  97  -0.420  -8.967  -8.967
  782   1HE2  GLN  97          2HE2      GLN  97   1.200  -5.888  -5.888
  783   2HE2  GLN  97          1HE2      GLN  97  -0.253  -6.765  -6.765
  784    H    LYS  98           H        LYS  98   0.780 -12.259 -12.259
  785    HA   LYS  98           HA       LYS  98   3.353 -13.256 -13.256
  786   1HB   LYS  98          2HB       LYS  98   2.771 -15.584 -15.584
  787   2HB   LYS  98          1HB       LYS  98   1.731 -14.996 -14.996
  788   1HG   LYS  98          2HG       LYS  98   0.030 -14.350 -14.350
  789   2HG   LYS  98          1HG       LYS  98   1.048 -15.104 -15.104
  790   1HD   LYS  98          2HD       LYS  98   0.961 -17.203 -17.203
  791   2HD   LYS  98          1HD       LYS  98  -0.424 -16.411 -16.411
  792   1HE   LYS  98          2HE       LYS  98  -0.425 -16.471 -16.471
  793   2HE   LYS  98          1HE       LYS  98  -0.641 -18.027 -18.027
  794   1HZ   LYS  98          3HZ       LYS  98  -2.224 -15.585 -15.585
  795   2HZ   LYS  98          2HZ       LYS  98  -2.747 -16.864 -16.864
  796   3HZ   LYS  98          1HZ       LYS  98  -2.463 -17.125 -17.125
  797    H    LEU  99           H        LEU  99   4.820 -13.862 -13.862
  798    HA   LEU  99           HA       LEU  99   4.549 -12.332 -12.332
  799   1HB   LEU  99          2HB       LEU  99   6.240 -14.756 -14.756
  800   2HB   LEU  99          1HB       LEU  99   6.396 -13.812 -13.812
  801    HG   LEU  99           HG       LEU  99   6.435 -12.300 -12.300
  802   1HD1  LEU  99          3HD1      LEU  99   7.861 -14.425 -14.425
  803   2HD1  LEU  99          2HD1      LEU  99   8.901 -13.746 -13.746
  804   3HD1  LEU  99          1HD1      LEU  99   8.676 -12.885 -12.885
  805   1HD2  LEU  99          2HD2      LEU  99   6.641 -11.221 -11.221
  806   2HD2  LEU  99          1HD2      LEU  99   8.103 -10.996 -10.996
  807   3HD2  LEU  99          3HD2      LEU  99   8.073 -12.197 -12.197
  808    H    LEU 100           H        LEU 100   4.608 -13.286 -13.286
  809    HA   LEU 100           HA       LEU 100   2.495 -15.345 -15.345
  810   1HB   LEU 100          2HB       LEU 100   3.603 -13.234 -13.234
  811   2HB   LEU 100          1HB       LEU 100   2.574 -14.544 -14.544
  812    HG   LEU 100           HG       LEU 100   1.734 -12.836 -12.836
  813   1HD1  LEU 100          2HD1      LEU 100   1.607 -12.224 -12.224
  814   2HD1  LEU 100          1HD1      LEU 100   0.330 -11.654 -11.654
  815   3HD1  LEU 100          3HD1      LEU 100   1.998 -11.147 -11.147
  816   1HD2  LEU 100          3HD2      LEU 100   0.493 -14.797 -14.797
  817   2HD2  LEU 100          2HD2      LEU 100   0.266 -14.624 -14.624
  818   3HD2  LEU 100          1HD2      LEU 100  -0.520 -13.500 -13.500
  819    H    LYS 101           H        LYS 101   5.862 -15.083 -15.083
  820    HA   LYS 101           HA       LYS 101   6.135 -17.707 -17.707
  821   1HB   LYS 101          2HB       LYS 101   6.368 -15.912 -15.912
  822   2HB   LYS 101          1HB       LYS 101   7.839 -15.407 -15.407
  823   1HG   LYS 101          2HG       LYS 101   8.784 -16.942 -16.942
  824   2HG   LYS 101          1HG       LYS 101   8.319 -18.051 -18.051
  825   1HD   LYS 101          2HD       LYS 101   6.033 -18.155 -18.155
  826   2HD   LYS 101          1HD       LYS 101   6.995 -17.578 -17.578
  827   1HE   LYS 101          2HE       LYS 101   8.402 -19.485 -19.485
  828   2HE   LYS 101          1HE       LYS 101   7.872 -19.944 -19.944
  829   1HZ   LYS 101          1HZ       LYS 101   5.651 -20.353 -20.353
  830   2HZ   LYS 101          3HZ       LYS 101   6.224 -19.991 -19.991
  831   3HZ   LYS 101          2HZ       LYS 101   6.828 -21.343 -21.343
  832    H    GLY 102           H        GLY 102   7.832 -18.844 -18.844
  833   1HA   GLY 102          2HA       GLY 102   9.585 -19.303 -19.303
  834   2HA   GLY 102          1HA       GLY 102  10.124 -17.642 -17.642
  835    H    GLU 103           H        GLU 103  10.578 -17.590 -17.590
  836    HA   GLU 103           HA       GLU 103   8.491 -16.331 -16.331
  837   1HB   GLU 103          2HB       GLU 103   7.657 -18.692 -18.692
  838   2HB   GLU 103          1HB       GLU 103   9.146 -19.143 -19.143
  839   1HG   GLU 103          2HG       GLU 103   8.647 -17.675 -17.675
  840   2HG   GLU 103          1HG       GLU 103   7.265 -16.991 -16.991
  841    H    GLY 104           H        GLY 104   9.354 -15.283 -15.283
  842   1HA   GLY 104          2HA       GLY 104  11.887 -16.153 -16.153
  843   2HA   GLY 104          1HA       GLY 104  11.956 -14.615 -14.615
  844    HA   PRO 105           HA       PRO 105  10.260 -12.801 -12.801
  845   1HB   PRO 105          2HB       PRO 105   9.431 -10.398 -10.398
  846   2HB   PRO 105          1HB       PRO 105  11.133 -10.793 -10.793
  847   1HG   PRO 105          2HG       PRO 105   9.686 -10.586 -10.586
  848   2HG   PRO 105          1HG       PRO 105  11.422 -10.460 -10.460
  849   1HD   PRO 105          2HD       PRO 105  10.025 -12.735 -12.735
  850   2HD   PRO 105          1HD       PRO 105  11.737 -12.652 -12.652
  851    H    LYS 106           H        LYS 106   8.107 -11.397 -11.397
  852    HA   LYS 106           HA       LYS 106   5.796 -12.523 -12.523
  853   1HB   LYS 106          2HB       LYS 106   6.146 -13.889 -13.889
  854   2HB   LYS 106          1HB       LYS 106   6.143 -12.430 -12.430
  855   1HG   LYS 106          2HG       LYS 106   3.857 -12.006 -12.006
  856   2HG   LYS 106          1HG       LYS 106   3.822 -13.137 -13.137
  857   1HD   LYS 106          2HD       LYS 106   2.754 -14.264 -14.264
  858   2HD   LYS 106          1HD       LYS 106   4.364 -14.972 -14.972
  859   1HE   LYS 106          2HE       LYS 106   3.932 -14.500 -14.500
  860   2HE   LYS 106          1HE       LYS 106   5.153 -13.368 -13.368
  861   1HZ   LYS 106          1HZ       LYS 106   2.273 -12.703 -12.703
  862   2HZ   LYS 106          3HZ       LYS 106   3.244 -12.419 -12.419
  863   3HZ   LYS 106          2HZ       LYS 106   3.601 -11.649 -11.649
  864    H    THR 107           H        THR 107   4.161 -10.973 -10.973
  865    HA   THR 107           HA       THR 107   4.579  -8.370  -8.370
  866    HB   THR 107           HB       THR 107   3.238  -7.668  -7.668
  867    HG1  THR 107           HG1      THR 107   3.661  -9.887  -9.887
  868   1HG2  THR 107          1HG2      THR 107   6.229  -7.830  -7.830
  869   2HG2  THR 107          3HG2      THR 107   5.425  -6.802  -6.802
  870   3HG2  THR 107          2HG2      THR 107   5.174  -6.524  -6.524
  871    H    SER 108           H        SER 108   2.808  -7.260  -7.260
  872    HA   SER 108           HA       SER 108   0.073  -8.089  -8.089
  873   1HB   SER 108          2HB       SER 108  -0.219  -8.375  -8.375
  874   2HB   SER 108          1HB       SER 108   0.203  -9.748  -9.748
  875    HG   SER 108           HG       SER 108   1.594  -8.651  -8.651
  876    H    TRP 109           H        TRP 109  -1.180  -6.216  -6.216
  877    HA   TRP 109           HA       TRP 109  -0.122  -4.114  -4.114
  878   1HB   TRP 109          2HB       TRP 109  -0.779  -2.396  -2.396
  879   2HB   TRP 109          1HB       TRP 109   0.627  -3.370  -3.370
  880    HD1  TRP 109           HD1      TRP 109   0.464  -4.970  -4.970
  881    HE1  TRP 109           HE1      TRP 109  -1.315  -5.328  -5.328
  882    HE3  TRP 109           HE3      TRP 109  -3.433  -2.372  -2.372
  883    HZ2  TRP 109           HZ2      TRP 109  -4.032  -4.607  -4.607
  884    HZ3  TRP 109           HZ3      TRP 109  -5.599  -2.224  -2.224
  885    HH2  TRP 109           HH2      TRP 109  -5.906  -3.334  -3.334
  886    H    THR 110           H        THR 110  -1.796  -2.346  -2.346
  887    HA   THR 110           HA       THR 110  -4.570  -3.442  -3.442
  888    HB   THR 110           HB       THR 110  -5.018  -2.832  -2.832
  889    HG1  THR 110           HG1      THR 110  -3.337  -1.823  -1.823
  890   1HG2  THR 110          2HG2      THR 110  -3.102  -4.760  -4.760
  891   2HG2  THR 110          1HG2      THR 110  -2.389  -3.871  -3.871
  892   3HG2  THR 110          3HG2      THR 110  -3.972  -4.624  -4.624
  893    H    MET 111           H        MET 111  -6.181  -1.657  -1.657
  894    HA   MET 111           HA       MET 111  -5.284   1.100   1.100
  895   1HB   MET 111          2HB       MET 111  -6.947   1.332   1.332
  896   2HB   MET 111          1HB       MET 111  -5.518   0.372   0.372
  897   1HG   MET 111          2HG       MET 111  -6.775  -1.696  -1.696
  898   2HG   MET 111          1HG       MET 111  -8.203  -0.748  -0.748
  899   1HE   MET 111          2HE       MET 111  -9.650   0.071   0.071
  900   2HE   MET 111          1HE       MET 111  -9.513   0.924   0.924
  901   3HE   MET 111          3HE       MET 111 -10.148  -0.725  -0.725
  902    H    GLU 112           H        GLU 112  -6.472   2.360   2.360
  903    HA   GLU 112           HA       GLU 112  -9.159   1.343   1.343
  904   1HB   GLU 112          2HB       GLU 112  -7.456   1.301   1.301
  905   2HB   GLU 112          1HB       GLU 112  -7.190   3.028   3.028
  906   1HG   GLU 112          2HG       GLU 112  -9.416   3.557   3.557
  907   2HG   GLU 112          1HG       GLU 112  -9.906   1.865   1.865
  908    H    LEU 113           H        LEU 113 -10.804   2.924   2.924
  909    HA   LEU 113           HA       LEU 113 -10.276   5.555   5.555
  910   1HB   LEU 113          2HB       LEU 113 -12.062   3.590   3.590
  911   2HB   LEU 113          1HB       LEU 113 -13.072   4.611   4.611
  912    HG   LEU 113           HG       LEU 113 -13.089   5.198   5.198
  913   1HD1  LEU 113          3HD1      LEU 113 -12.754   6.962   6.962
  914   2HD1  LEU 113          2HD1      LEU 113 -12.105   7.711   7.711
  915   3HD1  LEU 113          1HD1      LEU 113 -13.775   7.152   7.152
  916   1HD2  LEU 113          3HD2      LEU 113 -10.547   4.739   4.739
  917   2HD2  LEU 113          2HD2      LEU 113 -11.207   6.099   6.099
  918   3HD2  LEU 113          1HD2      LEU 113 -10.359   6.378   6.378
  919    H    THR 114           H        THR 114 -11.084   7.405   7.405
  920    HA   THR 114           HA       THR 114 -11.661   6.824   6.824
  921    HB   THR 114           HB       THR 114 -11.472   9.302   9.302
  922    HG1  THR 114           HG1      THR 114 -10.952  10.517  10.517
  923   1HG2  THR 114          2HG2      THR 114  -9.278   7.721   7.721
  924   2HG2  THR 114          1HG2      THR 114  -9.010   9.371   9.371
  925   3HG2  THR 114          3HG2      THR 114  -9.465   8.111   8.111
  926    H    ASN 115           H        ASN 115 -13.421   8.160   8.160
  927    HA   ASN 115           HA       ASN 115 -15.942   7.550   7.550
  928   1HB   ASN 115          2HB       ASN 115 -15.223   8.059   8.059
  929   2HB   ASN 115          1HB       ASN 115 -15.735   9.692   9.692
  930   1HD2  ASN 115          2HD2      ASN 115 -18.627   7.410   7.410
  931   2HD2  ASN 115          1HD2      ASN 115 -17.045   7.527   7.527
  932    H    ASP 116           H        ASP 116 -13.865  10.321  10.321
  933    HA   ASP 116           HA       ASP 116 -16.108  11.949  11.949
  934   1HB   ASP 116          2HB       ASP 116 -14.460  13.767  13.767
  935   2HB   ASP 116          1HB       ASP 116 -14.455  13.064  13.064
  936    H    GLY 117           H        GLY 117 -13.258  10.188  10.188
  937   1HA   GLY 117          2HA       GLY 117 -13.920   9.391   9.391
  938   2HA   GLY 117          1HA       GLY 117 -13.856  11.115  11.115
  939    H    GLU 118           H        GLU 118 -11.496  11.023  11.023
  940    HA   GLU 118           HA       GLU 118  -9.344  11.245  11.245
  941   1HB   GLU 118          2HB       GLU 118  -9.149  10.267  10.267
  942   2HB   GLU 118          1HB       GLU 118  -7.851  10.979  10.979
  943   1HG   GLU 118          2HG       GLU 118  -9.793  12.897  12.897
  944   2HG   GLU 118          1HG       GLU 118 -10.099  12.289  12.289
  945    H    LEU 119           H        LEU 119  -7.377   9.668   9.668
  946    HA   LEU 119           HA       LEU 119  -8.241   6.833   6.833
  947   1HB   LEU 119          2HB       LEU 119  -8.817   7.704   7.704
  948   2HB   LEU 119          1HB       LEU 119  -7.112   8.050   8.050
  949    HG   LEU 119           HG       LEU 119  -8.065   5.288   5.288
  950   1HD1  LEU 119          2HD1      LEU 119  -8.157   6.705   6.705
  951   2HD1  LEU 119          1HD1      LEU 119  -7.783   4.981   4.981
  952   3HD1  LEU 119          3HD1      LEU 119  -9.311   5.567   5.567
  953   1HD2  LEU 119          1HD2      LEU 119  -5.579   6.559   6.559
  954   2HD2  LEU 119          3HD2      LEU 119  -5.740   5.287   5.287
  955   3HD2  LEU 119          2HD2      LEU 119  -5.957   4.910   4.910
  956    H    ILE 120           H        ILE 120  -6.680   5.903   5.903
  957    HA   ILE 120           HA       ILE 120  -3.851   6.779   6.779
  958    HB   ILE 120           HB       ILE 120  -4.574   7.034   7.034
  959   1HG1  ILE 120          2HG1      ILE 120  -2.833   4.560   4.560
  960   2HG1  ILE 120          1HG1      ILE 120  -2.248   6.199   6.199
  961   1HG2  ILE 120          3HG2      ILE 120  -5.462   4.177   4.177
  962   2HG2  ILE 120          2HG2      ILE 120  -5.106   4.805   4.805
  963   3HG2  ILE 120          1HG2      ILE 120  -6.380   5.542   5.542
  964   1HD1  ILE 120          2HD1      ILE 120  -3.221   6.746   6.746
  965   2HD1  ILE 120          1HD1      ILE 120  -3.272   4.999   4.999
  966   3HD1  ILE 120          3HD1      ILE 120  -1.731   5.803   5.803
  967    H    LEU 121           H        LEU 121  -2.239   4.978   4.978
  968    HA   LEU 121           HA       LEU 121  -3.422   2.354   2.354
  969   1HB   LEU 121          2HB       LEU 121  -3.117   3.666   3.666
  970   2HB   LEU 121          1HB       LEU 121  -1.414   3.876   3.876
  971    HG   LEU 121           HG       LEU 121  -2.021   1.073   1.073
  972   1HD1  LEU 121          3HD1      LEU 121  -3.940   1.667   1.667
  973   2HD1  LEU 121          2HD1      LEU 121  -2.786   2.306   2.306
  974   3HD1  LEU 121          1HD1      LEU 121  -2.773   0.589   0.589
  975   1HD2  LEU 121          3HD2      LEU 121   0.163   2.204   2.204
  976   2HD2  LEU 121          2HD2      LEU 121  -0.254   0.889   0.889
  977   3HD2  LEU 121          1HD2      LEU 121  -0.480   2.564   2.564
  978    H    THR 122           H        THR 122  -2.206   0.687   0.687
  979    HA   THR 122           HA       THR 122   0.517   1.363   1.363
  980    HB   THR 122           HB       THR 122  -0.481  -1.100  -1.100
  981    HG1  THR 122           HG1      THR 122  -2.146   1.170   1.170
  982   1HG2  THR 122          2HG2      THR 122   0.223   1.634   1.634
  983   2HG2  THR 122          1HG2      THR 122  -0.247   0.296   0.296
  984   3HG2  THR 122          3HG2      THR 122   1.197   0.165   0.165
  985    H    MET 123           H        MET 123   1.944  -0.700  -0.700
  986    HA   MET 123           HA       MET 123   1.268  -2.532  -2.532
  987   1HB   MET 123          2HB       MET 123   3.803  -0.865  -0.865
  988   2HB   MET 123          1HB       MET 123   3.364  -2.071  -2.071
  989   1HG   MET 123          2HG       MET 123   1.217  -0.651  -0.651
  990   2HG   MET 123          1HG       MET 123   2.114   0.623   0.623
  991   1HE   MET 123          3HE       MET 123   0.972  -0.754  -0.754
  992   2HE   MET 123          2HE       MET 123   2.078  -0.457  -0.457
  993   3HE   MET 123          1HE       MET 123   2.294  -1.883  -1.883
  994    H    THR 124           H        THR 124   2.905  -4.297  -4.297
  995    HA   THR 124           HA       THR 124   4.611  -4.647  -4.647
  996    HB   THR 124           HB       THR 124   2.667  -6.815  -6.815
  997    HG1  THR 124           HG1      THR 124   1.374  -5.184  -5.184
  998   1HG2  THR 124          3HG2      THR 124   4.752  -7.354  -7.354
  999   2HG2  THR 124          2HG2      THR 124   4.232  -6.234  -6.234
 1000   3HG2  THR 124          1HG2      THR 124   3.284  -7.681  -7.681
 1001    H    ALA 125           H        ALA 125   6.196  -6.254  -6.254
 1002    HA   ALA 125           HA       ALA 125   6.296  -7.792  -7.792
 1003   1HB   ALA 125          2HB       ALA 125   8.271  -5.551  -5.551
 1004   2HB   ALA 125          1HB       ALA 125   8.452  -6.779  -6.779
 1005   3HB   ALA 125          3HB       ALA 125   7.109  -5.639  -5.639
 1006    H    ASP 126           H        ASP 126   6.601  -9.635  -9.635
 1007    HA   ASP 126           HA       ASP 126   7.900 -11.288 -11.288
 1008   1HB   ASP 126          2HB       ASP 126   9.861  -9.456  -9.456
 1009   2HB   ASP 126          1HB       ASP 126  10.265  -9.810  -9.810
 1010    H    ASP 127           H        ASP 127   9.234  -8.465  -8.465
 1011    HA   ASP 127           HA       ASP 127   7.401  -8.945  -8.945
 1012   1HB   ASP 127          2HB       ASP 127   9.419 -10.442 -10.442
 1013   2HB   ASP 127          1HB       ASP 127  10.399  -8.978  -8.978
 1014    H    VAL 128           H        VAL 128   8.101  -6.827  -6.827
 1015    HA   VAL 128           HA       VAL 128   8.701  -4.629  -4.629
 1016    HB   VAL 128           HB       VAL 128   9.626  -3.359  -3.359
 1017   1HG1  VAL 128          1HG1      VAL 128  10.724  -6.185  -6.185
 1018   2HG1  VAL 128          3HG1      VAL 128  11.591  -4.778  -4.778
 1019   3HG1  VAL 128          2HG1      VAL 128  11.153  -4.867  -4.867
 1020   1HG2  VAL 128          3HG2      VAL 128   8.352  -5.541  -5.541
 1021   2HG2  VAL 128          2HG2      VAL 128   8.663  -3.869  -3.869
 1022   3HG2  VAL 128          1HG2      VAL 128   9.950  -5.068  -5.068
 1023    H    VAL 129           H        VAL 129   7.736  -2.493  -2.493
 1024    HA   VAL 129           HA       VAL 129   5.234  -3.009  -3.009
 1025    HB   VAL 129           HB       VAL 129   5.342  -2.475  -2.475
 1026   1HG1  VAL 129          1HG1      VAL 129   3.255  -1.256  -1.256
 1027   2HG1  VAL 129          3HG1      VAL 129   2.952  -1.571  -1.571
 1028   3HG1  VAL 129          2HG1      VAL 129   4.217  -0.438  -0.438
 1029   1HG2  VAL 129          2HG2      VAL 129   3.849  -4.163  -4.163
 1030   2HG2  VAL 129          1HG2      VAL 129   4.542  -4.587  -4.587
 1031   3HG2  VAL 129          3HG2      VAL 129   3.011  -3.716  -3.716
 1032    H    CYS 130           H        CYS 130   5.167  -1.426  -1.426
 1033    HA   CYS 130           HA       CYS 130   6.440   1.199   1.199
 1034   1HB   CYS 130          2HB       CYS 130   6.742  -0.301  -0.301
 1035   2HB   CYS 130          1HB       CYS 130   5.293   0.573   0.573
 1036    HG   CYS 130           HG       CYS 130   6.947   2.326   2.326
 1037    H    THR 131           H        THR 131   5.071   2.714   2.714
 1038    HA   THR 131           HA       THR 131   2.203   2.610   2.610
 1039    HB   THR 131           HB       THR 131   3.457   3.870   3.870
 1040    HG1  THR 131           HG1      THR 131   2.498   2.133   2.133
 1041   1HG2  THR 131          3HG2      THR 131   0.675   3.794   3.794
 1042   2HG2  THR 131          2HG2      THR 131   0.899   3.772   3.772
 1043   3HG2  THR 131          1HG2      THR 131   1.523   5.119   5.119
 1044    H    ARG 132           H        ARG 132   1.208   4.501   4.501
 1045    HA   ARG 132           HA       ARG 132   2.664   7.032   7.032
 1046   1HB   ARG 132          2HB       ARG 132   1.874   7.059   7.059
 1047   2HB   ARG 132          1HB       ARG 132   3.461   6.456   6.456
 1048   1HG   ARG 132          2HG       ARG 132   1.232   4.480   4.480
 1049   2HG   ARG 132          1HG       ARG 132   1.764   5.038   5.038
 1050   1HD   ARG 132          2HD       ARG 132   3.898   4.307   4.307
 1051   2HD   ARG 132          1HD       ARG 132   2.948   2.982   2.982
 1052    HE   ARG 132           HE       ARG 132   4.682   4.825   4.825
 1053   1HH1  ARG 132          1HH2      ARG 132   1.882   3.419   3.419
 1054   2HH1  ARG 132          2HH2      ARG 132   2.539   2.251   2.251
 1055   1HH2  ARG 132          2HH1      ARG 132   5.820   2.770   2.770
 1056   2HH2  ARG 132          1HH1      ARG 132   4.768   1.884   1.884
 1057    H    VAL 133           H        VAL 133   1.122   8.526   8.526
 1058    HA   VAL 133           HA       VAL 133  -1.721   7.780   7.780
 1059    HB   VAL 133           HB       VAL 133  -0.438  10.380  10.380
 1060   1HG1  VAL 133          1HG1      VAL 133  -2.909  10.395  10.395
 1061   2HG1  VAL 133          3HG1      VAL 133  -3.121   9.192   9.192
 1062   3HG1  VAL 133          2HG1      VAL 133  -2.522  10.803  10.803
 1063   1HG2  VAL 133          1HG2      VAL 133  -1.214   7.930   7.930
 1064   2HG2  VAL 133          3HG2      VAL 133   0.430   8.494   8.494
 1065   3HG2  VAL 133          2HG2      VAL 133  -0.668   9.460   9.460
 1066    H    TYR 134           H        TYR 134  -3.281   8.722   8.722
 1067    HA   TYR 134           HA       TYR 134  -2.217  10.640  10.640
 1068   1HB   TYR 134          2HB       TYR 134  -3.769   8.108   8.108
 1069   2HB   TYR 134          1HB       TYR 134  -3.994   9.446   9.446
 1070    HD1  TYR 134           HD1      TYR 134  -1.603   6.959   6.959
 1071    HD2  TYR 134           HD2      TYR 134  -2.188  10.222  10.222
 1072    HE1  TYR 134           HE1      TYR 134   0.470   6.333   6.333
 1073    HE2  TYR 134           HE2      TYR 134  -0.103   9.594   9.594
 1074    HH   TYR 134           HH       TYR 134   2.211   7.667   7.667
 1075    H    VAL 135           H        VAL 135  -3.463  12.378  12.378
 1076    HA   VAL 135           HA       VAL 135  -6.221  12.339  12.339
 1077    HB   VAL 135           HB       VAL 135  -4.071  14.066  14.066
 1078   1HG1  VAL 135          2HG1      VAL 135  -4.611  15.305  15.305
 1079   2HG1  VAL 135          1HG1      VAL 135  -6.201  15.654  15.654
 1080   3HG1  VAL 135          3HG1      VAL 135  -4.749  16.281  16.281
 1081   1HG2  VAL 135          3HG2      VAL 135  -6.231  13.333  13.333
 1082   2HG2  VAL 135          2HG2      VAL 135  -5.574  14.935  14.935
 1083   3HG2  VAL 135          1HG2      VAL 135  -6.955  14.759  14.759
 1084    H    ARG 136           H        ARG 136  -7.885  12.984  12.984
 1085    HA   ARG 136           HA       ARG 136  -7.550  12.624  12.624
 1086   1HB   ARG 136          2HB       ARG 136  -9.641  13.583  13.583
 1087   2HB   ARG 136          1HB       ARG 136  -9.590  14.558  14.558
 1088   1HG   ARG 136          2HG       ARG 136 -10.028  12.768  12.768
 1089   2HG   ARG 136          1HG       ARG 136  -9.367  11.591  11.591
 1090   1HD   ARG 136          2HD       ARG 136 -12.021  13.041  13.041
 1091   2HD   ARG 136          1HD       ARG 136 -11.766  11.310  11.310
 1092    HE   ARG 136           HE       ARG 136 -10.462  11.912  11.912
 1093   1HH1  ARG 136          1HH2      ARG 136 -13.280  10.552  10.552
 1094   2HH1  ARG 136          2HH2      ARG 136 -14.236  11.221  11.221
 1095   1HH2  ARG 136          2HH1      ARG 136 -11.841  13.550  13.550
 1096   2HH2  ARG 136          1HH1      ARG 136 -13.423  12.922  12.922
 1097    H    GLU 137           HN       GLU 137  -6.618  13.688  13.688
 1098    HA   GLU 137           HA       GLU 137  -5.319  15.310  15.310
 1099   1HB   GLU 137          2HB       GLU 137  -7.829  15.878  15.878
 1100   2HB   GLU 137          1HB       GLU 137  -7.461  17.209  17.209
 1101   1HG   GLU 137          2HG       GLU 137  -5.622  17.907  17.907
 1102   2HG   GLU 137          1HG       GLU 137  -6.157  16.657  16.657

  Start of MODEL   22
    1   1H    PRO   1          1H        PRO   1 -16.139   8.509   8.509
    2   2H    PRO   1          2H        PRO   1 -15.560   7.949   7.949
    3    HA   PRO   1           HA       PRO   1 -15.982   5.855   5.855
    4   1HB   PRO   1          2HB       PRO   1 -18.706   5.944   5.944
    5   2HB   PRO   1          1HB       PRO   1 -18.093   5.382   5.382
    6   1HG   PRO   1          2HG       PRO   1 -19.535   7.791   7.791
    7   2HG   PRO   1          1HG       PRO   1 -18.917   7.226   7.226
    8   1HD   PRO   1          1HD       PRO   1 -17.922   9.375   9.375
    9   2HD   PRO   1          2HD       PRO   1 -17.313   8.809   8.809
   10    H    ASN   2           H        ASN   2 -14.869   7.450   7.450
   11    HA   ASN   2           HA       ASN   2 -15.662   5.864   5.864
   12   1HB   ASN   2          2HB       ASN   2 -16.197   8.777   8.777
   13   2HB   ASN   2          1HB       ASN   2 -15.541   8.248   8.248
   14   1HD2  ASN   2          2HD2      ASN   2 -18.580   6.823   6.823
   15   2HD2  ASN   2          1HD2      ASN   2 -16.999   7.293   7.293
   16    H    PHE   3           H        PHE   3 -13.814   5.210   5.210
   17    HA   PHE   3           HA       PHE   3 -11.303   6.698   6.698
   18   1HB   PHE   3          2HB       PHE   3 -11.838   3.952   3.952
   19   2HB   PHE   3          1HB       PHE   3 -10.242   4.642   4.642
   20    HD1  PHE   3           HD1      PHE   3 -13.353   4.148   4.148
   21    HD2  PHE   3           HD2      PHE   3  -9.065   3.937   3.937
   22    HE1  PHE   3           HE1      PHE   3 -13.288   3.257   3.257
   23    HE2  PHE   3           HE2      PHE   3  -9.009   3.032   3.032
   24    HZ   PHE   3           HZ       PHE   3 -11.122   2.686   2.686
   25    H    SER   4           H        SER   4 -13.652   6.308   6.308
   26    HA   SER   4           HA       SER   4 -12.018   6.304   6.304
   27   1HB   SER   4          2HB       SER   4 -14.590   5.919   5.919
   28   2HB   SER   4          1HB       SER   4 -14.695   7.660   7.660
   29    HG   SER   4           HG       SER   4 -14.058   7.428   7.428
   30    H    GLY   5           H        GLY   5 -10.608   7.820   7.820
   31   1HA   GLY   5          2HA       GLY   5 -11.126  10.413  10.413
   32   2HA   GLY   5          1HA       GLY   5 -10.720  10.564  10.564
   33    H    ASN   6           H        ASN   6  -8.869  11.816  11.816
   34    HA   ASN   6           HA       ASN   6  -6.711   9.971   9.971
   35   1HB   ASN   6          2HB       ASN   6  -7.168  12.952  12.952
   36   2HB   ASN   6          1HB       ASN   6  -5.522  12.321  12.321
   37   1HD2  ASN   6          2HD2      ASN   6  -6.411  10.361  10.361
   38   2HD2  ASN   6          1HD2      ASN   6  -5.747  10.031  10.031
   39    H    TRP   7           H        TRP   7  -4.498  10.531  10.531
   40    HA   TRP   7           HA       TRP   7  -4.854  11.516  11.516
   41   1HB   TRP   7          2HB       TRP   7  -4.056   8.683   8.683
   42   2HB   TRP   7          1HB       TRP   7  -3.920   9.388   9.388
   43    HD1  TRP   7           HD1      TRP   7  -6.350   7.815   7.815
   44    HE1  TRP   7           HE1      TRP   7  -8.729   7.857   7.857
   45    HE3  TRP   7           HE3      TRP   7  -5.530  10.956  10.956
   46    HZ2  TRP   7           HZ2      TRP   7 -10.091   9.113   9.113
   47    HZ3  TRP   7           HZ3      TRP   7  -7.367  11.592  11.592
   48    HH2  TRP   7           HH2      TRP   7  -9.631  10.671  10.671
   49    H    LYS   8           H        LYS   8  -3.141  12.694  12.694
   50    HA   LYS   8           HA       LYS   8  -0.497  11.988  11.988
   51   1HB   LYS   8          2HB       LYS   8  -1.574  14.723  14.723
   52   2HB   LYS   8          1HB       LYS   8   0.081  14.409  14.409
   53   1HG   LYS   8          2HG       LYS   8  -0.806  13.476  13.476
   54   2HG   LYS   8          1HG       LYS   8  -2.434  13.920  13.920
   55   1HD   LYS   8          2HD       LYS   8  -1.837  15.782  15.782
   56   2HD   LYS   8          1HD       LYS   8  -1.361  16.299  16.299
   57   1HE   LYS   8          2HE       LYS   8   0.611  16.759  16.759
   58   2HE   LYS   8          1HE       LYS   8   0.913  15.062  15.062
   59   1HZ   LYS   8          1HZ       LYS   8  -0.208  14.600  14.600
   60   2HZ   LYS   8          3HZ       LYS   8   0.002  16.250  16.250
   61   3HZ   LYS   8          2HZ       LYS   8   1.355  15.263  15.263
   62    H    ILE   9           H        ILE   9   0.689  11.067  11.067
   63    HA   ILE   9           HA       ILE   9   0.194  11.105  11.105
   64    HB   ILE   9           HB       ILE   9   1.579   9.426   9.426
   65   1HG1  ILE   9          2HG1      ILE   9   3.113  11.078  11.078
   66   2HG1  ILE   9          1HG1      ILE   9   1.967   9.788   9.788
   67   1HG2  ILE   9          2HG2      ILE   9   3.470  11.750  11.750
   68   2HG2  ILE   9          1HG2      ILE   9   3.916  10.060  10.060
   69   3HG2  ILE   9          3HG2      ILE   9   2.650  10.782  10.782
   70   1HD1  ILE   9          1HD1      ILE   9   3.600   8.391   8.391
   71   2HD1  ILE   9          3HD1      ILE   9   4.762   9.607   9.607
   72   3HD1  ILE   9          2HD1      ILE   9   3.945   8.590   8.590
   73    H    ILE  10           H        ILE  10   0.891  12.386  12.386
   74    HA   ILE  10           HA       ILE  10   2.506  14.796  14.796
   75    HB   ILE  10           HB       ILE  10   1.231  16.033  16.033
   76   1HG1  ILE  10          2HG1      ILE  10  -1.033  14.554  14.554
   77   2HG1  ILE  10          1HG1      ILE  10   0.222  13.317  13.317
   78   1HG2  ILE  10          2HG2      ILE  10  -0.140  14.674  14.674
   79   2HG2  ILE  10          1HG2      ILE  10  -1.112  15.660  15.660
   80   3HG2  ILE  10          3HG2      ILE  10   0.242  16.381  16.381
   81   1HD1  ILE  10          1HD1      ILE  10   1.507  15.095  15.095
   82   2HD1  ILE  10          3HD1      ILE  10  -0.106  15.757  15.757
   83   3HD1  ILE  10          2HD1      ILE  10   0.255  14.099  14.099
   84    H    ARG  11           H        ARG  11   2.060  12.116  12.116
   85    HA   ARG  11           HA       ARG  11   4.551  12.946  12.946
   86   1HB   ARG  11          2HB       ARG  11   2.077  13.218  13.218
   87   2HB   ARG  11          1HB       ARG  11   2.583  11.628  11.628
   88   1HG   ARG  11          2HG       ARG  11   4.810  12.695  12.695
   89   2HG   ARG  11          1HG       ARG  11   4.049  14.256  14.256
   90   1HD   ARG  11          2HD       ARG  11   2.890  12.201  12.201
   91   2HD   ARG  11          1HD       ARG  11   3.974  13.490  13.490
   92    HE   ARG  11           HE       ARG  11   1.501  14.240  14.240
   93   1HH1  ARG  11          2HH1      ARG  11   2.466  16.579  16.579
   94   2HH1  ARG  11          1HH1      ARG  11   1.941  16.679  16.679
   95   1HH2  ARG  11          1HH2      ARG  11   1.219  13.298  13.298
   96   2HH2  ARG  11          2HH2      ARG  11   1.235  14.822  14.822
   97    H    SER  12           H        SER  12   5.331  11.034  11.034
   98    HA   SER  12           HA       SER  12   4.614   8.348   8.348
   99   1HB   SER  12          2HB       SER  12   4.997   8.422   8.422
  100   2HB   SER  12          1HB       SER  12   6.450   9.397   9.397
  101    HG   SER  12           HG       SER  12   7.466   7.565   7.565
  102    H    GLU  13           H        GLU  13   6.632   6.900   6.900
  103    HA   GLU  13           HA       GLU  13   8.942   8.353   8.353
  104   1HB   GLU  13          2HB       GLU  13   8.506   7.797   7.797
  105   2HB   GLU  13          1HB       GLU  13   7.231   8.822   8.822
  106   1HG   GLU  13          2HG       GLU  13   6.444   6.145   6.145
  107   2HG   GLU  13          1HG       GLU  13   7.017   6.181   6.181
  108    H    ASN  14           H        ASN  14   8.396   5.974   5.974
  109    HA   ASN  14           HA       ASN  14  10.389   4.189   4.189
  110   1HB   ASN  14          2HB       ASN  14   8.185   2.433   2.433
  111   2HB   ASN  14          1HB       ASN  14   9.063   2.585   2.585
  112   1HD2  ASN  14          2HD2      ASN  14   6.142   3.831   3.831
  113   2HD2  ASN  14          1HD2      ASN  14   7.467   2.788   2.788
  114    H    PHE  15           H        PHE  15  10.062   5.756   5.756
  115    HA   PHE  15           HA       PHE  15   9.349   4.058   4.058
  116   1HB   PHE  15          2HB       PHE  15   9.703   6.621   6.621
  117   2HB   PHE  15          1HB       PHE  15  11.415   6.257   6.257
  118    HD1  PHE  15           HD2      PHE  15  10.425   3.573   3.573
  119    HD2  PHE  15           HD1      PHE  15  10.067   7.841   7.841
  120    HE1  PHE  15           HE2      PHE  15  10.211   3.367   3.367
  121    HE2  PHE  15           HE1      PHE  15   9.843   7.616   7.616
  122    HZ   PHE  15           HZ       PHE  15   9.915   5.364   5.364
  123    H    GLU  16           H        GLU  16  12.644   5.119   5.119
  124    HA   GLU  16           HA       GLU  16  14.018   3.133   3.133
  125   1HB   GLU  16          2HB       GLU  16  15.917   3.576   3.576
  126   2HB   GLU  16          1HB       GLU  16  15.214   5.046   5.046
  127   1HG   GLU  16          2HG       GLU  16  14.027   5.526   5.526
  128   2HG   GLU  16          1HG       GLU  16  14.308   3.907   3.907
  129    H    GLU  17           H        GLU  17  12.403   2.972   2.972
  130    HA   GLU  17           HA       GLU  17  13.639   0.616   0.616
  131   1HB   GLU  17          2HB       GLU  17  10.829   1.674   1.674
  132   2HB   GLU  17          1HB       GLU  17  11.639   0.490   0.490
  133   1HG   GLU  17          2HG       GLU  17  13.521   2.313   2.313
  134   2HG   GLU  17          1HG       GLU  17  12.225   3.411   3.411
  135    H    LEU  18           H        LEU  18  10.863   1.124   1.124
  136    HA   LEU  18           HA       LEU  18  10.263  -1.712  -1.712
  137   1HB   LEU  18          2HB       LEU  18   8.806   0.577   0.577
  138   2HB   LEU  18          1HB       LEU  18   9.186   0.027   0.027
  139    HG   LEU  18           HG       LEU  18   8.324  -2.228  -2.228
  140   1HD1  LEU  18          2HD1      LEU  18   8.132  -0.944  -0.944
  141   2HD1  LEU  18          1HD1      LEU  18   6.787  -1.991  -1.991
  142   3HD1  LEU  18          3HD1      LEU  18   8.430  -2.630  -2.630
  143   1HD2  LEU  18          1HD2      LEU  18   6.850   0.108   0.108
  144   2HD2  LEU  18          3HD2      LEU  18   6.287  -1.549  -1.549
  145   3HD2  LEU  18          2HD2      LEU  18   5.974  -0.693  -0.693
  146    H    LEU  19           H        LEU  19  12.484   0.409   0.409
  147    HA   LEU  19           HA       LEU  19  12.602  -1.275  -1.275
  148   1HB   LEU  19          2HB       LEU  19  14.434   1.017   1.017
  149   2HB   LEU  19          1HB       LEU  19  14.259   0.300   0.300
  150    HG   LEU  19           HG       LEU  19  12.388   2.171   2.171
  151   1HD1  LEU  19          1HD1      LEU  19  13.528   1.952   1.952
  152   2HD1  LEU  19          3HD1      LEU  19  12.394   3.202   3.202
  153   3HD1  LEU  19          2HD1      LEU  19  13.992   3.094   3.094
  154   1HD2  LEU  19          3HD2      LEU  19  11.041   0.126   0.126
  155   2HD2  LEU  19          2HD2      LEU  19  10.559   1.642   1.642
  156   3HD2  LEU  19          1HD2      LEU  19  11.541   0.497   0.497
  157    H    LYS  20           H        LYS  20  14.093  -1.011  -1.011
  158    HA   LYS  20           HA       LYS  20  16.516  -2.489  -2.489
  159   1HB   LYS  20          2HB       LYS  20  15.535  -1.985  -1.985
  160   2HB   LYS  20          1HB       LYS  20  17.182  -2.316  -2.316
  161   1HG   LYS  20          2HG       LYS  20  16.184   0.001   0.001
  162   2HG   LYS  20          1HG       LYS  20  15.940   0.218   0.218
  163   1HD   LYS  20          2HD       LYS  20  18.563  -0.556  -0.556
  164   2HD   LYS  20          1HD       LYS  20  18.145   1.063   1.063
  165   1HE   LYS  20          2HE       LYS  20  17.594  -0.355  -0.355
  166   2HE   LYS  20          1HE       LYS  20  18.889  -1.345  -1.345
  167   1HZ   LYS  20          3HZ       LYS  20  20.179   0.763   0.763
  168   2HZ   LYS  20          2HZ       LYS  20  18.977   1.542   1.542
  169   3HZ   LYS  20          1HZ       LYS  20  19.896   0.289   0.289
  170    H    VAL  21           H        VAL  21  13.341  -3.070  -3.070
  171    HA   VAL  21           HA       VAL  21  13.881  -5.813  -5.813
  172    HB   VAL  21           HB       VAL  21  12.117  -4.377  -4.377
  173   1HG1  VAL  21          3HG1      VAL  21  11.400  -3.255  -3.255
  174   2HG1  VAL  21          2HG1      VAL  21  10.605  -4.746  -4.746
  175   3HG1  VAL  21          1HG1      VAL  21  10.061  -3.880  -3.880
  176   1HG2  VAL  21          2HG2      VAL  21  11.120  -6.859  -6.859
  177   2HG2  VAL  21          1HG2      VAL  21  11.968  -6.829  -6.829
  178   3HG2  VAL  21          3HG2      VAL  21  10.356  -6.126  -6.126
  179    H    LEU  22           H        LEU  22  12.370  -4.133  -4.133
  180    HA   LEU  22           HA       LEU  22  11.462  -6.406  -6.406
  181   1HB   LEU  22          2HB       LEU  22  11.883  -3.505  -3.505
  182   2HB   LEU  22          1HB       LEU  22  12.011  -4.453  -4.453
  183    HG   LEU  22           HG       LEU  22   9.782  -5.338  -5.338
  184   1HD1  LEU  22          2HD1      LEU  22   9.921  -5.492  -5.492
  185   2HD1  LEU  22          1HD1      LEU  22   9.618  -3.759  -3.759
  186   3HD1  LEU  22          3HD1      LEU  22   8.399  -4.840  -4.840
  187   1HD2  LEU  22          1HD2      LEU  22  10.331  -2.783  -2.783
  188   2HD2  LEU  22          3HD2      LEU  22   8.681  -3.403  -3.403
  189   3HD2  LEU  22          2HD2      LEU  22   9.325  -2.494  -2.494
  190    H    GLY  23           H        GLY  23  14.278  -4.313  -4.313
  191   1HA   GLY  23          2HA       GLY  23  15.590  -6.370  -6.370
  192   2HA   GLY  23          1HA       GLY  23  16.040  -4.671  -4.671
  193    H    VAL  24           H        VAL  24  18.207  -5.188  -5.188
  194    HA   VAL  24           HA       VAL  24  18.834  -5.706  -5.706
  195    HB   VAL  24           HB       VAL  24  20.134  -7.326  -7.326
  196   1HG1  VAL  24          1HG1      VAL  24  21.225  -6.666  -6.666
  197   2HG1  VAL  24          3HG1      VAL  24  20.233  -8.015  -8.015
  198   3HG1  VAL  24          2HG1      VAL  24  21.446  -8.270  -8.270
  199   1HG2  VAL  24          2HG2      VAL  24  17.951  -8.029  -8.029
  200   2HG2  VAL  24          1HG2      VAL  24  17.877  -8.130  -8.130
  201   3HG2  VAL  24          3HG2      VAL  24  18.902  -9.244  -9.244
  202    H    ASN  25           H        ASN  25  20.072  -5.023  -5.023
  203    HA   ASN  25           HA       ASN  25  22.613  -3.986  -3.986
  204   1HB   ASN  25          2HB       ASN  25  21.304  -4.365  -4.365
  205   2HB   ASN  25          1HB       ASN  25  21.027  -2.640  -2.640
  206   1HD2  ASN  25          2HD2      ASN  25  24.291  -1.790  -1.790
  207   2HD2  ASN  25          1HD2      ASN  25  22.714  -1.271  -1.271
  208    H    VAL  26           H        VAL  26  22.901  -1.396  -1.396
  209    HA   VAL  26           HA       VAL  26  21.171   0.029   0.029
  210    HB   VAL  26           HB       VAL  26  23.158   1.664   1.664
  211   1HG1  VAL  26          2HG1      VAL  26  22.459  -0.456  -0.456
  212   2HG1  VAL  26          1HG1      VAL  26  24.101  -0.918  -0.918
  213   3HG1  VAL  26          3HG1      VAL  26  23.808   0.618   0.618
  214   1HG2  VAL  26          3HG2      VAL  26  24.547  -0.755  -0.755
  215   2HG2  VAL  26          2HG2      VAL  26  24.364   0.816   0.816
  216   3HG2  VAL  26          1HG2      VAL  26  25.356   0.661   0.661
  217    H    MET  27           H        MET  27  22.878   0.409   0.409
  218    HA   MET  27           HA       MET  27  21.755   3.001   3.001
  219   1HB   MET  27          2HB       MET  27  23.790   1.993   1.993
  220   2HB   MET  27          1HB       MET  27  22.699   0.914   0.914
  221   1HG   MET  27          2HG       MET  27  21.649   2.722   2.722
  222   2HG   MET  27          1HG       MET  27  22.353   3.916   3.916
  223   1HE   MET  27          3HE       MET  27  22.098   4.241   4.241
  224   2HE   MET  27          2HE       MET  27  23.635   4.920   4.920
  225   3HE   MET  27          1HE       MET  27  23.091   3.376   3.376
  226    H    LEU  28           H        LEU  28  20.633  -0.281  -0.281
  227    HA   LEU  28           HA       LEU  28  18.623  -0.012  -0.012
  228   1HB   LEU  28          2HB       LEU  28  19.272  -1.825  -1.825
  229   2HB   LEU  28          1HB       LEU  28  17.564  -1.789  -1.789
  230    HG   LEU  28           HG       LEU  28  18.744  -3.528  -3.528
  231   1HD1  LEU  28          3HD1      LEU  28  16.877  -1.977  -1.977
  232   2HD1  LEU  28          2HD1      LEU  28  18.186  -1.339  -1.339
  233   3HD1  LEU  28          1HD1      LEU  28  17.766  -3.050  -3.050
  234   1HD2  LEU  28          2HD2      LEU  28  20.938  -2.154  -2.154
  235   2HD2  LEU  28          1HD2      LEU  28  20.585  -3.072  -3.072
  236   3HD2  LEU  28          3HD2      LEU  28  20.296  -1.333  -1.333
  237    H    ARG  29           H        ARG  29  18.422   0.537   0.537
  238    HA   ARG  29           HA       ARG  29  15.631   1.207   1.207
  239   1HB   ARG  29          2HB       ARG  29  17.734   2.181   2.181
  240   2HB   ARG  29          1HB       ARG  29  16.007   2.003   2.003
  241   1HG   ARG  29          2HG       ARG  29  16.286  -0.149  -0.149
  242   2HG   ARG  29          1HG       ARG  29  17.065  -0.515  -0.515
  243   1HD   ARG  29          2HD       ARG  29  18.511  -0.970  -0.970
  244   2HD   ARG  29          1HD       ARG  29  19.221   0.161   0.161
  245    HE   ARG  29           HE       ARG  29  17.713   1.317   1.317
  246   1HH1  ARG  29          2HH1      ARG  29  19.111   3.430   3.430
  247   2HH1  ARG  29          1HH1      ARG  29  20.733   3.287   3.287
  248   1HH2  ARG  29          1HH2      ARG  29  20.493  -0.117  -0.117
  249   2HH2  ARG  29          2HH2      ARG  29  21.516   1.280   1.280
  250    H    LYS  30           H        LYS  30  18.580   3.169   3.169
  251    HA   LYS  30           HA       LYS  30  17.318   5.712   5.712
  252   1HB   LYS  30          2HB       LYS  30  19.798   5.254   5.254
  253   2HB   LYS  30          1HB       LYS  30  19.819   5.061   5.061
  254   1HG   LYS  30          2HG       LYS  30  19.484   7.300   7.300
  255   2HG   LYS  30          1HG       LYS  30  18.512   7.516   7.516
  256   1HD   LYS  30          2HD       LYS  30  20.684   7.133   7.133
  257   2HD   LYS  30          1HD       LYS  30  21.521   7.352   7.352
  258   1HE   LYS  30          2HE       LYS  30  21.504   9.537   9.537
  259   2HE   LYS  30          1HE       LYS  30  20.017   9.520   9.520
  260   1HZ   LYS  30          1HZ       LYS  30  18.974   8.727   8.727
  261   2HZ   LYS  30          3HZ       LYS  30  20.358   9.403   9.403
  262   3HZ   LYS  30          2HZ       LYS  30  19.316  10.377  10.377
  263    H    ILE  31           H        ILE  31  17.516   3.423   3.423
  264    HA   ILE  31           HA       ILE  31  16.870   5.406   5.406
  265    HB   ILE  31           HB       ILE  31  16.707   2.371   2.371
  266   1HG1  ILE  31          2HG1      ILE  31  18.813   4.044   4.044
  267   2HG1  ILE  31          1HG1      ILE  31  18.975   3.672   3.672
  268   1HG2  ILE  31          3HG2      ILE  31  16.501   4.517   4.517
  269   2HG2  ILE  31          2HG2      ILE  31  16.854   2.832   2.832
  270   3HG2  ILE  31          1HG2      ILE  31  15.323   3.262   3.262
  271   1HD1  ILE  31          1HD1      ILE  31  18.279   1.408   1.408
  272   2HD1  ILE  31          3HD1      ILE  31  19.923   2.037   2.037
  273   3HD1  ILE  31          2HD1      ILE  31  19.310   1.429   1.429
  274    H    ALA  32           H        ALA  32  15.114   3.292   3.292
  275    HA   ALA  32           HA       ALA  32  12.560   3.670   3.670
  276   1HB   ALA  32          2HB       ALA  32  13.597   1.953   1.953
  277   2HB   ALA  32          1HB       ALA  32  12.113   2.725   2.725
  278   3HB   ALA  32          3HB       ALA  32  12.112   1.782   1.782
  279    H    VAL  33           H        VAL  33  14.392   5.215   5.215
  280    HA   VAL  33           HA       VAL  33  12.143   6.689   6.689
  281    HB   VAL  33           HB       VAL  33  15.064   7.427   7.427
  282   1HG1  VAL  33          3HG1      VAL  33  13.232   8.922   8.922
  283   2HG1  VAL  33          2HG1      VAL  33  12.768   7.611   7.611
  284   3HG1  VAL  33          1HG1      VAL  33  14.360   8.354   8.354
  285   1HG2  VAL  33          2HG2      VAL  33  13.851   4.926   4.926
  286   2HG2  VAL  33          1HG2      VAL  33  15.503   5.468   5.468
  287   3HG2  VAL  33          3HG2      VAL  33  14.246   5.824   5.824
  288    H    ALA  34           H        ALA  34  14.748   7.240   7.240
  289    HA   ALA  34           HA       ALA  34  14.075  10.020  10.020
  290   1HB   ALA  34          3HB       ALA  34  15.805   7.996   7.996
  291   2HB   ALA  34          2HB       ALA  34  15.556   9.624   9.624
  292   3HB   ALA  34          1HB       ALA  34  16.327   9.395   9.395
  293    H    ALA  35           H        ALA  35  13.305   6.907   6.907
  294    HA   ALA  35           HA       ALA  35  11.937   7.883   7.883
  295   1HB   ALA  35          3HB       ALA  35  11.903   5.286   5.286
  296   2HB   ALA  35          2HB       ALA  35  10.841   5.542   5.542
  297   3HB   ALA  35          1HB       ALA  35  12.591   5.602   5.602
  298    H    ALA  36           H        ALA  36  10.929   7.108   7.108
  299    HA   ALA  36           HA       ALA  36   8.116   7.385   7.385
  300   1HB   ALA  36          1HB       ALA  36   9.943   7.147   7.147
  301   2HB   ALA  36          3HB       ALA  36   8.463   8.046   8.046
  302   3HB   ALA  36          2HB       ALA  36   8.373   6.392   6.392
  303    H    SER  37           H        SER  37  10.259   9.592   9.592
  304    HA   SER  37           HA       SER  37  10.094  11.920  11.920
  305   1HB   SER  37          2HB       SER  37  10.689  11.533  11.533
  306   2HB   SER  37          1HB       SER  37   9.086  12.221  12.221
  307    HG   SER  37           HG       SER  37   9.743  14.027  14.027
  308    H    LYS  38           H        LYS  38   7.909  10.677  10.677
  309    HA   LYS  38           HA       LYS  38   5.698  11.086  11.086
  310   1HB   LYS  38          2HB       LYS  38   5.780  13.603  13.603
  311   2HB   LYS  38          1HB       LYS  38   4.751  13.272  13.272
  312   1HG   LYS  38          2HG       LYS  38   7.773  13.428  13.428
  313   2HG   LYS  38          1HG       LYS  38   6.706  14.791  14.791
  314   1HD   LYS  38          2HD       LYS  38   6.313  12.146  12.146
  315   2HD   LYS  38          1HD       LYS  38   7.480  13.321  13.321
  316   1HE   LYS  38          2HE       LYS  38   4.656  14.158  14.158
  317   2HE   LYS  38          1HE       LYS  38   5.046  13.410  13.410
  318   1HZ   LYS  38          2HZ       LYS  38   6.350  15.828  15.828
  319   2HZ   LYS  38          1HZ       LYS  38   5.195  15.819  15.819
  320   3HZ   LYS  38          3HZ       LYS  38   6.716  15.111  15.111
  321    HA   PRO  39           HA       PRO  39   4.624   9.471   9.471
  322   1HB   PRO  39          2HB       PRO  39   3.790   6.999   6.999
  323   2HB   PRO  39          1HB       PRO  39   5.442   7.371   7.371
  324   1HG   PRO  39          2HG       PRO  39   4.367   7.008   7.008
  325   2HG   PRO  39          1HG       PRO  39   6.010   6.745   6.745
  326   1HD   PRO  39          2HD       PRO  39   5.165   8.978   8.978
  327   2HD   PRO  39          1HD       PRO  39   6.660   8.875   8.875
  328    H    ALA  40           H        ALA  40   2.530   9.381   9.381
  329    HA   ALA  40           HA       ALA  40   0.370  10.200  10.200
  330   1HB   ALA  40          3HB       ALA  40   0.846  11.404  11.404
  331   2HB   ALA  40          2HB       ALA  40   0.254   9.964   9.964
  332   3HB   ALA  40          1HB       ALA  40  -0.825  10.885  10.885
  333    H    VAL  41           H        VAL  41  -1.869   9.265   9.265
  334    HA   VAL  41           HA       VAL  41  -1.815   6.470   6.470
  335    HB   VAL  41           HB       VAL  41  -2.349   7.345   7.345
  336   1HG1  VAL  41          1HG1      VAL  41  -3.237   4.755   4.755
  337   2HG1  VAL  41          3HG1      VAL  41  -3.245   5.062   5.062
  338   3HG1  VAL  41          2HG1      VAL  41  -4.293   5.998   5.998
  339   1HG2  VAL  41          2HG2      VAL  41  -0.627   5.270   5.270
  340   2HG2  VAL  41          1HG2      VAL  41  -0.112   6.633   6.633
  341   3HG2  VAL  41          3HG2      VAL  41  -0.932   5.260   5.260
  342    H    GLU  42           H        GLU  42  -4.102   5.631   5.631
  343    HA   GLU  42           HA       GLU  42  -6.207   7.711   7.711
  344   1HB   GLU  42          2HB       GLU  42  -5.280   7.952   7.952
  345   2HB   GLU  42          1HB       GLU  42  -5.438   6.211   6.211
  346   1HG   GLU  42          2HG       GLU  42  -7.917   6.454   6.454
  347   2HG   GLU  42          1HG       GLU  42  -7.692   8.200   8.200
  348    H    ILE  43           H        ILE  43  -7.711   6.702   6.702
  349    HA   ILE  43           HA       ILE  43  -8.026   3.759   3.759
  350    HB   ILE  43           HB       ILE  43  -8.904   5.766   5.766
  351   1HG1  ILE  43          2HG1      ILE  43  -7.366   3.429   3.429
  352   2HG1  ILE  43          1HG1      ILE  43  -6.521   4.323   4.323
  353   1HG2  ILE  43          3HG2      ILE  43  -9.761   2.936   2.936
  354   2HG2  ILE  43          2HG2      ILE  43  -9.468   3.461   3.461
  355   3HG2  ILE  43          1HG2      ILE  43 -10.670   4.291   4.291
  356   1HD1  ILE  43          3HD1      ILE  43  -7.703   6.104   6.104
  357   2HD1  ILE  43          2HD1      ILE  43  -6.566   4.961   4.961
  358   3HD1  ILE  43          1HD1      ILE  43  -6.043   6.020   6.020
  359    H    LYS  44           H        LYS  44  -9.908   2.829   2.829
  360    HA   LYS  44           HA       LYS  44 -12.136   4.626   4.626
  361   1HB   LYS  44          2HB       LYS  44 -11.946   1.967   1.967
  362   2HB   LYS  44          1HB       LYS  44 -12.342   3.531   3.531
  363   1HG   LYS  44          2HG       LYS  44  -9.948   4.138   4.138
  364   2HG   LYS  44          1HG       LYS  44  -9.544   2.601   2.601
  365   1HD   LYS  44          2HD       LYS  44  -9.936   1.392   1.392
  366   2HD   LYS  44          1HD       LYS  44 -11.180   2.505   2.505
  367   1HE   LYS  44          2HE       LYS  44  -9.046   4.153   4.153
  368   2HE   LYS  44          1HE       LYS  44  -8.231   2.613   2.613
  369   1HZ   LYS  44          1HZ       LYS  44 -10.603   3.547   3.547
  370   2HZ   LYS  44          3HZ       LYS  44  -9.002   3.690   3.690
  371   3HZ   LYS  44          2HZ       LYS  44  -9.683   2.151   2.151
  372    H    GLN  45           H        GLN  45 -13.822   4.285   4.285
  373    HA   GLN  45           HA       GLN  45 -13.990   1.636   1.636
  374   1HB   GLN  45          2HB       GLN  45 -14.020   3.617   3.617
  375   2HB   GLN  45          1HB       GLN  45 -15.439   4.234   4.234
  376   1HG   GLN  45          2HG       GLN  45 -16.794   2.402   2.402
  377   2HG   GLN  45          1HG       GLN  45 -15.391   1.533   1.533
  378   1HE2  GLN  45          2HE2      GLN  45 -16.260   2.914   2.914
  379   2HE2  GLN  45          1HE2      GLN  45 -16.184   1.503   1.503
  380    H    GLU  46           H        GLU  46 -15.220   0.175   0.175
  381    HA   GLU  46           HA       GLU  46 -17.798   1.112   1.112
  382   1HB   GLU  46          2HB       GLU  46 -16.070  -1.272  -1.272
  383   2HB   GLU  46          1HB       GLU  46 -17.650  -0.918  -0.918
  384   1HG   GLU  46          2HG       GLU  46 -16.490   1.469   1.469
  385   2HG   GLU  46          1HG       GLU  46 -15.040   0.463   0.463
  386    H    GLY  47           H        GLY  47 -17.728   0.687   0.687
  387   1HA   GLY  47          2HA       GLY  47 -19.299  -0.419  -0.419
  388   2HA   GLY  47          1HA       GLY  47 -19.406  -1.745  -1.745
  389    H    ASP  48           H        ASP  48 -18.582  -3.564  -3.564
  390    HA   ASP  48           HA       ASP  48 -16.537  -3.456  -3.456
  391   1HB   ASP  48          2HB       ASP  48 -16.499  -5.992  -5.992
  392   2HB   ASP  48          1HB       ASP  48 -18.004  -5.314  -5.314
  393    H    THR  49           H        THR  49 -16.311  -3.099  -3.099
  394    HA   THR  49           HA       THR  49 -13.745  -4.551  -4.551
  395    HB   THR  49           HB       THR  49 -15.655  -3.280  -3.280
  396    HG1  THR  49           HG1      THR  49 -16.083  -5.359  -5.359
  397   1HG2  THR  49          3HG2      THR  49 -12.802  -4.119  -4.119
  398   2HG2  THR  49          2HG2      THR  49 -14.028  -3.781  -3.781
  399   3HG2  THR  49          1HG2      THR  49 -13.470  -2.494  -2.494
  400    H    PHE  50           H        PHE  50 -11.815  -3.465  -3.465
  401    HA   PHE  50           HA       PHE  50 -11.898  -0.494  -0.494
  402   1HB   PHE  50          2HB       PHE  50 -10.378  -2.169  -2.169
  403   2HB   PHE  50          1HB       PHE  50 -10.164  -0.428  -0.428
  404    HD1  PHE  50           HD2      PHE  50 -12.123   1.115   1.115
  405    HD2  PHE  50           HD1      PHE  50 -12.257  -3.035  -3.035
  406    HE1  PHE  50           HE2      PHE  50 -14.142   1.530   1.530
  407    HE2  PHE  50           HE1      PHE  50 -14.275  -2.627  -2.627
  408    HZ   PHE  50           HZ       PHE  50 -15.229  -0.349  -0.349
  409    H    TYR  51           H        TYR  51 -10.689   0.129   0.129
  410    HA   TYR  51           HA       TYR  51  -8.449  -1.584  -1.584
  411   1HB   TYR  51          2HB       TYR  51 -10.259  -1.034  -1.034
  412   2HB   TYR  51          1HB       TYR  51  -9.969   0.679   0.679
  413    HD1  TYR  51           HD1      TYR  51  -7.471   1.470   1.470
  414    HD2  TYR  51           HD2      TYR  51  -9.188  -2.101  -2.101
  415    HE1  TYR  51           HE1      TYR  51  -5.768   1.479   1.479
  416    HE2  TYR  51           HE2      TYR  51  -7.491  -2.087  -2.087
  417    HH   TYR  51           HH       TYR  51  -5.884   0.329   0.329
  418    H    ILE  52           H        ILE  52  -6.373  -0.789  -0.789
  419    HA   ILE  52           HA       ILE  52  -6.114   2.049   2.049
  420    HB   ILE  52           HB       ILE  52  -3.877   0.143   0.143
  421   1HG1  ILE  52          2HG1      ILE  52  -5.939  -1.147  -1.147
  422   2HG1  ILE  52          1HG1      ILE  52  -4.836  -0.808  -0.808
  423   1HG2  ILE  52          3HG2      ILE  52  -5.146   2.455   2.455
  424   2HG2  ILE  52          2HG2      ILE  52  -3.838   1.490   1.490
  425   3HG2  ILE  52          1HG2      ILE  52  -3.574   2.410   2.410
  426   1HD1  ILE  52          3HD1      ILE  52  -7.008   1.167   1.167
  427   2HD1  ILE  52          2HD1      ILE  52  -7.468  -0.378  -0.378
  428   3HD1  ILE  52          1HD1      ILE  52  -6.298   0.658   0.658
  429    H    LYS  53           H        LYS  53  -4.727   3.359   3.359
  430    HA   LYS  53           HA       LYS  53  -3.120   1.995   1.995
  431   1HB   LYS  53          2HB       LYS  53  -5.412   3.275   3.275
  432   2HB   LYS  53          1HB       LYS  53  -4.334   4.667   4.667
  433   1HG   LYS  53          2HG       LYS  53  -2.773   3.106   3.106
  434   2HG   LYS  53          1HG       LYS  53  -4.289   2.281   2.281
  435   1HD   LYS  53          2HD       LYS  53  -5.278   4.379   4.379
  436   2HD   LYS  53          1HD       LYS  53  -3.808   5.254   5.254
  437   1HE   LYS  53          2HE       LYS  53  -2.645   4.465   4.465
  438   2HE   LYS  53          1HE       LYS  53  -3.458   2.901   2.901
  439   1HZ   LYS  53          3HZ       LYS  53  -5.500   4.218   4.218
  440   2HZ   LYS  53          2HZ       LYS  53  -4.405   5.452   5.452
  441   3HZ   LYS  53          1HZ       LYS  53  -4.290   3.930   3.930
  442    H    THR  54           H        THR  54  -1.114   2.400   2.400
  443    HA   THR  54           HA       THR  54  -0.565   5.170   5.170
  444    HB   THR  54           HB       THR  54   1.224   2.744   2.744
  445    HG1  THR  54           HG1      THR  54  -0.101   2.082   2.082
  446   1HG2  THR  54          3HG2      THR  54   1.671   5.449   5.449
  447   2HG2  THR  54          2HG2      THR  54   1.281   4.782   4.782
  448   3HG2  THR  54          1HG2      THR  54   2.609   4.104   4.104
  449    H    SER  55           H        SER  55   1.105   6.408   6.408
  450    HA   SER  55           HA       SER  55   2.625   5.239   5.239
  451   1HB   SER  55          2HB       SER  55   1.958   7.619   7.619
  452   2HB   SER  55          1HB       SER  55   1.091   6.116   6.116
  453    HG   SER  55           HG       SER  55   0.109   8.306   8.306
  454    H    THR  56           H        THR  56   4.644   6.074   6.074
  455    HA   THR  56           HA       THR  56   5.381   8.252   8.252
  456    HB   THR  56           HB       THR  56   7.759   7.239   7.239
  457    HG1  THR  56           HG1      THR  56   7.660   5.307   5.307
  458   1HG2  THR  56          2HG2      THR  56   6.753   7.235   7.235
  459   2HG2  THR  56          1HG2      THR  56   5.800   5.817   5.817
  460   3HG2  THR  56          3HG2      THR  56   7.559   5.706   5.706
  461    H    THR  57           H        THR  57   6.650   7.005   7.005
  462    HA   THR  57           HA       THR  57   6.196   9.307   9.307
  463    HB   THR  57           HB       THR  57   7.756  10.482  10.482
  464    HG1  THR  57           HG1      THR  57   8.124  11.030  11.030
  465   1HG2  THR  57          2HG2      THR  57   8.808   8.394   8.394
  466   2HG2  THR  57          1HG2      THR  57   9.744   8.274   8.274
  467   3HG2  THR  57          3HG2      THR  57   9.968   9.656   9.656
  468    H    VAL  58           H        VAL  58   8.438   6.729   6.729
  469    HA   VAL  58           HA       VAL  58   8.538   5.924   5.924
  470    HB   VAL  58           HB       VAL  58  10.505   5.271   5.271
  471   1HG1  VAL  58          2HG1      VAL  58  10.232   4.517   4.517
  472   2HG1  VAL  58          1HG1      VAL  58  11.853   4.753   4.753
  473   3HG1  VAL  58          3HG1      VAL  58  10.784   3.543   3.543
  474   1HG2  VAL  58          1HG2      VAL  58  10.228   7.714   7.714
  475   2HG2  VAL  58          3HG2      VAL  58  11.793   7.056   7.056
  476   3HG2  VAL  58          2HG2      VAL  58  11.266   6.948   6.948
  477    H    ARG  59           H        ARG  59   7.317   5.121   5.121
  478    HA   ARG  59           HA       ARG  59   6.845   2.310   2.310
  479   1HB   ARG  59          2HB       ARG  59   8.384   2.476   2.476
  480   2HB   ARG  59          1HB       ARG  59   7.105   3.313   3.313
  481   1HG   ARG  59          2HG       ARG  59   5.730   1.418   1.418
  482   2HG   ARG  59          1HG       ARG  59   6.544   0.656   0.656
  483   1HD   ARG  59          2HD       ARG  59   8.210   1.205   1.205
  484   2HD   ARG  59          1HD       ARG  59   7.016  -0.085  -0.085
  485    HE   ARG  59           HE       ARG  59   8.192  -1.309  -1.309
  486   1HH1  ARG  59          2HH1      ARG  59   9.241   0.182   0.182
  487   2HH1  ARG  59          1HH1      ARG  59  10.873   0.571   0.571
  488   1HH2  ARG  59          1HH2      ARG  59  10.434  -0.124  -0.124
  489   2HH2  ARG  59          2HH2      ARG  59  11.549   0.398   0.398
  490    H    THR  60           H        THR  60   4.777   1.419   1.419
  491    HA   THR  60           HA       THR  60   2.782   3.288   3.288
  492    HB   THR  60           HB       THR  60   2.372   2.125   2.125
  493    HG1  THR  60           HG1      THR  60   2.818   4.161   4.161
  494   1HG2  THR  60          1HG2      THR  60   0.795   3.807   3.807
  495   2HG2  THR  60          3HG2      THR  60   0.629   4.138   4.138
  496   3HG2  THR  60          2HG2      THR  60   0.246   2.537   2.537
  497    H    THR  61           H        THR  61   2.070   1.847   1.847
  498    HA   THR  61           HA       THR  61   1.650  -0.993  -0.993
  499    HB   THR  61           HB       THR  61   0.833  -0.850  -0.850
  500    HG1  THR  61           HG1      THR  61   1.908   0.704   0.704
  501   1HG2  THR  61          3HG2      THR  61   3.521  -1.219  -1.219
  502   2HG2  THR  61          2HG2      THR  61   3.387  -1.257  -1.257
  503   3HG2  THR  61          1HG2      THR  61   2.483  -2.413  -2.413
  504    H    GLU  62           H        GLU  62  -0.429  -2.014  -2.014
  505    HA   GLU  62           HA       GLU  62  -2.778  -0.268  -0.268
  506   1HB   GLU  62          2HB       GLU  62  -2.066  -1.570  -1.570
  507   2HB   GLU  62          1HB       GLU  62  -3.749  -1.315  -1.315
  508   1HG   GLU  62          2HG       GLU  62  -3.530   0.784   0.784
  509   2HG   GLU  62          1HG       GLU  62  -2.515   1.124   1.124
  510    H    ILE  63           H        ILE  63  -3.539  -1.533  -1.533
  511    HA   ILE  63           HA       ILE  63  -3.833  -4.464  -4.464
  512    HB   ILE  63           HB       ILE  63  -4.016  -4.801  -4.801
  513   1HG1  ILE  63          2HG1      ILE  63  -3.940  -1.775  -1.775
  514   2HG1  ILE  63          1HG1      ILE  63  -5.376  -2.775  -2.775
  515   1HG2  ILE  63          2HG2      ILE  63  -1.756  -4.398  -4.398
  516   2HG2  ILE  63          1HG2      ILE  63  -1.857  -2.733  -2.733
  517   3HG2  ILE  63          3HG2      ILE  63  -1.838  -4.064  -4.064
  518   1HD1  ILE  63          2HD1      ILE  63  -3.662  -4.089  -4.089
  519   2HD1  ILE  63          1HD1      ILE  63  -3.053  -2.442  -2.442
  520   3HD1  ILE  63          3HD1      ILE  63  -4.736  -2.802  -2.802
  521    H    ASN  64           H        ASN  64  -5.918  -5.429  -5.429
  522    HA   ASN  64           HA       ASN  64  -8.246  -3.675  -3.675
  523   1HB   ASN  64          2HB       ASN  64  -9.444  -4.670  -4.670
  524   2HB   ASN  64          1HB       ASN  64  -8.082  -3.651  -3.651
  525   1HD2  ASN  64          2HD2      ASN  64  -6.042  -6.434  -6.434
  526   2HD2  ASN  64          1HD2      ASN  64  -5.933  -4.923  -4.923
  527    H    PHE  65           H        PHE  65  -9.749  -4.742  -4.742
  528    HA   PHE  65           HA       PHE  65  -9.997  -7.669  -7.669
  529   1HB   PHE  65          2HB       PHE  65  -9.244  -8.079  -8.079
  530   2HB   PHE  65          1HB       PHE  65  -7.946  -7.350  -7.350
  531    HD1  PHE  65           HD2      PHE  65  -7.415  -4.908  -4.908
  532    HD2  PHE  65           HD1      PHE  65 -10.262  -6.932  -6.932
  533    HE1  PHE  65           HE2      PHE  65  -7.344  -3.021  -3.021
  534    HE2  PHE  65           HE1      PHE  65 -10.202  -5.053  -5.053
  535    HZ   PHE  65           HZ       PHE  65  -8.746  -3.092  -3.092
  536    H    LYS  66           H        LYS  66 -11.203  -8.316  -8.316
  537    HA   LYS  66           HA       LYS  66 -13.418  -6.373  -6.373
  538   1HB   LYS  66          2HB       LYS  66 -14.908  -8.446  -8.446
  539   2HB   LYS  66          1HB       LYS  66 -14.431  -8.019  -8.019
  540   1HG   LYS  66          2HG       LYS  66 -12.507  -9.654  -9.654
  541   2HG   LYS  66          1HG       LYS  66 -13.240 -10.182 -10.182
  542   1HD   LYS  66          2HD       LYS  66 -14.925 -11.302 -11.302
  543   2HD   LYS  66          1HD       LYS  66 -15.095 -10.068 -10.068
  544   1HE   LYS  66          2HE       LYS  66 -12.622 -11.096 -11.096
  545   2HE   LYS  66          1HE       LYS  66 -13.466 -12.527 -12.527
  546   1HZ   LYS  66          1HZ       LYS  66 -15.345 -11.741 -11.741
  547   2HZ   LYS  66          3HZ       LYS  66 -14.163 -10.781 -10.781
  548   3HZ   LYS  66          2HZ       LYS  66 -13.987 -12.470 -12.470
  549    H    VAL  67           H        VAL  67 -14.335  -6.618  -6.618
  550    HA   VAL  67           HA       VAL  67 -12.247  -7.485  -7.485
  551    HB   VAL  67           HB       VAL  67 -14.851  -6.733  -6.733
  552   1HG1  VAL  67          2HG1      VAL  67 -11.971  -5.838  -5.838
  553   2HG1  VAL  67          1HG1      VAL  67 -13.292  -5.195  -5.195
  554   3HG1  VAL  67          3HG1      VAL  67 -12.869  -6.904  -6.904
  555   1HG2  VAL  67          3HG2      VAL  67 -13.380  -4.868  -4.868
  556   2HG2  VAL  67          2HG2      VAL  67 -15.115  -5.155  -5.155
  557   3HG2  VAL  67          1HG2      VAL  67 -14.280  -4.252  -4.252
  558    H    GLY  68           H        GLY  68 -12.164  -9.749  -9.749
  559   1HA   GLY  68          2HA       GLY  68 -13.418 -11.392 -11.392
  560   2HA   GLY  68          1HA       GLY  68 -14.697 -11.232 -11.232
  561    H    GLU  69           H        GLU  69 -12.851 -11.115 -11.115
  562    HA   GLU  69           HA       GLU  69 -12.079 -14.008 -14.008
  563   1HB   GLU  69          2HB       GLU  69 -12.909 -12.120 -12.120
  564   2HB   GLU  69          1HB       GLU  69 -12.216 -13.710 -13.710
  565   1HG   GLU  69          2HG       GLU  69 -14.297 -14.002 -14.002
  566   2HG   GLU  69          1HG       GLU  69 -14.933 -13.062 -13.062
  567    H    GLU  70           H        GLU  70 -10.074 -14.592 -14.592
  568    HA   GLU  70           HA       GLU  70  -7.969 -12.569 -12.569
  569   1HB   GLU  70          2HB       GLU  70  -7.727 -15.439 -15.439
  570   2HB   GLU  70          1HB       GLU  70  -6.418 -14.412 -14.412
  571   1HG   GLU  70          2HG       GLU  70  -7.133 -14.527 -14.527
  572   2HG   GLU  70          1HG       GLU  70  -8.795 -14.910 -14.910
  573    H    PHE  71           H        PHE  71  -6.256 -12.382 -12.382
  574    HA   PHE  71           HA       PHE  71  -7.136 -12.905 -12.905
  575   1HB   PHE  71          2HB       PHE  71  -7.152 -10.476 -10.476
  576   2HB   PHE  71          1HB       PHE  71  -8.476 -10.924 -10.924
  577    HD1  PHE  71           HD2      PHE  71  -8.184 -10.529 -10.529
  578    HD2  PHE  71           HD1      PHE  71  -5.585  -8.825  -8.825
  579    HE1  PHE  71           HE2      PHE  71  -7.392  -8.859  -8.859
  580    HE2  PHE  71           HE1      PHE  71  -4.794  -7.154  -7.154
  581    HZ   PHE  71           HZ       PHE  71  -5.695  -7.168  -7.168
  582    H    GLU  72           H        GLU  72  -5.552 -11.743 -11.743
  583    HA   GLU  72           HA       GLU  72  -2.839 -11.895 -11.895
  584   1HB   GLU  72          2HB       GLU  72  -3.288 -11.777 -11.777
  585   2HB   GLU  72          1HB       GLU  72  -1.953 -12.488 -12.488
  586   1HG   GLU  72          2HG       GLU  72  -3.537 -14.234 -14.234
  587   2HG   GLU  72          1HG       GLU  72  -4.769 -13.586 -13.586
  588    H    GLU  73           H        GLU  73  -1.432 -10.151 -10.151
  589    HA   GLU  73           HA       GLU  73  -2.158  -7.805  -7.805
  590   1HB   GLU  73          2HB       GLU  73  -2.240  -6.278  -6.278
  591   2HB   GLU  73          1HB       GLU  73  -3.605  -7.393  -7.393
  592   1HG   GLU  73          2HG       GLU  73  -2.944  -8.537  -8.537
  593   2HG   GLU  73          1HG       GLU  73  -1.231  -8.397  -8.397
  594    H    GLN  74           H        GLN  74  -0.552  -5.934  -5.934
  595    HA   GLN  74           HA       GLN  74   2.133  -7.260  -7.260
  596   1HB   GLN  74          2HB       GLN  74   1.146  -4.553  -4.553
  597   2HB   GLN  74          1HB       GLN  74   2.852  -4.793  -4.793
  598   1HG   GLN  74          2HG       GLN  74   2.646  -6.889  -6.889
  599   2HG   GLN  74          1HG       GLN  74   1.207  -6.076  -6.076
  600   1HE2  GLN  74          2HE2      GLN  74   4.798  -4.113  -4.113
  601   2HE2  GLN  74          1HE2      GLN  74   4.550  -5.025  -5.025
  602    H    THR  75           H        THR  75   3.759  -6.414  -6.414
  603    HA   THR  75           HA       THR  75   2.528  -5.537  -5.537
  604    HB   THR  75           HB       THR  75   4.141  -7.502  -7.502
  605    HG1  THR  75           HG1      THR  75   4.541  -7.159  -7.159
  606   1HG2  THR  75          1HG2      THR  75   5.813  -5.517  -5.517
  607   2HG2  THR  75          3HG2      THR  75   6.547  -6.006  -6.006
  608   3HG2  THR  75          2HG2      THR  75   6.180  -7.214  -7.214
  609    H    VAL  76           H        VAL  76   5.067  -4.266  -4.266
  610    HA   VAL  76           HA       VAL  76   4.619  -1.648  -1.648
  611    HB   VAL  76           HB       VAL  76   4.358  -1.844  -1.844
  612   1HG1  VAL  76          1HG1      VAL  76   6.568  -3.477  -3.477
  613   2HG1  VAL  76          3HG1      VAL  76   7.252  -1.982  -1.982
  614   3HG1  VAL  76          2HG1      VAL  76   5.916  -2.768  -2.768
  615   1HG2  VAL  76          2HG2      VAL  76   5.452   0.191   0.191
  616   2HG2  VAL  76          1HG2      VAL  76   5.249   0.246   0.246
  617   3HG2  VAL  76          3HG2      VAL  76   6.813  -0.182  -0.182
  618    H    ASP  77           H        ASP  77   7.049  -4.121  -4.121
  619    HA   ASP  77           HA       ASP  77   9.226  -2.318  -2.318
  620   1HB   ASP  77          2HB       ASP  77   9.314  -4.493  -4.493
  621   2HB   ASP  77          1HB       ASP  77   9.515  -5.282  -5.282
  622    H    GLY  78           H        GLY  78   7.560  -5.158  -5.158
  623   1HA   GLY  78          2HA       GLY  78   6.897  -4.527  -4.527
  624   2HA   GLY  78          1HA       GLY  78   8.649  -4.549  -4.549
  625    H    ARG  79           H        ARG  79   6.560  -6.684  -6.684
  626    HA   ARG  79           HA       ARG  79   7.438  -8.970  -8.970
  627   1HB   ARG  79          2HB       ARG  79   7.560  -8.584  -8.584
  628   2HB   ARG  79          1HB       ARG  79   7.321 -10.199 -10.199
  629   1HG   ARG  79          2HG       ARG  79   9.464  -8.614  -8.614
  630   2HG   ARG  79          1HG       ARG  79   9.772  -9.081  -9.081
  631   1HD   ARG  79          2HD       ARG  79   8.755 -11.121 -11.121
  632   2HD   ARG  79          1HD       ARG  79  10.470 -10.714 -10.714
  633    HE   ARG  79           HE       ARG  79   8.985 -11.779 -11.779
  634   1HH1  ARG  79          1HH2      ARG  79  11.653 -10.514 -10.514
  635   2HH1  ARG  79          2HH2      ARG  79  12.723 -11.873 -11.873
  636   1HH2  ARG  79          2HH1      ARG  79  10.421 -13.915 -13.915
  637   2HH2  ARG  79          1HH1      ARG  79  12.025 -13.798 -13.798
  638    HA   PRO  80           HA       PRO  80   3.101  -9.882  -9.882
  639   1HB   PRO  80          2HB       PRO  80   3.175 -12.566 -12.566
  640   2HB   PRO  80          1HB       PRO  80   3.439 -11.282 -11.282
  641   1HG   PRO  80          2HG       PRO  80   5.425 -13.111 -13.111
  642   2HG   PRO  80          1HG       PRO  80   5.498 -12.285 -12.285
  643   1HD   PRO  80          2HD       PRO  80   6.848 -11.498 -11.498
  644   2HD   PRO  80          1HD       PRO  80   6.656 -10.519 -10.519
  645    H    CYS  81           H        CYS  81   1.608 -10.576 -10.576
  646    HA   CYS  81           HA       CYS  81   2.174 -12.745 -12.745
  647   1HB   CYS  81          2HB       CYS  81   1.898 -11.248 -11.248
  648   2HB   CYS  81          1HB       CYS  81   3.430 -11.058 -11.058
  649    HG   CYS  81           HG       CYS  81   2.437  -8.872  -8.872
  650    H    LYS  82           H        LYS  82   0.263 -13.508 -13.508
  651    HA   LYS  82           HA       LYS  82  -2.236 -12.284 -12.284
  652   1HB   LYS  82          2HB       LYS  82  -1.900 -14.734 -14.734
  653   2HB   LYS  82          1HB       LYS  82  -1.776 -14.861 -14.861
  654   1HG   LYS  82          2HG       LYS  82  -4.090 -13.653 -13.653
  655   2HG   LYS  82          1HG       LYS  82  -4.170 -14.222 -14.222
  656   1HD   LYS  82          2HD       LYS  82  -3.331 -16.214 -16.214
  657   2HD   LYS  82          1HD       LYS  82  -5.023 -15.715 -15.715
  658   1HE   LYS  82          2HE       LYS  82  -3.888 -16.335 -16.335
  659   2HE   LYS  82          1HE       LYS  82  -4.124 -17.704 -17.704
  660   1HZ   LYS  82          1HZ       LYS  82  -6.425 -16.636 -16.636
  661   2HZ   LYS  82          3HZ       LYS  82  -6.122 -15.835 -15.835
  662   3HZ   LYS  82          2HZ       LYS  82  -6.154 -17.533 -17.533
  663    H    SER  83           H        SER  83  -3.114 -10.753 -10.753
  664    HA   SER  83           HA       SER  83  -2.570 -10.834 -10.834
  665   1HB   SER  83          2HB       SER  83  -2.197  -8.807  -8.807
  666   2HB   SER  83          1HB       SER  83  -3.911  -8.548  -8.548
  667    HG   SER  83           HG       SER  83  -2.198  -7.591  -7.591
  668    H    LEU  84           H        LEU  84  -4.511  -9.777  -9.777
  669    HA   LEU  84           HA       LEU  84  -7.163 -10.528 -10.528
  670   1HB   LEU  84          2HB       LEU  84  -6.396 -12.660 -12.660
  671   2HB   LEU  84          1HB       LEU  84  -5.979 -11.838 -11.838
  672    HG   LEU  84           HG       LEU  84  -8.349 -11.232 -11.232
  673   1HD1  LEU  84          3HD1      LEU  84  -8.953 -11.197 -11.197
  674   2HD1  LEU  84          2HD1      LEU  84  -8.875 -12.954 -12.954
  675   3HD1  LEU  84          1HD1      LEU  84 -10.079 -12.126 -12.126
  676   1HD2  LEU  84          1HD2      LEU  84  -7.799 -14.159 -14.159
  677   2HD2  LEU  84          3HD2      LEU  84  -7.587 -13.306 -13.306
  678   3HD2  LEU  84          2HD2      LEU  84  -9.207 -13.565 -13.565
  679    H    VAL  85           H        VAL  85  -8.845  -9.491  -9.491
  680    HA   VAL  85           HA       VAL  85  -7.810  -7.667  -7.667
  681    HB   VAL  85           HB       VAL  85  -9.663  -6.688  -6.688
  682   1HG1  VAL  85          1HG1      VAL  85  -9.469  -5.566  -5.566
  683   2HG1  VAL  85          3HG1      VAL  85  -7.829  -5.127  -5.127
  684   3HG1  VAL  85          2HG1      VAL  85  -9.206  -4.533  -4.533
  685   1HG2  VAL  85          3HG2      VAL  85  -6.709  -6.957  -6.957
  686   2HG2  VAL  85          2HG2      VAL  85  -7.825  -6.903  -6.903
  687   3HG2  VAL  85          1HG2      VAL  85  -7.343  -5.411  -5.411
  688    H    LYS  86           H        LYS  86  -9.085  -7.724  -7.724
  689    HA   LYS  86           HA       LYS  86 -11.984  -8.337  -8.337
  690   1HB   LYS  86          2HB       LYS  86 -11.644  -9.020  -9.020
  691   2HB   LYS  86          1HB       LYS  86 -11.439 -10.184 -10.184
  692   1HG   LYS  86          2HG       LYS  86  -8.973  -9.614  -9.614
  693   2HG   LYS  86          1HG       LYS  86  -9.266  -8.651  -8.651
  694   1HD   LYS  86          2HD       LYS  86  -9.940 -10.563 -10.563
  695   2HD   LYS  86          1HD       LYS  86 -10.067 -11.560 -11.560
  696   1HE   LYS  86          2HE       LYS  86  -7.563 -11.141 -11.141
  697   2HE   LYS  86          1HE       LYS  86  -7.557 -10.506 -10.506
  698   1HZ   LYS  86          3HZ       LYS  86  -8.739 -12.705 -12.705
  699   2HZ   LYS  86          2HZ       LYS  86  -8.113 -13.247 -13.247
  700   3HZ   LYS  86          1HZ       LYS  86  -7.062 -12.724 -12.724
  701    H    TRP  87           H        TRP  87 -13.353  -7.151  -7.151
  702    HA   TRP  87           HA       TRP  87 -12.326  -4.445  -4.445
  703   1HB   TRP  87          2HB       TRP  87 -14.950  -5.825  -5.825
  704   2HB   TRP  87          1HB       TRP  87 -14.630  -4.192  -4.192
  705    HD1  TRP  87           HD1      TRP  87 -15.774  -6.128  -6.128
  706    HE1  TRP  87           HE1      TRP  87 -16.059  -4.611  -4.611
  707    HE3  TRP  87           HE3      TRP  87 -13.407  -1.945  -1.945
  708    HZ2  TRP  87           HZ2      TRP  87 -15.368  -1.959  -1.959
  709    HZ3  TRP  87           HZ3      TRP  87 -13.210   0.059   0.059
  710    HH2  TRP  87           HH2      TRP  87 -14.186   0.047   0.047
  711    H    GLU  88           H        GLU  88 -12.803  -3.432  -3.432
  712    HA   GLU  88           HA       GLU  88 -12.149  -5.249  -5.249
  713   1HB   GLU  88          2HB       GLU  88 -10.144  -3.903  -3.903
  714   2HB   GLU  88          1HB       GLU  88 -10.933  -2.504  -2.504
  715   1HG   GLU  88          2HG       GLU  88  -9.384  -3.328  -3.328
  716   2HG   GLU  88          1HG       GLU  88 -11.000  -3.766  -3.766
  717    H    SER  89           H        SER  89 -13.092  -2.019  -2.019
  718    HA   SER  89           HA       SER  89 -15.112  -1.907  -1.907
  719   1HB   SER  89          2HB       SER  89 -14.592   0.387   0.387
  720   2HB   SER  89          1HB       SER  89 -13.029  -0.420  -0.420
  721    HG   SER  89           HG       SER  89 -13.072   1.476   1.476
  722    H    GLU  90           H        GLU  90 -16.053   0.692   0.692
  723    HA   GLU  90           HA       GLU  90 -17.684  -0.401  -0.401
  724   1HB   GLU  90          2HB       GLU  90 -17.557   2.494   2.494
  725   2HB   GLU  90          1HB       GLU  90 -18.891   1.675   1.675
  726   1HG   GLU  90          2HG       GLU  90 -18.646   0.089   0.089
  727   2HG   GLU  90          1HG       GLU  90 -18.093   1.618   1.618
  728    H    ASN  91           H        ASN  91 -14.786   1.545   1.545
  729    HA   ASN  91           HA       ASN  91 -14.696   1.555   1.555
  730   1HB   ASN  91          2HB       ASN  91 -14.069   4.013   4.013
  731   2HB   ASN  91          1HB       ASN  91 -14.099   3.881   3.881
  732   1HD2  ASN  91          2HD2      ASN  91 -17.435   5.006   5.006
  733   2HD2  ASN  91          1HD2      ASN  91 -15.863   5.227   5.227
  734    H    LYS  92           H        LYS  92 -13.185   0.134   0.134
  735    HA   LYS  92           HA       LYS  92 -10.479   0.978   0.978
  736   1HB   LYS  92          2HB       LYS  92 -10.668   1.848   1.848
  737   2HB   LYS  92          1HB       LYS  92 -11.385   0.352   0.352
  738   1HG   LYS  92          2HG       LYS  92  -9.324  -0.823  -0.823
  739   2HG   LYS  92          1HG       LYS  92  -8.597   0.423   0.423
  740   1HD   LYS  92          2HD       LYS  92  -8.676   2.013   2.013
  741   2HD   LYS  92          1HD       LYS  92  -9.442   0.792   0.792
  742   1HE   LYS  92          2HE       LYS  92  -6.895   0.002   0.002
  743   2HE   LYS  92          1HE       LYS  92  -6.772   1.195   1.195
  744   1HZ   LYS  92          2HZ       LYS  92  -8.402  -1.222  -1.222
  745   2HZ   LYS  92          1HZ       LYS  92  -6.714  -1.311  -1.311
  746   3HZ   LYS  92          3HZ       LYS  92  -7.613  -0.258  -0.258
  747    H    MET  93           H        MET  93  -9.916  -0.737  -0.737
  748    HA   MET  93           HA       MET  93 -10.505  -3.476  -3.476
  749   1HB   MET  93          2HB       MET  93 -10.415  -4.262  -4.262
  750   2HB   MET  93          1HB       MET  93 -11.653  -3.036  -3.036
  751   1HG   MET  93          2HG       MET  93  -9.372  -1.567  -1.567
  752   2HG   MET  93          1HG       MET  93  -9.256  -2.986  -2.986
  753   1HE   MET  93          2HE       MET  93 -11.160  -4.036  -4.036
  754   2HE   MET  93          1HE       MET  93 -12.801  -3.398  -3.398
  755   3HE   MET  93          3HE       MET  93 -11.775  -3.198  -3.198
  756    H    VAL  94           H        VAL  94  -8.875  -5.039  -5.039
  757    HA   VAL  94           HA       VAL  94  -6.118  -3.946  -3.946
  758    HB   VAL  94           HB       VAL  94  -6.803  -6.695  -6.695
  759   1HG1  VAL  94          3HG1      VAL  94  -4.512  -4.911  -4.911
  760   2HG1  VAL  94          2HG1      VAL  94  -4.878  -5.452  -5.452
  761   3HG1  VAL  94          1HG1      VAL  94  -4.582  -6.632  -6.632
  762   1HG2  VAL  94          1HG2      VAL  94  -7.178  -4.079  -4.079
  763   2HG2  VAL  94          3HG2      VAL  94  -8.353  -5.378  -5.378
  764   3HG2  VAL  94          2HG2      VAL  94  -6.954  -5.617  -5.617
  765    H    CYS  95           H        CYS  95  -4.487  -5.702  -5.702
  766    HA   CYS  95           HA       CYS  95  -5.694  -7.340  -7.340
  767   1HB   CYS  95          2HB       CYS  95  -5.273  -5.087  -5.087
  768   2HB   CYS  95          1HB       CYS  95  -3.575  -5.249  -5.249
  769    HG   CYS  95           HG       CYS  95  -4.715  -6.323  -6.323
  770    H    GLU  96           H        GLU  96  -4.625  -9.223  -9.223
  771    HA   GLU  96           HA       GLU  96  -1.917  -9.461  -9.461
  772   1HB   GLU  96          2HB       GLU  96  -2.366 -11.961 -11.961
  773   2HB   GLU  96          1HB       GLU  96  -3.417 -11.116 -11.116
  774   1HG   GLU  96          2HG       GLU  96  -5.217 -11.047 -11.047
  775   2HG   GLU  96          1HG       GLU  96  -4.168 -11.637 -11.637
  776    H    GLN  97           H        GLN  97  -0.323 -10.831 -10.831
  777    HA   GLN  97           HA       GLN  97  -0.941 -11.009 -11.009
  778   1HB   GLN  97          2HB       GLN  97  -0.286  -8.562  -8.562
  779   2HB   GLN  97          1HB       GLN  97   1.346  -9.221  -9.221
  780   1HG   GLN  97          2HG       GLN  97   0.685 -10.171 -10.171
  781   2HG   GLN  97          1HG       GLN  97  -0.613  -8.981  -8.981
  782   1HE2  GLN  97          2HE2      GLN  97   1.514  -6.230  -6.230
  783   2HE2  GLN  97          1HE2      GLN  97  -0.069  -6.765  -6.765
  784    H    LYS  98           H        LYS  98   0.407 -12.386 -12.386
  785    HA   LYS  98           HA       LYS  98   2.991 -13.181 -13.181
  786   1HB   LYS  98          2HB       LYS  98   2.404 -15.597 -15.597
  787   2HB   LYS  98          1HB       LYS  98   1.389 -14.782 -14.782
  788   1HG   LYS  98          2HG       LYS  98  -0.406 -14.539 -14.539
  789   2HG   LYS  98          1HG       LYS  98   0.607 -15.275 -15.275
  790   1HD   LYS  98          2HD       LYS  98   0.774 -17.311 -17.311
  791   2HD   LYS  98          1HD       LYS  98  -0.518 -16.581 -16.581
  792   1HE   LYS  98          2HE       LYS  98  -1.934 -16.487 -16.487
  793   2HE   LYS  98          1HE       LYS  98  -0.656 -17.311 -17.311
  794   1HZ   LYS  98          3HZ       LYS  98  -0.821 -19.107 -19.107
  795   2HZ   LYS  98          2HZ       LYS  98  -2.232 -18.350 -18.350
  796   3HZ   LYS  98          1HZ       LYS  98  -2.170 -18.958 -18.958
  797    H    LEU  99           H        LEU  99   4.437 -14.013 -14.013
  798    HA   LEU  99           HA       LEU  99   4.079 -12.973 -12.973
  799   1HB   LEU  99          2HB       LEU  99   5.829 -15.226 -15.226
  800   2HB   LEU  99          1HB       LEU  99   5.944 -14.530 -14.530
  801    HG   LEU  99           HG       LEU  99   5.999 -12.635 -12.635
  802   1HD1  LEU  99          2HD1      LEU  99   7.485 -14.628 -14.628
  803   2HD1  LEU  99          1HD1      LEU  99   8.452 -14.205 -14.205
  804   3HD1  LEU  99          3HD1      LEU  99   8.299 -13.066 -13.066
  805   1HD2  LEU  99          2HD2      LEU  99   7.262 -12.921 -12.921
  806   2HD2  LEU  99          1HD2      LEU  99   6.169 -11.660 -11.660
  807   3HD2  LEU  99          3HD2      LEU  99   7.834 -11.714 -11.714
  808    H    LEU 100           H        LEU 100   4.073 -14.277 -14.277
  809    HA   LEU 100           HA       LEU 100   2.008 -16.398 -16.398
  810   1HB   LEU 100          2HB       LEU 100   3.073 -14.654 -14.654
  811   2HB   LEU 100          1HB       LEU 100   2.083 -16.076 -16.076
  812    HG   LEU 100           HG       LEU 100   1.197 -13.962 -13.962
  813   1HD1  LEU 100          2HD1      LEU 100   1.190 -13.919 -13.919
  814   2HD1  LEU 100          1HD1      LEU 100  -0.292 -13.405 -13.405
  815   3HD1  LEU 100          3HD1      LEU 100   1.227 -12.577 -12.577
  816   1HD2  LEU 100          2HD2      LEU 100   0.023 -16.336 -16.336
  817   2HD2  LEU 100          1HD2      LEU 100  -0.219 -15.770 -15.770
  818   3HD2  LEU 100          3HD2      LEU 100  -1.040 -14.965 -14.965
  819    H    LYS 101           H        LYS 101   5.382 -16.068 -16.068
  820    HA   LYS 101           HA       LYS 101   5.687 -18.903 -18.903
  821   1HB   LYS 101          2HB       LYS 101   5.831 -17.475 -17.475
  822   2HB   LYS 101          1HB       LYS 101   7.355 -16.877 -16.877
  823   1HG   LYS 101          2HG       LYS 101   7.975 -19.366 -19.366
  824   2HG   LYS 101          1HG       LYS 101   6.632 -19.701 -19.701
  825   1HD   LYS 101          2HD       LYS 101   8.592 -17.604 -17.604
  826   2HD   LYS 101          1HD       LYS 101   9.109 -19.288 -19.288
  827   1HE   LYS 101          2HE       LYS 101   6.977 -19.770 -19.770
  828   2HE   LYS 101          1HE       LYS 101   6.708 -18.028 -18.028
  829   1HZ   LYS 101          1HZ       LYS 101   9.265 -19.207 -19.207
  830   2HZ   LYS 101          3HZ       LYS 101   7.931 -19.143 -19.143
  831   3HZ   LYS 101          2HZ       LYS 101   8.583 -17.707 -17.707
  832    H    GLY 102           H        GLY 102   7.610 -19.765 -19.765
  833   1HA   GLY 102          2HA       GLY 102   9.439 -19.845 -19.845
  834   2HA   GLY 102          1HA       GLY 102   9.777 -18.176 -18.176
  835    H    GLU 103           H        GLU 103  10.296 -17.916 -17.916
  836    HA   GLU 103           HA       GLU 103   8.171 -16.630 -16.630
  837   1HB   GLU 103          2HB       GLU 103   7.447 -19.011 -19.011
  838   2HB   GLU 103          1HB       GLU 103   8.964 -19.314 -19.314
  839   1HG   GLU 103          2HG       GLU 103   8.415 -17.746 -17.746
  840   2HG   GLU 103          1HG       GLU 103   7.030 -17.141 -17.141
  841    H    GLY 104           H        GLY 104   9.011 -15.384 -15.384
  842   1HA   GLY 104          2HA       GLY 104  11.518 -16.030 -16.030
  843   2HA   GLY 104          1HA       GLY 104  11.657 -14.682 -14.682
  844    HA   PRO 105           HA       PRO 105   9.917 -12.154 -12.154
  845   1HB   PRO 105          2HB       PRO 105   9.118 -10.006 -10.006
  846   2HB   PRO 105          1HB       PRO 105  10.815 -10.344 -10.344
  847   1HG   PRO 105          2HG       PRO 105   9.389 -10.658 -10.658
  848   2HG   PRO 105          1HG       PRO 105  11.123 -10.479 -10.479
  849   1HD   PRO 105          2HD       PRO 105   9.719 -12.911 -12.911
  850   2HD   PRO 105          1HD       PRO 105  11.427 -12.746 -12.746
  851    H    LYS 106           H        LYS 106   7.775 -10.657 -10.657
  852    HA   LYS 106           HA       LYS 106   5.463 -11.990 -11.990
  853   1HB   LYS 106          2HB       LYS 106   5.786 -13.055 -13.055
  854   2HB   LYS 106          1HB       LYS 106   5.788 -11.467 -11.467
  855   1HG   LYS 106          2HG       LYS 106   3.510 -11.086 -11.086
  856   2HG   LYS 106          1HG       LYS 106   3.479 -12.426 -12.426
  857   1HD   LYS 106          2HD       LYS 106   2.524 -13.530 -13.530
  858   2HD   LYS 106          1HD       LYS 106   4.210 -13.764 -13.764
  859   1HE   LYS 106          2HE       LYS 106   3.150 -12.908 -12.908
  860   2HE   LYS 106          1HE       LYS 106   4.007 -11.533 -11.533
  861   1HZ   LYS 106          1HZ       LYS 106   1.780 -11.167 -11.167
  862   2HZ   LYS 106          3HZ       LYS 106   1.124 -12.111 -12.111
  863   3HZ   LYS 106          2HZ       LYS 106   1.933 -10.663 -10.663
  864    H    THR 107           H        THR 107   3.805 -10.497 -10.497
  865    HA   THR 107           HA       THR 107   4.276  -7.711  -7.711
  866    HB   THR 107           HB       THR 107   2.893  -7.352  -7.352
  867    HG1  THR 107           HG1      THR 107   3.275  -9.661  -9.661
  868   1HG2  THR 107          3HG2      THR 107   5.743  -7.223  -7.223
  869   2HG2  THR 107          2HG2      THR 107   5.403  -7.064  -7.064
  870   3HG2  THR 107          1HG2      THR 107   4.677  -5.941  -5.941
  871    H    SER 108           H        SER 108   2.514  -6.499  -6.499
  872    HA   SER 108           HA       SER 108  -0.232  -7.386  -7.386
  873   1HB   SER 108          2HB       SER 108   0.652  -7.198  -7.198
  874   2HB   SER 108          1HB       SER 108  -0.803  -7.941  -7.941
  875    HG   SER 108           HG       SER 108   1.290  -9.212  -9.212
  876    H    TRP 109           H        TRP 109  -1.468  -5.484  -5.484
  877    HA   TRP 109           HA       TRP 109  -0.374  -3.156  -3.156
  878   1HB   TRP 109          2HB       TRP 109  -1.008  -1.694  -1.694
  879   2HB   TRP 109          1HB       TRP 109   0.400  -2.720  -2.720
  880    HD1  TRP 109           HD1      TRP 109   0.256  -4.616  -4.616
  881    HE1  TRP 109           HE1      TRP 109  -1.493  -5.221  -5.221
  882    HE3  TRP 109           HE3      TRP 109  -3.637  -1.704  -1.704
  883    HZ2  TRP 109           HZ2      TRP 109  -4.189  -4.553  -4.553
  884    HZ3  TRP 109           HZ3      TRP 109  -5.773  -1.709  -1.709
  885    HH2  TRP 109           HH2      TRP 109  -6.061  -3.123  -3.123
  886    H    THR 110           H        THR 110  -2.021  -1.329  -1.329
  887    HA   THR 110           HA       THR 110  -4.805  -2.400  -2.400
  888    HB   THR 110           HB       THR 110  -5.239  -1.456  -1.456
  889    HG1  THR 110           HG1      THR 110  -2.629  -0.364  -0.364
  890   1HG2  THR 110          1HG2      THR 110  -3.278  -3.424  -3.424
  891   2HG2  THR 110          3HG2      THR 110  -2.598  -2.313  -2.313
  892   3HG2  THR 110          2HG2      THR 110  -4.166  -3.064  -3.064
  893    H    MET 111           H        MET 111  -6.412  -0.599  -0.599
  894    HA   MET 111           HA       MET 111  -5.493   2.063   2.063
  895   1HB   MET 111          2HB       MET 111  -6.971   2.030   2.030
  896   2HB   MET 111          1HB       MET 111  -5.566   0.975   0.975
  897   1HG   MET 111          2HG       MET 111  -6.925  -0.968  -0.968
  898   2HG   MET 111          1HG       MET 111  -8.333   0.057   0.057
  899   1HE   MET 111          3HE       MET 111  -9.678   0.871   0.871
  900   2HE   MET 111          2HE       MET 111  -9.437   1.531   1.531
  901   3HE   MET 111          1HE       MET 111 -10.190  -0.049  -0.049
  902    H    GLU 112           H        GLU 112  -6.786   3.479   3.479
  903    HA   GLU 112           HA       GLU 112  -9.591   2.589   2.589
  904   1HB   GLU 112          2HB       GLU 112  -9.430   3.685   3.685
  905   2HB   GLU 112          1HB       GLU 112  -8.318   2.329   2.329
  906   1HG   GLU 112          2HG       GLU 112  -6.480   3.864   3.864
  907   2HG   GLU 112          1HG       GLU 112  -7.583   5.237   5.237
  908    H    LEU 113           H        LEU 113 -11.096   4.354   4.354
  909    HA   LEU 113           HA       LEU 113 -10.272   6.826   6.826
  910   1HB   LEU 113          2HB       LEU 113 -12.291   5.004   5.004
  911   2HB   LEU 113          1HB       LEU 113 -13.152   6.264   6.264
  912    HG   LEU 113           HG       LEU 113 -13.105   6.520   6.520
  913   1HD1  LEU 113          3HD1      LEU 113 -12.429   8.533   8.533
  914   2HD1  LEU 113          2HD1      LEU 113 -11.904   8.984   8.984
  915   3HD1  LEU 113          1HD1      LEU 113 -13.595   8.598   8.598
  916   1HD2  LEU 113          1HD2      LEU 113 -10.649   5.740   5.740
  917   2HD2  LEU 113          3HD2      LEU 113 -11.128   7.074   7.074
  918   3HD2  LEU 113          2HD2      LEU 113 -10.244   7.398   7.398
  919    H    THR 114           H        THR 114 -10.845   8.837   8.837
  920    HA   THR 114           HA       THR 114 -11.474   8.664   8.664
  921    HB   THR 114           HB       THR 114 -10.739  10.955  10.955
  922    HG1  THR 114           HG1      THR 114 -11.250  12.140  12.140
  923   1HG2  THR 114          3HG2      THR 114  -9.040   9.295   9.295
  924   2HG2  THR 114          2HG2      THR 114  -8.480  10.795  10.795
  925   3HG2  THR 114          1HG2      THR 114  -8.900   9.414   9.414
  926    H    ASN 115           H        ASN 115 -13.103  10.177  10.177
  927    HA   ASN 115           HA       ASN 115 -15.638   9.909   9.909
  928   1HB   ASN 115          2HB       ASN 115 -15.020  10.404  10.404
  929   2HB   ASN 115          1HB       ASN 115 -15.076  12.095  12.095
  930   1HD2  ASN 115          2HD2      ASN 115 -18.512  10.657  10.657
  931   2HD2  ASN 115          1HD2      ASN 115 -16.988  10.392  10.392
  932    H    ASP 116           H        ASP 116 -13.142  12.261  12.261
  933    HA   ASP 116           HA       ASP 116 -14.989  14.263  14.263
  934   1HB   ASP 116          2HB       ASP 116 -12.795  14.755  14.755
  935   2HB   ASP 116          1HB       ASP 116 -11.980  14.311  14.311
  936    H    GLY 117           H        GLY 117 -12.901  11.673  11.673
  937   1HA   GLY 117          2HA       GLY 117 -13.636  10.759  10.759
  938   2HA   GLY 117          1HA       GLY 117 -13.512  12.418  12.418
  939    H    GLU 118           H        GLU 118 -11.026  12.318  12.318
  940    HA   GLU 118           HA       GLU 118  -8.986  12.208  12.208
  941   1HB   GLU 118          2HB       GLU 118  -8.753  11.739  11.739
  942   2HB   GLU 118          1HB       GLU 118  -7.418  12.119  12.119
  943   1HG   GLU 118          2HG       GLU 118  -8.211  14.307  14.307
  944   2HG   GLU 118          1HG       GLU 118  -9.824  13.926  13.926
  945    H    LEU 119           H        LEU 119  -7.119  10.522  10.522
  946    HA   LEU 119           HA       LEU 119  -8.164   7.805   7.805
  947   1HB   LEU 119          2HB       LEU 119  -8.684   8.394   8.394
  948   2HB   LEU 119          1HB       LEU 119  -6.954   8.519   8.519
  949    HG   LEU 119           HG       LEU 119  -8.218   6.017   6.017
  950   1HD1  LEU 119          3HD1      LEU 119  -8.057   7.025   7.025
  951   2HD1  LEU 119          2HD1      LEU 119  -7.882   5.298   5.298
  952   3HD1  LEU 119          1HD1      LEU 119  -9.354   6.134   6.134
  953   1HD2  LEU 119          1HD2      LEU 119  -5.563   6.835   6.835
  954   2HD2  LEU 119          3HD2      LEU 119  -5.918   5.769   5.769
  955   3HD2  LEU 119          2HD2      LEU 119  -6.112   5.184   5.184
  956    H    ILE 120           H        ILE 120  -6.629   7.011   7.011
  957    HA   ILE 120           HA       ILE 120  -3.784   7.721   7.721
  958    HB   ILE 120           HB       ILE 120  -4.461   8.152   8.152
  959   1HG1  ILE 120          2HG1      ILE 120  -2.791   5.623   5.623
  960   2HG1  ILE 120          1HG1      ILE 120  -2.165   7.207   7.207
  961   1HG2  ILE 120          2HG2      ILE 120  -5.491   5.348   5.348
  962   2HG2  ILE 120          1HG2      ILE 120  -4.969   5.951   5.951
  963   3HG2  ILE 120          3HG2      ILE 120  -6.263   6.771   6.771
  964   1HD1  ILE 120          3HD1      ILE 120  -3.281   7.863   7.863
  965   2HD1  ILE 120          2HD1      ILE 120  -2.910   6.171   6.171
  966   3HD1  ILE 120          1HD1      ILE 120  -1.621   7.282   7.282
  967    H    LEU 121           H        LEU 121  -2.224   5.987   5.987
  968    HA   LEU 121           HA       LEU 121  -3.448   3.313   3.313
  969   1HB   LEU 121          2HB       LEU 121  -3.207   4.327   4.327
  970   2HB   LEU 121          1HB       LEU 121  -1.646   5.012   5.012
  971    HG   LEU 121           HG       LEU 121  -1.737   2.962   2.962
  972   1HD1  LEU 121          3HD1      LEU 121   0.226   4.000   4.000
  973   2HD1  LEU 121          2HD1      LEU 121   0.142   2.403   2.403
  974   3HD1  LEU 121          1HD1      LEU 121   0.454   2.555   2.555
  975   1HD2  LEU 121          2HD2      LEU 121  -3.228   1.699   1.699
  976   2HD2  LEU 121          1HD2      LEU 121  -1.895   0.812   0.812
  977   3HD2  LEU 121          3HD2      LEU 121  -1.743   1.423   1.423
  978    H    THR 122           H        THR 122  -2.459   1.995   1.995
  979    HA   THR 122           HA       THR 122   0.362   2.578   2.578
  980    HB   THR 122           HB       THR 122  -0.748   0.372   0.372
  981    HG1  THR 122           HG1      THR 122  -2.307   2.741   2.741
  982   1HG2  THR 122          2HG2      THR 122   0.163   3.183   3.183
  983   2HG2  THR 122          1HG2      THR 122  -0.505   2.162   2.162
  984   3HG2  THR 122          3HG2      THR 122   0.949   1.659   1.659
  985    H    MET 123           H        MET 123   1.769   0.582   0.582
  986    HA   MET 123           HA       MET 123   1.047  -1.623  -1.623
  987   1HB   MET 123          2HB       MET 123   3.631  -0.056  -0.056
  988   2HB   MET 123          1HB       MET 123   3.121  -1.408  -1.408
  989   1HG   MET 123          2HG       MET 123   1.025   0.056   0.056
  990   2HG   MET 123          1HG       MET 123   2.017   1.390   1.390
  991   1HE   MET 123          2HE       MET 123   1.100  -1.099  -1.099
  992   2HE   MET 123          1HE       MET 123   1.846  -0.696  -0.696
  993   3HE   MET 123          3HE       MET 123   2.659  -1.801  -1.801
  994    H    THR 124           H        THR 124   2.632  -3.418  -3.418
  995    HA   THR 124           HA       THR 124   4.325  -3.402  -3.402
  996    HB   THR 124           HB       THR 124   2.400  -5.664  -5.664
  997    HG1  THR 124           HG1      THR 124   0.906  -4.608  -4.608
  998   1HG2  THR 124          2HG2      THR 124   4.454  -5.952  -5.952
  999   2HG2  THR 124          1HG2      THR 124   3.868  -4.661  -4.661
 1000   3HG2  THR 124          3HG2      THR 124   2.957  -6.164  -6.164
 1001    H    ALA 125           H        ALA 125   5.906  -5.057  -5.057
 1002    HA   ALA 125           HA       ALA 125   6.021  -6.916  -6.916
 1003   1HB   ALA 125          2HB       ALA 125   8.028  -4.659  -4.659
 1004   2HB   ALA 125          1HB       ALA 125   8.196  -6.033  -6.033
 1005   3HB   ALA 125          3HB       ALA 125   6.878  -4.884  -4.884
 1006    H    ASP 126           H        ASP 126   6.236  -8.558  -8.558
 1007    HA   ASP 126           HA       ASP 126   7.485 -10.099 -10.099
 1008   1HB   ASP 126          2HB       ASP 126   9.504  -8.480  -8.480
 1009   2HB   ASP 126          1HB       ASP 126   9.868  -8.558  -8.558
 1010    H    ASP 127           H        ASP 127   8.843  -7.096  -7.096
 1011    HA   ASP 127           HA       ASP 127   6.978  -7.267  -7.267
 1012   1HB   ASP 127          2HB       ASP 127   9.985  -7.418  -7.418
 1013   2HB   ASP 127          1HB       ASP 127   8.797  -7.276  -7.276
 1014    H    VAL 128           H        VAL 128   7.763  -5.420  -5.420
 1015    HA   VAL 128           HA       VAL 128   8.304  -3.006  -3.006
 1016    HB   VAL 128           HB       VAL 128   9.352  -1.980  -1.980
 1017   1HG1  VAL 128          3HG1      VAL 128  10.516  -3.811  -3.811
 1018   2HG1  VAL 128          2HG1      VAL 128  10.642  -4.673  -4.673
 1019   3HG1  VAL 128          1HG1      VAL 128  11.370  -3.076  -3.076
 1020   1HG2  VAL 128          3HG2      VAL 128   8.190  -4.367  -4.367
 1021   2HG2  VAL 128          2HG2      VAL 128   8.462  -2.745  -2.745
 1022   3HG2  VAL 128          1HG2      VAL 128   9.797  -3.893  -3.893
 1023    H    VAL 129           H        VAL 129   7.429  -1.016  -1.016
 1024    HA   VAL 129           HA       VAL 129   4.993  -1.700  -1.700
 1025    HB   VAL 129           HB       VAL 129   4.966  -0.777  -0.777
 1026   1HG1  VAL 129          1HG1      VAL 129   3.183   0.351   0.351
 1027   2HG1  VAL 129          3HG1      VAL 129   2.486  -0.009  -0.009
 1028   3HG1  VAL 129          2HG1      VAL 129   3.822   1.134   1.134
 1029   1HG2  VAL 129          2HG2      VAL 129   3.515  -2.681  -2.681
 1030   2HG2  VAL 129          1HG2      VAL 129   4.181  -2.932  -2.932
 1031   3HG2  VAL 129          3HG2      VAL 129   2.662  -2.059  -2.059
 1032    H    CYS 130           H        CYS 130   5.049  -0.339  -0.339
 1033    HA   CYS 130           HA       CYS 130   6.279   2.346   2.346
 1034   1HB   CYS 130          2HB       CYS 130   6.953   0.727   0.727
 1035   2HB   CYS 130          1HB       CYS 130   5.404   1.152   1.152
 1036    HG   CYS 130           HG       CYS 130   7.079   3.597   3.597
 1037    H    THR 131           H        THR 131   4.809   3.892   3.892
 1038    HA   THR 131           HA       THR 131   2.025   3.646   3.646
 1039    HB   THR 131           HB       THR 131   3.218   5.530   5.530
 1040    HG1  THR 131           HG1      THR 131   3.255   3.404   3.404
 1041   1HG2  THR 131          2HG2      THR 131   0.444   5.053   5.053
 1042   2HG2  THR 131          1HG2      THR 131   0.672   5.591   5.591
 1043   3HG2  THR 131          3HG2      THR 131   1.260   6.581   6.581
 1044    H    ARG 132           H        ARG 132   1.035   5.449   5.449
 1045    HA   ARG 132           HA       ARG 132   2.668   7.703   7.703
 1046   1HB   ARG 132          2HB       ARG 132   1.296   5.834   5.834
 1047   2HB   ARG 132          1HB       ARG 132   2.211   7.284   7.284
 1048   1HG   ARG 132          2HG       ARG 132   4.193   6.170   6.170
 1049   2HG   ARG 132          1HG       ARG 132   3.244   4.684   4.684
 1050   1HD   ARG 132          2HD       ARG 132   3.590   6.285   6.285
 1051   2HD   ARG 132          1HD       ARG 132   4.913   5.256   5.256
 1052    HE   ARG 132           HE       ARG 132   2.822   3.521   3.521
 1053   1HH1  ARG 132          1HH2      ARG 132   4.866   4.487   4.487
 1054   2HH1  ARG 132          2HH2      ARG 132   3.813   4.186   4.186
 1055   1HH2  ARG 132          2HH1      ARG 132   1.002   3.703   3.703
 1056   2HH2  ARG 132          1HH1      ARG 132   1.626   3.744   3.744
 1057    H    VAL 133           H        VAL 133   1.180   9.020   9.020
 1058    HA   VAL 133           HA       VAL 133  -1.670   8.704   8.704
 1059    HB   VAL 133           HB       VAL 133  -0.068  11.223  11.223
 1060   1HG1  VAL 133          2HG1      VAL 133  -2.979  10.523  10.523
 1061   2HG1  VAL 133          1HG1      VAL 133  -2.261  11.709  11.709
 1062   3HG1  VAL 133          3HG1      VAL 133  -2.249  11.991  11.991
 1063   1HG2  VAL 133          1HG2      VAL 133  -1.140   9.062   9.062
 1064   2HG2  VAL 133          3HG2      VAL 133   0.540   9.559   9.559
 1065   3HG2  VAL 133          2HG2      VAL 133  -0.610  10.638  10.638
 1066    H    TYR 134           H        TYR 134  -3.032   9.132   9.132
 1067    HA   TYR 134           HA       TYR 134  -1.929  10.733  10.733
 1068   1HB   TYR 134          2HB       TYR 134  -3.780   8.370   8.370
 1069   2HB   TYR 134          1HB       TYR 134  -3.809   9.478   9.478
 1070    HD1  TYR 134           HD2      TYR 134  -1.821   9.763   9.763
 1071    HD2  TYR 134           HD1      TYR 134  -1.926   6.908   6.908
 1072    HE1  TYR 134           HE2      TYR 134   0.139   8.607   8.607
 1073    HE2  TYR 134           HE1      TYR 134   0.012   5.706   5.706
 1074    HH   TYR 134           HH       TYR 134   1.095   6.237   6.237
 1075    H    VAL 135           H        VAL 135  -2.988  12.544  12.544
 1076    HA   VAL 135           HA       VAL 135  -5.731  12.927  12.927
 1077    HB   VAL 135           HB       VAL 135  -3.432  14.530  14.530
 1078   1HG1  VAL 135          1HG1      VAL 135  -5.397  15.926  15.926
 1079   2HG1  VAL 135          3HG1      VAL 135  -4.076  16.711  16.711
 1080   3HG1  VAL 135          2HG1      VAL 135  -3.725  15.524  15.524
 1081   1HG2  VAL 135          2HG2      VAL 135  -5.649  14.192  14.192
 1082   2HG2  VAL 135          1HG2      VAL 135  -4.840  15.755  15.755
 1083   3HG2  VAL 135          3HG2      VAL 135  -6.236  15.554  15.554
 1084    H    ARG 136           H        ARG 136  -7.344  13.450  13.450
 1085    HA   ARG 136           HA       ARG 136  -7.070  12.635  12.635
 1086   1HB   ARG 136          2HB       ARG 136  -9.054  14.061  14.061
 1087   2HB   ARG 136          1HB       ARG 136  -8.914  14.767  14.767
 1088   1HG   ARG 136          2HG       ARG 136  -9.535  12.823  12.823
 1089   2HG   ARG 136          1HG       ARG 136  -8.977  11.790  11.790
 1090   1HD   ARG 136          2HD       ARG 136 -11.463  13.529  13.529
 1091   2HD   ARG 136          1HD       ARG 136 -11.409  11.766  11.766
 1092    HE   ARG 136           HE       ARG 136  -9.985  12.597  12.597
 1093   1HH1  ARG 136          1HH2      ARG 136 -12.692  11.008  11.008
 1094   2HH1  ARG 136          2HH2      ARG 136 -13.689  11.857  11.857
 1095   1HH2  ARG 136          2HH1      ARG 136 -11.467  14.492  14.492
 1096   2HH2  ARG 136          1HH1      ARG 136 -12.996  13.831  13.831
 1097    H    GLU 137           HN       GLU 137  -6.036  13.306  13.306
 1098    HA   GLU 137           HA       GLU 137  -4.554  14.570  14.570
 1099   1HB   GLU 137          2HB       GLU 137  -6.998  15.286  15.286
 1100   2HB   GLU 137          1HB       GLU 137  -6.539  16.776  16.776
 1101   1HG   GLU 137          2HG       GLU 137  -4.535  16.868  16.868
 1102   2HG   GLU 137          1HG       GLU 137  -5.330  15.592  15.592

  Start of MODEL   23
    1   1H    PRO   1          1H        PRO   1 -16.235   7.155   7.155
    2   2H    PRO   1          2H        PRO   1 -15.729   6.248   6.248
    3    HA   PRO   1           HA       PRO   1 -16.208   4.351   4.351
    4   1HB   PRO   1          2HB       PRO   1 -18.879   4.768   4.768
    5   2HB   PRO   1          1HB       PRO   1 -18.363   3.844   3.844
    6   1HG   PRO   1          2HG       PRO   1 -19.679   6.390   6.390
    7   2HG   PRO   1          1HG       PRO   1 -19.177   5.452   5.452
    8   1HD   PRO   1          1HD       PRO   1 -18.010   7.860   7.860
    9   2HD   PRO   1          2HD       PRO   1 -17.495   6.901   6.901
   10    H    ASN   2           H        ASN   2 -14.945   6.319   6.319
   11    HA   ASN   2           HA       ASN   2 -15.643   5.317   5.317
   12   1HB   ASN   2          2HB       ASN   2 -16.093   8.145   8.145
   13   2HB   ASN   2          1HB       ASN   2 -15.518   7.852   7.852
   14   1HD2  ASN   2          1HD2      ASN   2 -18.267   7.471   7.471
   15   2HD2  ASN   2          2HD2      ASN   2 -19.353   6.905   6.905
   16    H    PHE   3           H        PHE   3 -13.744   4.823   4.823
   17    HA   PHE   3           HA       PHE   3 -11.270   6.181   6.181
   18   1HB   PHE   3          2HB       PHE   3 -11.716   3.684   3.684
   19   2HB   PHE   3          1HB       PHE   3 -10.144   4.321   4.321
   20    HD1  PHE   3           HD1      PHE   3 -13.387   3.473   3.473
   21    HD2  PHE   3           HD2      PHE   3  -9.093   3.291   3.291
   22    HE1  PHE   3           HE1      PHE   3 -13.473   2.209   2.209
   23    HE2  PHE   3           HE2      PHE   3  -9.189   2.017   2.017
   24    HZ   PHE   3           HZ       PHE   3 -11.379   1.470   1.470
   25    H    SER   4           H        SER   4 -13.459   6.012   6.012
   26    HA   SER   4           HA       SER   4 -11.736   6.535   6.535
   27   1HB   SER   4          2HB       SER   4 -14.202   5.948   5.948
   28   2HB   SER   4          1HB       SER   4 -14.535   7.636   7.636
   29    HG   SER   4           HG       SER   4 -14.458   7.656   7.656
   30    H    GLY   5           H        GLY   5 -10.379   8.181   8.181
   31   1HA   GLY   5          2HA       GLY   5 -10.979  10.848  10.848
   32   2HA   GLY   5          1HA       GLY   5 -10.651  10.710  10.710
   33    H    ASN   6           H        ASN   6  -8.814  12.226  12.226
   34    HA   ASN   6           HA       ASN   6  -6.540  10.633  10.633
   35   1HB   ASN   6          2HB       ASN   6  -7.116  13.586  13.586
   36   2HB   ASN   6          1HB       ASN   6  -5.446  13.033  13.033
   37   1HD2  ASN   6          2HD2      ASN   6  -6.165  11.565  11.565
   38   2HD2  ASN   6          1HD2      ASN   6  -5.540  11.009  11.009
   39    H    TRP   7           H        TRP   7  -4.395  11.131  11.131
   40    HA   TRP   7           HA       TRP   7  -4.921  11.596  11.596
   41   1HB   TRP   7          2HB       TRP   7  -3.936   8.970   8.970
   42   2HB   TRP   7          1HB       TRP   7  -3.900   9.385   9.385
   43    HD1  TRP   7           HD1      TRP   7  -6.164   8.153   8.153
   44    HE1  TRP   7           HE1      TRP   7  -8.576   7.910   7.910
   45    HE3  TRP   7           HE3      TRP   7  -5.632  10.522  10.522
   46    HZ2  TRP   7           HZ2      TRP   7 -10.076   8.667   8.667
   47    HZ3  TRP   7           HZ3      TRP   7  -7.559  10.790  10.790
   48    HH2  TRP   7           HH2      TRP   7  -9.762   9.857   9.857
   49    H    LYS   8           H        LYS   8  -3.301  12.704  12.704
   50    HA   LYS   8           HA       LYS   8  -0.574  12.415  12.415
   51   1HB   LYS   8          2HB       LYS   8  -1.839  14.835  14.835
   52   2HB   LYS   8          1HB       LYS   8  -0.155  14.738  14.738
   53   1HG   LYS   8          2HG       LYS   8  -0.921  14.310  14.310
   54   2HG   LYS   8          1HG       LYS   8  -2.591  14.501  14.501
   55   1HD   LYS   8          2HD       LYS   8  -2.147  16.799  16.799
   56   2HD   LYS   8          1HD       LYS   8  -0.442  16.621  16.621
   57   1HE   LYS   8          2HE       LYS   8  -0.928  16.427  16.427
   58   2HE   LYS   8          1HE       LYS   8  -2.652  16.217  16.217
   59   1HZ   LYS   8          3HZ       LYS   8  -2.649  18.484  18.484
   60   2HZ   LYS   8          2HZ       LYS   8  -1.040  18.668  18.668
   61   3HZ   LYS   8          1HZ       LYS   8  -2.280  18.450  18.450
   62    H    ILE   9           H        ILE   9   0.614  11.208  11.208
   63    HA   ILE   9           HA       ILE   9  -0.089  10.689  10.689
   64    HB   ILE   9           HB       ILE   9   1.293   9.163   9.163
   65   1HG1  ILE   9          2HG1      ILE   9   1.636   9.593   9.593
   66   2HG1  ILE   9          1HG1      ILE   9   2.774   8.560   8.560
   67   1HG2  ILE   9          1HG2      ILE   9   2.844  11.579  11.579
   68   2HG2  ILE   9          3HG2      ILE   9   3.838  10.174  10.174
   69   3HG2  ILE   9          2HG2      ILE   9   2.666  10.090  10.090
   70   1HD1  ILE   9          2HD1      ILE   9   3.603  11.370  11.370
   71   2HD1  ILE   9          1HD1      ILE   9   3.417  10.778  10.778
   72   3HD1  ILE   9          3HD1      ILE   9   4.501   9.952   9.952
   73    H    ILE  10           H        ILE  10   0.541  11.574  11.574
   74    HA   ILE  10           HA       ILE  10   2.258  14.016  14.016
   75    HB   ILE  10           HB       ILE  10   0.827  15.032  15.032
   76   1HG1  ILE  10          2HG1      ILE  10  -1.530  13.686  13.686
   77   2HG1  ILE  10          1HG1      ILE  10  -0.413  12.330  12.330
   78   1HG2  ILE  10          1HG2      ILE  10   0.344  15.409  15.409
   79   2HG2  ILE  10          3HG2      ILE  10  -0.749  14.025  14.025
   80   3HG2  ILE  10          2HG2      ILE  10  -1.123  15.456  15.456
   81   1HD1  ILE  10          3HD1      ILE  10   0.881  13.782  13.782
   82   2HD1  ILE  10          2HD1      ILE  10  -0.781  14.257  14.257
   83   3HD1  ILE  10          1HD1      ILE  10  -0.322  12.555  12.555
   84    H    ARG  11           H        ARG  11   1.473  11.050  11.050
   85    HA   ARG  11           HA       ARG  11   3.725  11.606  11.606
   86   1HB   ARG  11          2HB       ARG  11   0.919  10.849  10.849
   87   2HB   ARG  11          1HB       ARG  11   2.161   9.993   9.993
   88   1HG   ARG  11          2HG       ARG  11   2.592  12.911  12.911
   89   2HG   ARG  11          1HG       ARG  11   1.167  12.447  12.447
   90   1HD   ARG  11          2HD       ARG  11   3.681  10.947  10.947
   91   2HD   ARG  11          1HD       ARG  11   3.605  12.617  12.617
   92    HE   ARG  11           HE       ARG  11   1.215  11.559  11.559
   93   1HH1  ARG  11          2HH1      ARG  11   3.232   9.105   9.105
   94   2HH1  ARG  11          1HH1      ARG  11   3.624   8.958   8.958
   95   1HH2  ARG  11          1HH2      ARG  11   2.269  12.033  12.033
   96   2HH2  ARG  11          2HH2      ARG  11   3.077  10.615  10.615
   97    H    SER  12           H        SER  12   4.555   9.533   9.533
   98    HA   SER  12           HA       SER  12   4.057   6.926   6.926
   99   1HB   SER  12          2HB       SER  12   4.533   7.451   7.451
  100   2HB   SER  12          1HB       SER  12   5.916   8.447   8.447
  101    HG   SER  12           HG       SER  12   6.663   6.460   6.460
  102    H    GLU  13           H        GLU  13   6.102   5.500   5.500
  103    HA   GLU  13           HA       GLU  13   8.292   6.838   6.838
  104   1HB   GLU  13          2HB       GLU  13   7.801   5.817   5.817
  105   2HB   GLU  13          1HB       GLU  13   6.502   6.895   6.895
  106   1HG   GLU  13          2HG       GLU  13   5.882   4.328   4.328
  107   2HG   GLU  13          1HG       GLU  13   6.371   4.082   4.082
  108    H    ASN  14           H        ASN  14   7.911   4.814   4.814
  109    HA   ASN  14           HA       ASN  14   9.968   2.926   2.926
  110   1HB   ASN  14          2HB       ASN  14   7.858   1.243   1.243
  111   2HB   ASN  14          1HB       ASN  14   8.710   1.109   1.109
  112   1HD2  ASN  14          2HD2      ASN  14   5.741   1.910   1.910
  113   2HD2  ASN  14          1HD2      ASN  14   7.131   0.955   0.955
  114    H    PHE  15           H        PHE  15   9.634   4.939   4.939
  115    HA   PHE  15           HA       PHE  15   9.018   3.765   3.765
  116   1HB   PHE  15          2HB       PHE  15   9.346   6.261   6.261
  117   2HB   PHE  15          1HB       PHE  15  11.066   5.943   5.943
  118    HD1  PHE  15           HD2      PHE  15  10.088   3.706   3.706
  119    HD2  PHE  15           HD1      PHE  15   9.862   7.949   7.949
  120    HE1  PHE  15           HE2      PHE  15   9.958   4.045   4.045
  121    HE2  PHE  15           HE1      PHE  15   9.723   8.273   8.273
  122    HZ   PHE  15           HZ       PHE  15   9.768   6.302   6.302
  123    H    GLU  16           H        GLU  16  12.271   4.596   4.596
  124    HA   GLU  16           HA       GLU  16  13.697   3.004   3.004
  125   1HB   GLU  16          2HB       GLU  16  14.311   4.247   4.247
  126   2HB   GLU  16          1HB       GLU  16  15.399   2.977   2.977
  127   1HG   GLU  16          2HG       GLU  16  16.109   4.199   4.199
  128   2HG   GLU  16          1HG       GLU  16  14.604   5.113   5.113
  129    H    GLU  17           H        GLU  17  12.025   2.167   2.167
  130    HA   GLU  17           HA       GLU  17  13.262  -0.340  -0.340
  131   1HB   GLU  17          2HB       GLU  17  10.431   0.597   0.597
  132   2HB   GLU  17          1HB       GLU  17  11.212  -0.780  -0.780
  133   1HG   GLU  17          2HG       GLU  17  13.080   0.963   0.963
  134   2HG   GLU  17          1HG       GLU  17  11.797   2.140   2.140
  135    H    LEU  18           H        LEU  18  10.570   0.592   0.592
  136    HA   LEU  18           HA       LEU  18  10.006  -2.157  -2.157
  137   1HB   LEU  18          2HB       LEU  18   8.548   0.203   0.203
  138   2HB   LEU  18          1HB       LEU  18   8.949  -0.065  -0.065
  139    HG   LEU  18           HG       LEU  18   8.079  -2.379  -2.379
  140   1HD1  LEU  18          1HD1      LEU  18   7.915  -1.609  -1.609
  141   2HD1  LEU  18          3HD1      LEU  18   6.517  -2.489  -2.489
  142   3HD1  LEU  18          2HD1      LEU  18   8.126  -3.201  -3.201
  143   1HD2  LEU  18          2HD2      LEU  18   6.494   0.073   0.073
  144   2HD2  LEU  18          1HD2      LEU  18   6.267  -1.276  -1.276
  145   3HD2  LEU  18          3HD2      LEU  18   5.626  -1.369  -1.369
  146    H    LEU  19           H        LEU  19  12.216   0.279   0.279
  147    HA   LEU  19           HA       LEU  19  12.431  -0.883  -0.883
  148   1HB   LEU  19          2HB       LEU  19  14.209   1.226   1.226
  149   2HB   LEU  19          1HB       LEU  19  14.063   0.853   0.853
  150    HG   LEU  19           HG       LEU  19  12.117   2.332   2.332
  151   1HD1  LEU  19          3HD1      LEU  19  13.349   2.799   2.799
  152   2HD1  LEU  19          2HD1      LEU  19  12.203   3.886   3.886
  153   3HD1  LEU  19          1HD1      LEU  19  13.785   3.590   3.590
  154   1HD2  LEU  19          1HD2      LEU  19  10.848   0.514   0.514
  155   2HD2  LEU  19          3HD2      LEU  19  10.376   2.158   2.158
  156   3HD2  LEU  19          2HD2      LEU  19  11.424   1.246   1.246
  157    H    LYS  20           H        LYS  20  13.835  -1.248  -1.248
  158    HA   LYS  20           HA       LYS  20  16.307  -2.493  -2.493
  159   1HB   LYS  20          2HB       LYS  20  15.266  -2.580  -2.580
  160   2HB   LYS  20          1HB       LYS  20  16.929  -2.776  -2.776
  161   1HG   LYS  20          2HG       LYS  20  15.908  -0.236  -0.236
  162   2HG   LYS  20          1HG       LYS  20  15.642  -0.380  -0.380
  163   1HD   LYS  20          2HD       LYS  20  18.294  -0.815  -0.815
  164   2HD   LYS  20          1HD       LYS  20  17.840   0.627   0.627
  165   1HE   LYS  20          2HE       LYS  20  17.303  -1.438  -1.438
  166   2HE   LYS  20          1HE       LYS  20  18.787  -1.961  -1.961
  167   1HZ   LYS  20          2HZ       LYS  20  19.624   0.362   0.362
  168   2HZ   LYS  20          1HZ       LYS  20  18.297   0.558   0.558
  169   3HZ   LYS  20          3HZ       LYS  20  19.457  -0.636  -0.636
  170    H    VAL  21           H        VAL  21  13.125  -3.370  -3.370
  171    HA   VAL  21           HA       VAL  21  13.697  -6.215  -6.215
  172    HB   VAL  21           HB       VAL  21  11.885  -5.045  -5.045
  173   1HG1  VAL  21          3HG1      VAL  21  11.200  -3.551  -3.551
  174   2HG1  VAL  21          2HG1      VAL  21  10.407  -4.934  -4.934
  175   3HG1  VAL  21          1HG1      VAL  21   9.858  -4.334  -4.334
  176   1HG2  VAL  21          2HG2      VAL  21  11.892  -7.565  -7.565
  177   2HG2  VAL  21          1HG2      VAL  21  10.621  -6.954  -6.954
  178   3HG2  VAL  21          3HG2      VAL  21  10.385  -6.961  -6.961
  179    H    LEU  22           H        LEU  22  12.209  -4.066  -4.066
  180    HA   LEU  22           HA       LEU  22  11.398  -6.021  -6.021
  181   1HB   LEU  22          2HB       LEU  22  11.762  -3.087  -3.087
  182   2HB   LEU  22          1HB       LEU  22  11.937  -3.729  -3.729
  183    HG   LEU  22           HG       LEU  22   9.720  -4.690  -4.690
  184   1HD1  LEU  22          3HD1      LEU  22   9.814  -5.324  -5.324
  185   2HD1  LEU  22          2HD1      LEU  22   9.477  -3.640  -3.640
  186   3HD1  LEU  22          1HD1      LEU  22   8.292  -4.592  -4.592
  187   1HD2  LEU  22          1HD2      LEU  22  10.075  -1.845  -1.845
  188   2HD2  LEU  22          3HD2      LEU  22   9.524  -2.467  -2.467
  189   3HD2  LEU  22          2HD2      LEU  22   8.442  -2.491  -2.491
  190    H    GLY  23           H        GLY  23  14.178  -3.853  -3.853
  191   1HA   GLY  23          2HA       GLY  23  15.589  -5.479  -5.479
  192   2HA   GLY  23          1HA       GLY  23  16.010  -3.829  -3.829
  193    H    VAL  24           H        VAL  24  18.153  -4.297  -4.297
  194    HA   VAL  24           HA       VAL  24  18.655  -5.459  -5.459
  195    HB   VAL  24           HB       VAL  24  20.440  -6.985  -6.985
  196   1HG1  VAL  24          3HG1      VAL  24  18.027  -7.686  -7.686
  197   2HG1  VAL  24          2HG1      VAL  24  17.758  -7.641  -7.641
  198   3HG1  VAL  24          1HG1      VAL  24  18.942  -8.756  -8.756
  199   1HG2  VAL  24          3HG2      VAL  24  19.198  -6.160  -6.160
  200   2HG2  VAL  24          2HG2      VAL  24  20.881  -5.976  -5.976
  201   3HG2  VAL  24          1HG2      VAL  24  20.223  -7.583  -7.583
  202    H    ASN  25           H        ASN  25  20.033  -4.066  -4.066
  203    HA   ASN  25           HA       ASN  25  22.528  -3.207  -3.207
  204   1HB   ASN  25          2HB       ASN  25  21.340  -3.079  -3.079
  205   2HB   ASN  25          1HB       ASN  25  21.073  -1.425  -1.425
  206   1HD2  ASN  25          2HD2      ASN  25  24.399  -0.466  -0.466
  207   2HD2  ASN  25          1HD2      ASN  25  22.812   0.006   0.006
  208    H    VAL  26           H        VAL  26  22.752  -0.503  -0.503
  209    HA   VAL  26           HA       VAL  26  20.909   0.449   0.449
  210    HB   VAL  26           HB       VAL  26  22.835   2.003   2.003
  211   1HG1  VAL  26          3HG1      VAL  26  22.173  -0.440  -0.440
  212   2HG1  VAL  26          2HG1      VAL  26  23.815  -0.777  -0.777
  213   3HG1  VAL  26          1HG1      VAL  26  23.525   0.487   0.487
  214   1HG2  VAL  26          2HG2      VAL  26  24.345   0.061   0.061
  215   2HG2  VAL  26          1HG2      VAL  26  24.154   1.792   1.792
  216   3HG2  VAL  26          3HG2      VAL  26  25.095   1.217   1.217
  217    H    MET  27           H        MET  27  22.803   1.479   1.479
  218    HA   MET  27           HA       MET  27  21.680   4.135   4.135
  219   1HB   MET  27          2HB       MET  27  23.792   3.422   3.422
  220   2HB   MET  27          1HB       MET  27  22.803   2.491   2.491
  221   1HG   MET  27          2HG       MET  27  21.783   4.430   4.430
  222   2HG   MET  27          1HG       MET  27  22.292   5.426   5.426
  223   1HE   MET  27          3HE       MET  27  23.336   7.066   7.066
  224   2HE   MET  27          2HE       MET  27  24.990   6.668   6.668
  225   3HE   MET  27          1HE       MET  27  24.669   7.386   7.386
  226    H    LEU  28           H        LEU  28  20.684   0.994   0.994
  227    HA   LEU  28           HA       LEU  28  18.770   1.666   1.666
  228   1HB   LEU  28          2HB       LEU  28  19.343  -0.585  -0.585
  229   2HB   LEU  28          1HB       LEU  28  17.658  -0.482  -0.482
  230    HG   LEU  28           HG       LEU  28  18.944  -1.877  -1.877
  231   1HD1  LEU  28          1HD1      LEU  28  17.150   0.012   0.012
  232   2HD1  LEU  28          3HD1      LEU  28  18.538   0.590   0.590
  233   3HD1  LEU  28          2HD1      LEU  28  17.923  -1.041  -1.041
  234   1HD2  LEU  28          1HD2      LEU  28  20.608   0.638   0.638
  235   2HD2  LEU  28          3HD2      LEU  28  21.153  -0.925  -0.925
  236   3HD2  LEU  28          2HD2      LEU  28  20.702  -0.748  -0.748
  237    H    ARG  29           H        ARG  29  18.323   1.394   1.394
  238    HA   ARG  29           HA       ARG  29  15.530   2.017   2.017
  239   1HB   ARG  29          2HB       ARG  29  17.507   2.624   2.624
  240   2HB   ARG  29          1HB       ARG  29  15.771   2.384   2.384
  241   1HG   ARG  29          2HG       ARG  29  16.088   0.167   0.167
  242   2HG   ARG  29          1HG       ARG  29  16.845   0.088   0.088
  243   1HD   ARG  29          2HD       ARG  29  18.308  -0.728  -0.728
  244   2HD   ARG  29          1HD       ARG  29  19.017   0.568   0.568
  245    HE   ARG  29           HE       ARG  29  17.563   1.363   1.363
  246   1HH1  ARG  29          2HH1      ARG  29  19.174   3.461   3.461
  247   2HH1  ARG  29          1HH1      ARG  29  20.724   3.225   3.225
  248   1HH2  ARG  29          1HH2      ARG  29  20.143  -0.103  -0.103
  249   2HH2  ARG  29          2HH2      ARG  29  21.272   1.208   1.208
  250    H    LYS  30           H        LYS  30  18.431   4.035   4.035
  251    HA   LYS  30           HA       LYS  30  17.106   6.492   6.492
  252   1HB   LYS  30          2HB       LYS  30  19.622   5.944   5.944
  253   2HB   LYS  30          1HB       LYS  30  19.664   6.298   6.298
  254   1HG   LYS  30          2HG       LYS  30  19.191   8.546   8.546
  255   2HG   LYS  30          1HG       LYS  30  18.331   8.266   8.266
  256   1HD   LYS  30          2HD       LYS  30  20.405   7.869   7.869
  257   2HD   LYS  30          1HD       LYS  30  21.323   7.908   7.908
  258   1HE   LYS  30          2HE       LYS  30  21.670  10.078  10.078
  259   2HE   LYS  30          1HE       LYS  30  20.202  10.309  10.309
  260   1HZ   LYS  30          2HZ       LYS  30  18.957   9.878   9.878
  261   2HZ   LYS  30          1HZ       LYS  30  20.441  10.014  10.014
  262   3HZ   LYS  30          3HZ       LYS  30  19.829  11.336  11.336
  263    H    ILE  31           H        ILE  31  17.196   4.669   4.669
  264    HA   ILE  31           HA       ILE  31  16.753   7.010   7.010
  265    HB   ILE  31           HB       ILE  31  16.547   4.032   4.032
  266   1HG1  ILE  31          2HG1      ILE  31  18.825   4.810   4.810
  267   2HG1  ILE  31          1HG1      ILE  31  18.717   4.352   4.352
  268   1HG2  ILE  31          2HG2      ILE  31  16.051   6.482   6.482
  269   2HG2  ILE  31          1HG2      ILE  31  16.901   5.151   5.151
  270   3HG2  ILE  31          3HG2      ILE  31  15.295   4.893   4.893
  271   1HD1  ILE  31          1HD1      ILE  31  18.316   6.802   6.802
  272   2HD1  ILE  31          3HD1      ILE  31  18.716   7.155   7.155
  273   3HD1  ILE  31          2HD1      ILE  31  19.925   6.433   6.433
  274    H    ALA  32           H        ALA  32  14.889   4.587   4.587
  275    HA   ALA  32           HA       ALA  32  12.374   5.315   5.315
  276   1HB   ALA  32          3HB       ALA  32  13.313   3.154   3.154
  277   2HB   ALA  32          2HB       ALA  32  11.885   3.862   3.862
  278   3HB   ALA  32          1HB       ALA  32  11.803   3.269   3.269
  279    H    VAL  33           H        VAL  33  14.208   6.230   6.230
  280    HA   VAL  33           HA       VAL  33  11.985   7.553   7.553
  281    HB   VAL  33           HB       VAL  33  14.921   8.072   8.072
  282   1HG1  VAL  33          2HG1      VAL  33  12.341   8.312   8.312
  283   2HG1  VAL  33          1HG1      VAL  33  13.848   8.086   8.086
  284   3HG1  VAL  33          3HG1      VAL  33  13.648   9.484   9.484
  285   1HG2  VAL  33          1HG2      VAL  33  13.592   5.520   5.520
  286   2HG2  VAL  33          3HG2      VAL  33  15.253   5.917   5.917
  287   3HG2  VAL  33          2HG2      VAL  33  13.972   6.063   6.063
  288    H    ALA  34           H        ALA  34  14.816   8.476   8.476
  289    HA   ALA  34           HA       ALA  34  14.299  11.300  11.300
  290   1HB   ALA  34          2HB       ALA  34  15.855   9.590   9.590
  291   2HB   ALA  34          1HB       ALA  34  15.866  11.353  11.353
  292   3HB   ALA  34          3HB       ALA  34  16.519  10.461  10.461
  293    H    ALA  35           H        ALA  35  13.459   8.661   8.661
  294    HA   ALA  35           HA       ALA  35  12.185  10.206  10.206
  295   1HB   ALA  35          1HB       ALA  35  12.768   7.779   7.779
  296   2HB   ALA  35          3HB       ALA  35  11.489   7.399   7.399
  297   3HB   ALA  35          2HB       ALA  35  11.084   8.106   8.106
  298    H    ALA  36           H        ALA  36  10.874   8.555   8.555
  299    HA   ALA  36           HA       ALA  36   8.167   9.137   9.137
  300   1HB   ALA  36          1HB       ALA  36  10.013   8.684   8.684
  301   2HB   ALA  36          3HB       ALA  36   8.425   9.358   9.358
  302   3HB   ALA  36          2HB       ALA  36   8.554   7.807   7.807
  303    H    SER  37           H        SER  37  10.209  11.043  11.043
  304    HA   SER  37           HA       SER  37   9.973  13.293  13.293
  305   1HB   SER  37          2HB       SER  37  10.969  13.352  13.352
  306   2HB   SER  37          1HB       SER  37   9.365  13.893  13.893
  307    HG   SER  37           HG       SER  37   9.573  15.624  15.624
  308    H    LYS  38           H        LYS  38   7.673  11.915  11.915
  309    HA   LYS  38           HA       LYS  38   5.409  12.290  12.290
  310   1HB   LYS  38          2HB       LYS  38   5.584  14.963  14.963
  311   2HB   LYS  38          1HB       LYS  38   4.463  14.476  14.476
  312   1HG   LYS  38          2HG       LYS  38   6.523  14.200  14.200
  313   2HG   LYS  38          1HG       LYS  38   7.412  15.080  15.080
  314   1HD   LYS  38          2HD       LYS  38   5.609  16.880  16.880
  315   2HD   LYS  38          1HD       LYS  38   5.056  16.051  16.051
  316   1HE   LYS  38          2HE       LYS  38   6.548  17.535  17.535
  317   2HE   LYS  38          1HE       LYS  38   7.644  16.192  16.192
  318   1HZ   LYS  38          1HZ       LYS  38   8.054  17.291  17.291
  319   2HZ   LYS  38          3HZ       LYS  38   7.252  18.655  18.655
  320   3HZ   LYS  38          2HZ       LYS  38   8.677  18.104  18.104
  321    HA   PRO  39           HA       PRO  39   4.867  11.098  11.098
  322   1HB   PRO  39          2HB       PRO  39   3.996   8.540   8.540
  323   2HB   PRO  39          1HB       PRO  39   5.693   8.980   8.980
  324   1HG   PRO  39          2HG       PRO  39   4.274   8.358   8.358
  325   2HG   PRO  39          1HG       PRO  39   5.977   8.119   8.119
  326   1HD   PRO  39          2HD       PRO  39   5.006  10.210  10.210
  327   2HD   PRO  39          1HD       PRO  39   6.578  10.199  10.199
  328    H    ALA  40           H        ALA  40   2.714   9.938   9.938
  329    HA   ALA  40           HA       ALA  40   0.418  11.016  11.016
  330   1HB   ALA  40          1HB       ALA  40   0.960  12.374  12.374
  331   2HB   ALA  40          3HB       ALA  40   0.674  10.944  10.944
  332   3HB   ALA  40          2HB       ALA  40  -0.649  11.653  11.653
  333    H    VAL  41           H        VAL  41  -1.705  10.036  10.036
  334    HA   VAL  41           HA       VAL  41  -1.537   7.310   7.310
  335    HB   VAL  41           HB       VAL  41  -2.290   7.949   7.949
  336   1HG1  VAL  41          2HG1      VAL  41  -2.925   5.460   5.460
  337   2HG1  VAL  41          1HG1      VAL  41  -3.009   5.546   5.546
  338   3HG1  VAL  41          3HG1      VAL  41  -4.081   6.543   6.543
  339   1HG2  VAL  41          1HG2      VAL  41  -0.213   6.323   6.323
  340   2HG2  VAL  41          3HG2      VAL  41  -0.051   7.370   7.370
  341   3HG2  VAL  41          2HG2      VAL  41  -0.783   5.774   5.774
  342    H    GLU  42           H        GLU  42  -3.852   6.451   6.451
  343    HA   GLU  42           HA       GLU  42  -5.998   8.465   8.465
  344   1HB   GLU  42          2HB       GLU  42  -4.846   8.967   8.967
  345   2HB   GLU  42          1HB       GLU  42  -5.127   7.301   7.301
  346   1HG   GLU  42          2HG       GLU  42  -7.471   8.919   8.919
  347   2HG   GLU  42          1HG       GLU  42  -6.814   9.254   9.254
  348    H    ILE  43           H        ILE  43  -7.513   7.189   7.189
  349    HA   ILE  43           HA       ILE  43  -7.651   4.324   4.324
  350    HB   ILE  43           HB       ILE  43  -8.740   5.920   5.920
  351   1HG1  ILE  43          2HG1      ILE  43  -7.522   3.726   3.726
  352   2HG1  ILE  43          1HG1      ILE  43  -6.644   3.871   3.871
  353   1HG2  ILE  43          2HG2      ILE  43  -9.759   3.354   3.354
  354   2HG2  ILE  43          1HG2      ILE  43  -9.457   3.379   3.379
  355   3HG2  ILE  43          3HG2      ILE  43 -10.569   4.544   4.544
  356   1HD1  ILE  43          3HD1      ILE  43  -7.029   6.142   6.142
  357   2HD1  ILE  43          2HD1      ILE  43  -5.582   5.138   5.138
  358   3HD1  ILE  43          1HD1      ILE  43  -6.028   6.160   6.160
  359    H    LYS  44           H        LYS  44  -9.439   3.396   3.396
  360    HA   LYS  44           HA       LYS  44 -11.648   5.224   5.224
  361   1HB   LYS  44          2HB       LYS  44 -11.203   2.744   2.744
  362   2HB   LYS  44          1HB       LYS  44 -11.619   4.360   4.360
  363   1HG   LYS  44          2HG       LYS  44  -9.279   5.072   5.072
  364   2HG   LYS  44          1HG       LYS  44  -8.845   3.510   3.510
  365   1HD   LYS  44          2HD       LYS  44  -9.378   2.385   2.385
  366   2HD   LYS  44          1HD       LYS  44 -10.066   3.860   3.860
  367   1HE   LYS  44          2HE       LYS  44  -7.254   4.013   4.013
  368   2HE   LYS  44          1HE       LYS  44  -7.540   3.093   3.093
  369   1HZ   LYS  44          3HZ       LYS  44  -8.664   5.799   5.799
  370   2HZ   LYS  44          2HZ       LYS  44  -7.098   5.568   5.568
  371   3HZ   LYS  44          1HZ       LYS  44  -8.441   4.944   4.944
  372    H    GLN  45           H        GLN  45 -13.356   4.679   4.679
  373    HA   GLN  45           HA       GLN  45 -13.611   1.838   1.838
  374   1HB   GLN  45          2HB       GLN  45 -13.701   3.555   3.555
  375   2HB   GLN  45          1HB       GLN  45 -15.109   4.282   4.282
  376   1HG   GLN  45          2HG       GLN  45 -16.416   2.272   2.272
  377   2HG   GLN  45          1HG       GLN  45 -15.005   1.400   1.400
  378   1HE2  GLN  45          2HE2      GLN  45 -16.343   2.285   2.285
  379   2HE2  GLN  45          1HE2      GLN  45 -16.239   1.039   1.039
  380    H    GLU  46           H        GLU  46 -14.896   0.557   0.557
  381    HA   GLU  46           HA       GLU  46 -17.368   1.731   1.731
  382   1HB   GLU  46          2HB       GLU  46 -15.419  -0.317  -0.317
  383   2HB   GLU  46          1HB       GLU  46 -17.104  -0.366  -0.366
  384   1HG   GLU  46          2HG       GLU  46 -16.976   1.708   1.708
  385   2HG   GLU  46          1HG       GLU  46 -15.601   2.233   2.233
  386    H    GLY  47           H        GLY  47 -17.378   0.889   0.889
  387   1HA   GLY  47          2HA       GLY  47 -19.059  -0.367  -0.367
  388   2HA   GLY  47          1HA       GLY  47 -19.126  -1.512  -1.512
  389    H    ASP  48           H        ASP  48 -18.364  -3.464  -3.464
  390    HA   ASP  48           HA       ASP  48 -16.432  -3.694  -3.694
  391   1HB   ASP  48          2HB       ASP  48 -16.368  -6.141  -6.141
  392   2HB   ASP  48          1HB       ASP  48 -17.898  -5.550  -5.550
  393    H    THR  49           H        THR  49 -16.013  -2.825  -2.825
  394    HA   THR  49           HA       THR  49 -13.445  -4.254  -4.254
  395    HB   THR  49           HB       THR  49 -15.217  -2.664  -2.664
  396    HG1  THR  49           HG1      THR  49 -15.637  -4.824  -4.824
  397   1HG2  THR  49          1HG2      THR  49 -12.281  -3.071  -3.071
  398   2HG2  THR  49          3HG2      THR  49 -13.226  -3.406  -3.406
  399   3HG2  THR  49          2HG2      THR  49 -13.300  -1.812  -1.812
  400    H    PHE  50           H        PHE  50 -11.522  -3.196  -3.196
  401    HA   PHE  50           HA       PHE  50 -11.613  -0.232  -0.232
  402   1HB   PHE  50          2HB       PHE  50 -10.190  -2.196  -2.196
  403   2HB   PHE  50          1HB       PHE  50  -9.984  -0.443  -0.443
  404    HD1  PHE  50           HD2      PHE  50 -11.903   1.027   1.027
  405    HD2  PHE  50           HD1      PHE  50 -12.183  -3.247  -3.247
  406    HE1  PHE  50           HE2      PHE  50 -13.993   1.217   1.217
  407    HE2  PHE  50           HE1      PHE  50 -14.277  -3.059  -3.059
  408    HZ   PHE  50           HZ       PHE  50 -15.192  -0.832  -0.832
  409    H    TYR  51           H        TYR  51 -10.242   0.677   0.677
  410    HA   TYR  51           HA       TYR  51  -7.984  -0.906  -0.906
  411   1HB   TYR  51          2HB       TYR  51  -9.695  -0.007  -0.007
  412   2HB   TYR  51          1HB       TYR  51  -9.336   1.617   1.617
  413    HD1  TYR  51           HD1      TYR  51  -6.808   2.327   2.327
  414    HD2  TYR  51           HD2      TYR  51  -8.541  -0.864  -0.864
  415    HE1  TYR  51           HE1      TYR  51  -4.960   2.495   2.495
  416    HE2  TYR  51           HE2      TYR  51  -6.698  -0.701  -0.701
  417    HH   TYR  51           HH       TYR  51  -4.493   0.120   0.120
  418    H    ILE  52           H        ILE  52  -5.877  -0.091  -0.091
  419    HA   ILE  52           HA       ILE  52  -5.669   2.481   2.481
  420    HB   ILE  52           HB       ILE  52  -3.505   0.463   0.463
  421   1HG1  ILE  52          2HG1      ILE  52  -5.661  -0.858  -0.858
  422   2HG1  ILE  52          1HG1      ILE  52  -4.666  -0.805  -0.805
  423   1HG2  ILE  52          3HG2      ILE  52  -4.908   2.486   2.486
  424   2HG2  ILE  52          2HG2      ILE  52  -3.616   1.429   1.429
  425   3HG2  ILE  52          1HG2      ILE  52  -3.295   2.613   2.613
  426   1HD1  ILE  52          3HD1      ILE  52  -6.818   1.252   1.252
  427   2HD1  ILE  52          2HD1      ILE  52  -7.254  -0.368  -0.368
  428   3HD1  ILE  52          1HD1      ILE  52  -6.142   0.614   0.614
  429    H    LYS  53           H        LYS  53  -4.815   3.949   3.949
  430    HA   LYS  53           HA       LYS  53  -2.751   3.048   3.048
  431   1HB   LYS  53          2HB       LYS  53  -4.985   4.336   4.336
  432   2HB   LYS  53          1HB       LYS  53  -4.084   5.747   5.747
  433   1HG   LYS  53          2HG       LYS  53  -2.199   4.667   4.667
  434   2HG   LYS  53          1HG       LYS  53  -3.622   4.009   4.009
  435   1HD   LYS  53          2HD       LYS  53  -4.489   6.147   6.147
  436   2HD   LYS  53          1HD       LYS  53  -3.474   6.932   6.932
  437   1HE   LYS  53          2HE       LYS  53  -1.727   7.130   7.130
  438   2HE   LYS  53          1HE       LYS  53  -1.936   5.494   5.494
  439   1HZ   LYS  53          1HZ       LYS  53  -3.923   7.524   7.524
  440   2HZ   LYS  53          3HZ       LYS  53  -2.408   7.578   7.578
  441   3HZ   LYS  53          2HZ       LYS  53  -3.369   6.182   6.182
  442    H    THR  54           H        THR  54  -0.797   3.305   3.305
  443    HA   THR  54           HA       THR  54  -0.386   5.875   5.875
  444    HB   THR  54           HB       THR  54   1.453   3.470   3.470
  445    HG1  THR  54           HG1      THR  54  -0.377   2.701   2.701
  446   1HG2  THR  54          3HG2      THR  54   1.790   6.052   6.052
  447   2HG2  THR  54          2HG2      THR  54   1.349   5.090   5.090
  448   3HG2  THR  54          1HG2      THR  54   2.741   4.631   4.631
  449    H    SER  55           H        SER  55   1.261   7.307   7.307
  450    HA   SER  55           HA       SER  55   3.094   6.571   6.571
  451   1HB   SER  55          2HB       SER  55   2.228   8.724   8.724
  452   2HB   SER  55          1HB       SER  55   1.419   7.177   7.177
  453    HG   SER  55           HG       SER  55   0.674   9.313   9.313
  454    H    THR  56           H        THR  56   4.981   7.557   7.557
  455    HA   THR  56           HA       THR  56   4.982   9.850   9.850
  456    HB   THR  56           HB       THR  56   7.333   8.233   8.233
  457    HG1  THR  56           HG1      THR  56   5.529   7.805   7.805
  458   1HG2  THR  56          3HG2      THR  56   7.798  10.416  10.416
  459   2HG2  THR  56          2HG2      THR  56   6.899   9.930   9.930
  460   3HG2  THR  56          1HG2      THR  56   8.382   9.085   9.085
  461    H    THR  57           H        THR  57   6.945   8.888   8.888
  462    HA   THR  57           HA       THR  57   6.419  11.176  11.176
  463    HB   THR  57           HB       THR  57   7.521  12.472  12.472
  464    HG1  THR  57           HG1      THR  57   8.811  13.482  13.482
  465   1HG2  THR  57          2HG2      THR  57   8.768  10.415  10.415
  466   2HG2  THR  57          1HG2      THR  57   9.971  10.753  10.753
  467   3HG2  THR  57          3HG2      THR  57   9.651  11.942  11.942
  468    H    VAL  58           H        VAL  58   8.860   8.887   8.887
  469    HA   VAL  58           HA       VAL  58   9.645   8.397   8.397
  470    HB   VAL  58           HB       VAL  58  11.140   7.612   7.612
  471   1HG1  VAL  58          2HG1      VAL  58  11.928   7.676   7.676
  472   2HG1  VAL  58          1HG1      VAL  58  13.005   7.259   7.259
  473   3HG1  VAL  58          3HG1      VAL  58  11.625   6.226   6.226
  474   1HG2  VAL  58          1HG2      VAL  58  10.986  10.157  10.157
  475   2HG2  VAL  58          3HG2      VAL  58  11.661   9.818   9.818
  476   3HG2  VAL  58          2HG2      VAL  58  12.634   9.547   9.547
  477    H    ARG  59           H        ARG  59   8.003   7.086   7.086
  478    HA   ARG  59           HA       ARG  59   7.901   4.439   4.439
  479   1HB   ARG  59          2HB       ARG  59   9.250   4.298   4.298
  480   2HB   ARG  59          1HB       ARG  59   7.876   4.925   4.925
  481   1HG   ARG  59          2HG       ARG  59   6.579   3.007   3.007
  482   2HG   ARG  59          1HG       ARG  59   7.568   2.503   2.503
  483   1HD   ARG  59          2HD       ARG  59   8.515   1.085   1.085
  484   2HD   ARG  59          1HD       ARG  59   9.436   2.513   2.513
  485    HE   ARG  59           HE       ARG  59   7.321   1.248   1.248
  486   1HH1  ARG  59          2HH1      ARG  59   6.191   3.883   3.883
  487   2HH1  ARG  59          1HH1      ARG  59   7.085   4.750   4.750
  488   1HH2  ARG  59          1HH2      ARG  59   9.704   2.479   2.479
  489   2HH2  ARG  59          2HH2      ARG  59   9.074   3.955   3.955
  490    H    THR  60           H        THR  60   5.850   3.261   3.261
  491    HA   THR  60           HA       THR  60   3.607   4.754   4.754
  492    HB   THR  60           HB       THR  60   3.702   4.197   4.197
  493    HG1  THR  60           HG1      THR  60   4.411   6.148   6.148
  494   1HG2  THR  60          1HG2      THR  60   1.563   5.140   5.140
  495   2HG2  THR  60          3HG2      THR  60   1.567   5.725   5.725
  496   3HG2  THR  60          2HG2      THR  60   1.443   3.996   3.996
  497    H    THR  61           H        THR  61   2.597   3.109   3.109
  498    HA   THR  61           HA       THR  61   2.528   0.416   0.416
  499    HB   THR  61           HB       THR  61   1.822  -0.280  -0.280
  500    HG1  THR  61           HG1      THR  61   1.545   1.417   1.417
  501   1HG2  THR  61          3HG2      THR  61   4.029  -0.765  -0.765
  502   2HG2  THR  61          2HG2      THR  61   4.598   0.831   0.831
  503   3HG2  THR  61          1HG2      THR  61   4.175  -0.370  -0.370
  504    H    GLU  62           H        GLU  62   0.453  -0.784  -0.784
  505    HA   GLU  62           HA       GLU  62  -1.953   0.805   0.805
  506   1HB   GLU  62          2HB       GLU  62  -1.019   0.239   0.239
  507   2HB   GLU  62          1HB       GLU  62  -2.711  -0.148  -0.148
  508   1HG   GLU  62          2HG       GLU  62  -3.156   2.106   2.106
  509   2HG   GLU  62          1HG       GLU  62  -1.442   2.517   2.517
  510    H    ILE  63           H        ILE  63  -3.583  -0.540  -0.540
  511    HA   ILE  63           HA       ILE  63  -3.406  -3.434  -3.434
  512    HB   ILE  63           HB       ILE  63  -3.665  -4.159  -4.159
  513   1HG1  ILE  63          2HG1      ILE  63  -3.666  -1.226  -1.226
  514   2HG1  ILE  63          1HG1      ILE  63  -5.091  -2.257  -2.257
  515   1HG2  ILE  63          3HG2      ILE  63  -1.382  -3.348  -3.348
  516   2HG2  ILE  63          2HG2      ILE  63  -1.563  -2.021  -2.021
  517   3HG2  ILE  63          1HG2      ILE  63  -1.513  -3.687  -3.687
  518   1HD1  ILE  63          1HD1      ILE  63  -3.359  -3.795  -3.795
  519   2HD1  ILE  63          3HD1      ILE  63  -2.893  -2.168  -2.168
  520   3HD1  ILE  63          2HD1      ILE  63  -4.560  -2.708  -2.708
  521    H    ASN  64           H        ASN  64  -5.503  -4.572  -4.572
  522    HA   ASN  64           HA       ASN  64  -7.865  -2.888  -2.888
  523   1HB   ASN  64          2HB       ASN  64  -8.957  -3.605  -3.605
  524   2HB   ASN  64          1HB       ASN  64  -7.570  -2.552  -2.552
  525   1HD2  ASN  64          2HD2      ASN  64  -5.485  -5.193  -5.193
  526   2HD2  ASN  64          1HD2      ASN  64  -5.413  -3.797  -3.797
  527    H    PHE  65           H        PHE  65  -9.416  -4.152  -4.152
  528    HA   PHE  65           HA       PHE  65  -9.622  -7.023  -7.023
  529   1HB   PHE  65          2HB       PHE  65  -8.966  -7.793  -7.793
  530   2HB   PHE  65          1HB       PHE  65  -7.634  -6.911  -6.911
  531    HD1  PHE  65           HD2      PHE  65  -7.179  -4.523  -4.523
  532    HD2  PHE  65           HD1      PHE  65 -10.052  -6.996  -6.996
  533    HE1  PHE  65           HE2      PHE  65  -7.209  -2.934  -2.934
  534    HE2  PHE  65           HE1      PHE  65 -10.092  -5.411  -5.411
  535    HZ   PHE  65           HZ       PHE  65  -8.676  -3.376  -3.376
  536    H    LYS  66           H        LYS  66 -10.932  -8.022  -8.022
  537    HA   LYS  66           HA       LYS  66 -13.175  -6.175  -6.175
  538   1HB   LYS  66          2HB       LYS  66 -14.668  -8.245  -8.245
  539   2HB   LYS  66          1HB       LYS  66 -14.106  -7.572  -7.572
  540   1HG   LYS  66          2HG       LYS  66 -12.207  -9.232  -9.232
  541   2HG   LYS  66          1HG       LYS  66 -12.978  -9.975  -9.975
  542   1HD   LYS  66          2HD       LYS  66 -13.750 -11.228 -11.228
  543   2HD   LYS  66          1HD       LYS  66 -15.087 -10.167 -10.167
  544   1HE   LYS  66          2HE       LYS  66 -15.044  -9.632  -9.632
  545   2HE   LYS  66          1HE       LYS  66 -13.738  -8.555  -8.555
  546   1HZ   LYS  66          3HZ       LYS  66 -12.203 -10.469 -10.469
  547   2HZ   LYS  66          2HZ       LYS  66 -13.508 -11.280 -11.280
  548   3HZ   LYS  66          1HZ       LYS  66 -12.937  -9.822  -9.822
  549    H    VAL  67           H        VAL  67 -14.197  -6.763  -6.763
  550    HA   VAL  67           HA       VAL  67 -12.207  -7.930  -7.930
  551    HB   VAL  67           HB       VAL  67 -14.878  -7.349  -7.349
  552   1HG1  VAL  67          2HG1      VAL  67 -11.989  -6.710  -6.710
  553   2HG1  VAL  67          1HG1      VAL  67 -13.295  -5.946  -5.946
  554   3HG1  VAL  67          3HG1      VAL  67 -13.108  -7.700  -7.700
  555   1HG2  VAL  67          1HG2      VAL  67 -13.307  -5.246  -5.246
  556   2HG2  VAL  67          3HG2      VAL  67 -15.050  -5.506  -5.506
  557   3HG2  VAL  67          2HG2      VAL  67 -14.239  -4.826  -4.826
  558    H    GLY  68           H        GLY  68 -12.139 -10.161 -10.161
  559   1HA   GLY  68          2HA       GLY  68 -13.488 -12.032 -12.032
  560   2HA   GLY  68          1HA       GLY  68 -14.684 -11.677 -11.677
  561    H    GLU  69           H        GLU  69 -12.381 -11.162 -11.162
  562    HA   GLU  69           HA       GLU  69 -11.661 -14.036 -14.036
  563   1HB   GLU  69          2HB       GLU  69 -12.319 -11.951 -11.951
  564   2HB   GLU  69          1HB       GLU  69 -11.888 -13.633 -13.633
  565   1HG   GLU  69          2HG       GLU  69 -14.129 -13.201 -13.201
  566   2HG   GLU  69          1HG       GLU  69 -14.453 -12.783 -12.783
  567    H    GLU  70           H        GLU  70  -9.640 -14.376 -14.376
  568    HA   GLU  70           HA       GLU  70  -7.606 -12.371 -12.371
  569   1HB   GLU  70          2HB       GLU  70  -7.291 -15.066 -15.066
  570   2HB   GLU  70          1HB       GLU  70  -5.999 -14.088 -14.088
  571   1HG   GLU  70          2HG       GLU  70  -6.539 -14.659 -14.659
  572   2HG   GLU  70          1HG       GLU  70  -8.270 -14.698 -14.698
  573    H    PHE  71           H        PHE  71  -5.865 -11.945 -11.945
  574    HA   PHE  71           HA       PHE  71  -6.723 -11.988 -11.988
  575   1HB   PHE  71          2HB       PHE  71  -6.693  -9.481  -9.481
  576   2HB   PHE  71          1HB       PHE  71  -8.053 -10.097 -10.097
  577    HD1  PHE  71           HD2      PHE  71  -7.798 -10.189 -10.189
  578    HD2  PHE  71           HD1      PHE  71  -5.194  -7.938  -7.938
  579    HE1  PHE  71           HE2      PHE  71  -7.064  -8.828  -8.828
  580    HE2  PHE  71           HE1      PHE  71  -4.461  -6.574  -6.574
  581    HZ   PHE  71           HZ       PHE  71  -5.395  -7.018  -7.018
  582    H    GLU  72           H        GLU  72  -5.092 -10.572 -10.572
  583    HA   GLU  72           HA       GLU  72  -2.411 -10.907 -10.907
  584   1HB   GLU  72          2HB       GLU  72  -2.737 -10.628 -10.628
  585   2HB   GLU  72          1HB       GLU  72  -1.456 -11.418 -11.418
  586   1HG   GLU  72          2HG       GLU  72  -3.171 -13.147 -13.147
  587   2HG   GLU  72          1HG       GLU  72  -4.270 -12.439 -12.439
  588    H    GLU  73           H        GLU  73  -1.003  -9.168  -9.168
  589    HA   GLU  73           HA       GLU  73  -1.555  -6.759  -6.759
  590   1HB   GLU  73          2HB       GLU  73  -2.054  -5.257  -5.257
  591   2HB   GLU  73          1HB       GLU  73  -3.182  -6.600  -6.600
  592   1HG   GLU  73          2HG       GLU  73  -0.600  -6.410  -6.410
  593   2HG   GLU  73          1HG       GLU  73  -2.168  -5.894  -5.894
  594    H    GLN  74           H        GLN  74  -0.089  -4.946  -4.946
  595    HA   GLN  74           HA       GLN  74   2.619  -6.224  -6.224
  596   1HB   GLN  74          2HB       GLN  74   1.632  -3.396  -3.396
  597   2HB   GLN  74          1HB       GLN  74   3.323  -3.710  -3.710
  598   1HG   GLN  74          2HG       GLN  74   3.037  -5.513  -5.513
  599   2HG   GLN  74          1HG       GLN  74   1.798  -4.369  -4.369
  600   1HE2  GLN  74          2HE2      GLN  74   5.734  -3.358  -3.358
  601   2HE2  GLN  74          1HE2      GLN  74   5.269  -4.815  -4.815
  602    H    THR  75           H        THR  75   4.169  -5.526  -5.526
  603    HA   THR  75           HA       THR  75   2.771  -5.240  -5.240
  604    HB   THR  75           HB       THR  75   4.459  -7.090  -7.090
  605    HG1  THR  75           HG1      THR  75   3.838  -6.303  -6.303
  606   1HG2  THR  75          2HG2      THR  75   6.101  -4.880  -4.880
  607   2HG2  THR  75          1HG2      THR  75   6.797  -5.612  -5.612
  608   3HG2  THR  75          3HG2      THR  75   6.516  -6.591  -6.591
  609    H    VAL  76           H        VAL  76   5.438  -4.102  -4.102
  610    HA   VAL  76           HA       VAL  76   4.844  -1.299  -1.299
  611    HB   VAL  76           HB       VAL  76   6.253  -2.297  -2.297
  612   1HG1  VAL  76          3HG1      VAL  76   6.735   0.048   0.048
  613   2HG1  VAL  76          2HG1      VAL  76   5.004   0.385   0.385
  614   3HG1  VAL  76          1HG1      VAL  76   5.846  -0.034  -0.034
  615   1HG2  VAL  76          3HG2      VAL  76   3.862  -3.054  -3.054
  616   2HG2  VAL  76          2HG2      VAL  76   4.149  -1.964  -1.964
  617   3HG2  VAL  76          1HG2      VAL  76   3.386  -1.359  -1.359
  618    H    ASP  77           H        ASP  77   7.335  -3.709  -3.709
  619    HA   ASP  77           HA       ASP  77   9.451  -1.694  -1.694
  620   1HB   ASP  77          2HB       ASP  77   9.535  -4.123  -4.123
  621   2HB   ASP  77          1HB       ASP  77  10.042  -4.560  -4.560
  622    H    GLY  78           H        GLY  78   7.864  -4.320  -4.320
  623   1HA   GLY  78          2HA       GLY  78   7.386  -3.402  -3.402
  624   2HA   GLY  78          1HA       GLY  78   9.147  -3.400  -3.400
  625    H    ARG  79           H        ARG  79   6.936  -5.746  -5.746
  626    HA   ARG  79           HA       ARG  79   7.927  -7.813  -7.813
  627   1HB   ARG  79          2HB       ARG  79   7.987  -7.752  -7.752
  628   2HB   ARG  79          1HB       ARG  79   7.656  -9.289  -9.289
  629   1HG   ARG  79          2HG       ARG  79   9.981  -7.560  -7.560
  630   2HG   ARG  79          1HG       ARG  79  10.125  -8.724  -8.724
  631   1HD   ARG  79          2HD       ARG  79   9.128  -9.462  -9.462
  632   2HD   ARG  79          1HD       ARG  79  10.816  -9.607  -9.607
  633    HE   ARG  79           HE       ARG  79   8.685 -11.025 -11.025
  634   1HH1  ARG  79          2HH1      ARG  79  11.933 -10.897 -10.897
  635   2HH1  ARG  79          1HH1      ARG  79  12.207 -12.552 -12.552
  636   1HH2  ARG  79          1HH2      ARG  79   8.877 -13.192 -13.192
  637   2HH2  ARG  79          2HH2      ARG  79  10.477 -13.851 -13.851
  638    HA   PRO  80           HA       PRO  80   3.603  -8.759  -8.759
  639   1HB   PRO  80          2HB       PRO  80   3.737 -11.354 -11.354
  640   2HB   PRO  80          1HB       PRO  80   4.045  -9.941  -9.941
  641   1HG   PRO  80          2HG       PRO  80   5.987 -11.890 -11.890
  642   2HG   PRO  80          1HG       PRO  80   6.127 -10.892 -10.892
  643   1HD   PRO  80          2HD       PRO  80   7.353 -10.369 -10.369
  644   2HD   PRO  80          1HD       PRO  80   7.219  -9.231  -9.231
  645    H    CYS  81           H        CYS  81   2.046  -9.618  -9.618
  646    HA   CYS  81           HA       CYS  81   2.549 -11.999 -11.999
  647   1HB   CYS  81          2HB       CYS  81   2.225 -10.792 -10.792
  648   2HB   CYS  81          1HB       CYS  81   3.752 -10.415 -10.415
  649    HG   CYS  81           HG       CYS  81   2.508  -8.178  -8.178
  650    H    LYS  82           H        LYS  82   0.617 -12.858 -12.858
  651    HA   LYS  82           HA       LYS  82  -1.854 -11.568 -11.568
  652   1HB   LYS  82          2HB       LYS  82  -1.518 -13.943 -13.943
  653   2HB   LYS  82          1HB       LYS  82  -1.327 -14.298 -14.298
  654   1HG   LYS  82          2HG       LYS  82  -3.706 -13.183 -13.183
  655   2HG   LYS  82          1HG       LYS  82  -3.799 -13.599 -13.599
  656   1HD   LYS  82          2HD       LYS  82  -2.797 -15.723 -15.723
  657   2HD   LYS  82          1HD       LYS  82  -4.510 -15.324 -15.324
  658   1HE   LYS  82          2HE       LYS  82  -4.618 -15.546 -15.546
  659   2HE   LYS  82          1HE       LYS  82  -3.002 -16.248 -16.248
  660   1HZ   LYS  82          2HZ       LYS  82  -5.159 -17.290 -17.290
  661   2HZ   LYS  82          1HZ       LYS  82  -5.048 -17.788 -17.788
  662   3HZ   LYS  82          3HZ       LYS  82  -3.758 -18.074 -18.074
  663    H    SER  83           H        SER  83  -2.958 -10.290 -10.290
  664    HA   SER  83           HA       SER  83  -2.444 -10.551 -10.551
  665   1HB   SER  83          2HB       SER  83  -2.036  -8.331  -8.331
  666   2HB   SER  83          1HB       SER  83  -3.349  -8.326  -8.326
  667    HG   SER  83           HG       SER  83  -3.811  -7.149  -7.149
  668    H    LEU  84           H        LEU  84  -4.406 -10.026 -10.026
  669    HA   LEU  84           HA       LEU  84  -7.022 -10.733 -10.733
  670   1HB   LEU  84          2HB       LEU  84  -6.159 -12.940 -12.940
  671   2HB   LEU  84          1HB       LEU  84  -5.746 -12.327 -12.327
  672    HG   LEU  84           HG       LEU  84  -8.109 -11.952 -11.952
  673   1HD1  LEU  84          2HD1      LEU  84  -8.428 -12.013 -12.013
  674   2HD1  LEU  84          1HD1      LEU  84  -9.323 -13.393 -13.393
  675   3HD1  LEU  84          3HD1      LEU  84  -9.681 -11.772 -11.772
  676   1HD2  LEU  84          1HD2      LEU  84  -7.179 -14.629 -14.629
  677   2HD2  LEU  84          3HD2      LEU  84  -7.557 -14.092 -14.092
  678   3HD2  LEU  84          2HD2      LEU  84  -8.860 -14.454 -14.454
  679    H    VAL  85           H        VAL  85  -8.778 -10.023 -10.023
  680    HA   VAL  85           HA       VAL  85  -7.849  -8.501  -8.501
  681    HB   VAL  85           HB       VAL  85  -9.585  -7.219  -7.219
  682   1HG1  VAL  85          2HG1      VAL  85  -9.643  -6.461  -6.461
  683   2HG1  VAL  85          1HG1      VAL  85  -7.976  -5.934  -5.934
  684   3HG1  VAL  85          3HG1      VAL  85  -9.271  -5.216  -5.216
  685   1HG2  VAL  85          3HG2      VAL  85  -6.601  -7.176  -7.176
  686   2HG2  VAL  85          2HG2      VAL  85  -7.497  -7.421  -7.421
  687   3HG2  VAL  85          1HG2      VAL  85  -7.428  -5.821  -5.821
  688    H    LYS  86           H        LYS  86  -9.191  -8.798  -8.798
  689    HA   LYS  86           HA       LYS  86 -12.063  -9.403  -9.403
  690   1HB   LYS  86          2HB       LYS  86 -11.802 -10.419 -10.419
  691   2HB   LYS  86          1HB       LYS  86 -11.518 -11.395 -11.395
  692   1HG   LYS  86          2HG       LYS  86  -9.070 -10.780 -10.780
  693   2HG   LYS  86          1HG       LYS  86  -9.442 -10.025 -10.025
  694   1HD   LYS  86          2HD       LYS  86 -10.372 -12.207 -12.207
  695   2HD   LYS  86          1HD       LYS  86  -9.847 -12.940 -12.940
  696   1HE   LYS  86          2HE       LYS  86  -7.507 -12.080 -12.080
  697   2HE   LYS  86          1HE       LYS  86  -8.120 -11.727 -11.727
  698   1HZ   LYS  86          3HZ       LYS  86  -8.809 -14.069 -14.069
  699   2HZ   LYS  86          2HZ       LYS  86  -8.083 -14.375 -14.375
  700   3HZ   LYS  86          1HZ       LYS  86  -7.132 -13.895 -13.895
  701    H    TRP  87           H        TRP  87 -13.515  -8.454  -8.454
  702    HA   TRP  87           HA       TRP  87 -12.562  -5.817  -5.817
  703   1HB   TRP  87          2HB       TRP  87 -15.174  -7.310  -7.310
  704   2HB   TRP  87          1HB       TRP  87 -14.920  -5.778  -5.778
  705    HD1  TRP  87           HD1      TRP  87 -15.872  -7.249  -7.249
  706    HE1  TRP  87           HE1      TRP  87 -16.090  -5.428  -5.428
  707    HE3  TRP  87           HE3      TRP  87 -13.684  -3.356  -3.356
  708    HZ2  TRP  87           HZ2      TRP  87 -15.421  -2.665  -2.665
  709    HZ3  TRP  87           HZ3      TRP  87 -13.464  -1.140  -1.140
  710    HH2  TRP  87           HH2      TRP  87 -14.327  -0.801  -0.801
  711    H    GLU  88           H        GLU  88 -13.207  -5.116  -5.116
  712    HA   GLU  88           HA       GLU  88 -12.612  -7.195  -7.195
  713   1HB   GLU  88          2HB       GLU  88 -10.587  -5.714  -5.714
  714   2HB   GLU  88          1HB       GLU  88 -11.420  -4.435  -4.435
  715   1HG   GLU  88          2HG       GLU  88 -10.014  -5.377  -5.377
  716   2HG   GLU  88          1HG       GLU  88 -11.582  -6.121  -6.121
  717    H    SER  89           H        SER  89 -13.564  -3.870  -3.870
  718    HA   SER  89           HA       SER  89 -15.685  -4.052  -4.052
  719   1HB   SER  89          2HB       SER  89 -15.212  -1.783  -1.783
  720   2HB   SER  89          1HB       SER  89 -13.691  -2.669  -2.669
  721    HG   SER  89           HG       SER  89 -13.871  -0.492  -0.492
  722    H    GLU  90           H        GLU  90 -16.573  -1.321  -1.321
  723    HA   GLU  90           HA       GLU  90 -18.080  -2.046  -2.046
  724   1HB   GLU  90          2HB       GLU  90 -19.046   0.258   0.258
  725   2HB   GLU  90          1HB       GLU  90 -19.188  -0.729  -0.729
  726   1HG   GLU  90          2HG       GLU  90 -16.659   0.725   0.725
  727   2HG   GLU  90          1HG       GLU  90 -18.036   1.819   1.819
  728    H    ASN  91           H        ASN  91 -15.188  -0.183  -0.183
  729    HA   ASN  91           HA       ASN  91 -14.925   0.236   0.236
  730   1HB   ASN  91          2HB       ASN  91 -14.375   2.459   2.459
  731   2HB   ASN  91          1HB       ASN  91 -14.367   2.554   2.554
  732   1HD2  ASN  91          2HD2      ASN  91 -17.745   3.426   3.426
  733   2HD2  ASN  91          1HD2      ASN  91 -16.190   3.544   3.544
  734    H    LYS  92           H        LYS  92 -13.544  -1.507  -1.507
  735    HA   LYS  92           HA       LYS  92 -10.791  -0.540  -0.540
  736   1HB   LYS  92          2HB       LYS  92 -11.290  -0.046  -0.046
  737   2HB   LYS  92          1HB       LYS  92 -11.748  -1.727  -1.727
  738   1HG   LYS  92          2HG       LYS  92  -9.284  -2.089  -2.089
  739   2HG   LYS  92          1HG       LYS  92  -9.054  -0.523  -0.523
  740   1HD   LYS  92          2HD       LYS  92 -10.285  -1.718  -1.718
  741   2HD   LYS  92          1HD       LYS  92  -9.663  -3.172  -3.172
  742   1HE   LYS  92          2HE       LYS  92  -7.441  -1.643  -1.643
  743   2HE   LYS  92          1HE       LYS  92  -8.191  -0.976  -0.976
  744   1HZ   LYS  92          2HZ       LYS  92  -8.507  -3.450  -3.450
  745   2HZ   LYS  92          1HZ       LYS  92  -7.267  -3.721  -3.721
  746   3HZ   LYS  92          3HZ       LYS  92  -6.984  -2.729  -2.729
  747    H    MET  93           H        MET  93 -10.083  -2.066  -2.066
  748    HA   MET  93           HA       MET  93 -10.771  -4.921  -4.921
  749   1HB   MET  93          2HB       MET  93 -10.573  -5.369  -5.369
  750   2HB   MET  93          1HB       MET  93 -11.815  -4.172  -4.172
  751   1HG   MET  93          2HG       MET  93  -9.425  -2.719  -2.719
  752   2HG   MET  93          1HG       MET  93  -9.409  -3.924  -3.924
  753   1HE   MET  93          2HE       MET  93 -11.682  -4.665  -4.665
  754   2HE   MET  93          1HE       MET  93 -12.847  -3.560  -3.560
  755   3HE   MET  93          3HE       MET  93 -11.220  -3.703  -3.703
  756    H    VAL  94           H        VAL  94  -9.149  -6.484  -6.484
  757    HA   VAL  94           HA       VAL  94  -6.381  -5.432  -5.432
  758    HB   VAL  94           HB       VAL  94  -7.198  -8.291  -8.291
  759   1HG1  VAL  94          2HG1      VAL  94  -4.962  -6.471  -6.471
  760   2HG1  VAL  94          1HG1      VAL  94  -5.351  -7.832  -7.832
  761   3HG1  VAL  94          3HG1      VAL  94  -4.893  -8.112  -8.112
  762   1HG2  VAL  94          2HG2      VAL  94  -7.575  -5.939  -5.939
  763   2HG2  VAL  94          1HG2      VAL  94  -8.759  -7.165  -7.165
  764   3HG2  VAL  94          3HG2      VAL  94  -7.407  -7.589  -7.589
  765    H    CYS  95           H        CYS  95  -4.698  -7.023  -7.023
  766    HA   CYS  95           HA       CYS  95  -5.760  -8.250  -8.250
  767   1HB   CYS  95          2HB       CYS  95  -5.242  -5.877  -5.877
  768   2HB   CYS  95          1HB       CYS  95  -3.586  -6.135  -6.135
  769    HG   CYS  95           HG       CYS  95  -3.069  -7.229  -7.229
  770    H    GLU  96           H        GLU  96  -4.532  -9.912  -9.912
  771    HA   GLU  96           HA       GLU  96  -1.999 -10.541 -10.541
  772   1HB   GLU  96          2HB       GLU  96  -3.732 -12.481 -12.481
  773   2HB   GLU  96          1HB       GLU  96  -2.420 -12.871 -12.871
  774   1HG   GLU  96          2HG       GLU  96  -4.492 -11.239 -11.239
  775   2HG   GLU  96          1HG       GLU  96  -5.130 -12.758 -12.758
  776    H    GLN  97           H        GLN  97  -0.306 -11.581 -11.581
  777    HA   GLN  97           HA       GLN  97  -0.728 -11.145 -11.145
  778   1HB   GLN  97          2HB       GLN  97  -0.098  -8.912  -8.912
  779   2HB   GLN  97          1HB       GLN  97   1.528  -9.565  -9.565
  780   1HG   GLN  97          2HG       GLN  97   0.828  -9.973  -9.973
  781   2HG   GLN  97          1HG       GLN  97  -0.420  -8.778  -8.778
  782   1HE2  GLN  97          2HE2      GLN  97   1.813  -6.043  -6.043
  783   2HE2  GLN  97          1HE2      GLN  97   0.213  -6.570  -6.570
  784    H    LYS  98           H        LYS  98   0.576 -12.416 -12.416
  785    HA   LYS  98           HA       LYS  98   3.142 -13.400 -13.400
  786   1HB   LYS  98          2HB       LYS  98   2.552 -15.730 -15.730
  787   2HB   LYS  98          1HB       LYS  98   1.527 -15.137 -15.137
  788   1HG   LYS  98          2HG       LYS  98  -0.322 -14.838 -14.838
  789   2HG   LYS  98          1HG       LYS  98   0.670 -14.755 -14.755
  790   1HD   LYS  98          2HD       LYS  98   1.310 -17.219 -17.219
  791   2HD   LYS  98          1HD       LYS  98  -0.153 -17.174 -17.174
  792   1HE   LYS  98          2HE       LYS  98  -1.297 -16.234 -16.234
  793   2HE   LYS  98          1HE       LYS  98   0.113 -16.865 -16.865
  794   1HZ   LYS  98          1HZ       LYS  98  -0.354 -19.026 -19.026
  795   2HZ   LYS  98          3HZ       LYS  98  -1.840 -18.371 -18.371
  796   3HZ   LYS  98          2HZ       LYS  98  -1.501 -18.563 -18.563
  797    H    LEU  99           H        LEU  99   4.607 -14.133 -14.133
  798    HA   LEU  99           HA       LEU  99   4.376 -12.586 -12.586
  799   1HB   LEU  99          2HB       LEU  99   6.095 -14.965 -14.965
  800   2HB   LEU  99          1HB       LEU  99   6.262 -14.062 -14.062
  801    HG   LEU  99           HG       LEU  99   6.231 -12.478 -12.478
  802   1HD1  LEU  99          1HD1      LEU  99   8.513 -14.267 -14.267
  803   2HD1  LEU  99          3HD1      LEU  99   8.703 -12.926 -12.926
  804   3HD1  LEU  99          2HD1      LEU  99   7.677 -14.297 -14.297
  805   1HD2  LEU  99          2HD2      LEU  99   6.457 -11.492 -11.492
  806   2HD2  LEU  99          1HD2      LEU  99   7.852 -11.150 -11.150
  807   3HD2  LEU  99          3HD2      LEU  99   7.951 -12.404 -12.404
  808    H    LEU 100           H        LEU 100   4.527 -13.605 -13.605
  809    HA   LEU 100           HA       LEU 100   2.448 -15.700 -15.700
  810   1HB   LEU 100          2HB       LEU 100   3.539 -13.587 -13.587
  811   2HB   LEU 100          1HB       LEU 100   2.560 -14.931 -14.931
  812    HG   LEU 100           HG       LEU 100   1.696 -13.037 -13.037
  813   1HD1  LEU 100          3HD1      LEU 100   1.973 -12.280 -12.280
  814   2HD1  LEU 100          2HD1      LEU 100   0.390 -13.052 -13.052
  815   3HD1  LEU 100          1HD1      LEU 100   0.645 -11.713 -11.713
  816   1HD2  LEU 100          2HD2      LEU 100   0.562 -15.459 -15.459
  817   2HD2  LEU 100          1HD2      LEU 100   0.351 -14.873 -14.873
  818   3HD2  LEU 100          3HD2      LEU 100  -0.562 -14.141 -14.141
  819    H    LYS 101           H        LYS 101   5.812 -15.362 -15.362
  820    HA   LYS 101           HA       LYS 101   6.161 -18.008 -18.008
  821   1HB   LYS 101          2HB       LYS 101   6.408 -15.947 -15.947
  822   2HB   LYS 101          1HB       LYS 101   8.040 -15.959 -15.959
  823   1HG   LYS 101          2HG       LYS 101   6.796 -18.555 -18.555
  824   2HG   LYS 101          1HG       LYS 101   7.456 -17.478 -17.478
  825   1HD   LYS 101          2HD       LYS 101   9.637 -17.611 -17.611
  826   2HD   LYS 101          1HD       LYS 101   9.074 -18.180 -18.180
  827   1HE   LYS 101          2HE       LYS 101   9.927 -20.131 -20.131
  828   2HE   LYS 101          1HE       LYS 101   8.191 -20.245 -20.245
  829   1HZ   LYS 101          2HZ       LYS 101  10.021 -18.974 -18.974
  830   2HZ   LYS 101          1HZ       LYS 101   9.711 -20.645 -20.645
  831   3HZ   LYS 101          3HZ       LYS 101   8.441 -19.545 -19.545
  832    H    GLY 102           H        GLY 102   7.813 -19.074 -19.074
  833   1HA   GLY 102          2HA       GLY 102   9.578 -19.435 -19.435
  834   2HA   GLY 102          1HA       GLY 102  10.133 -17.805 -17.805
  835    H    GLU 103           H        GLU 103  10.606 -17.625 -17.625
  836    HA   GLU 103           HA       GLU 103   8.551 -16.199 -16.199
  837   1HB   GLU 103          2HB       GLU 103   7.664 -18.537 -18.537
  838   2HB   GLU 103          1HB       GLU 103   9.125 -18.941 -18.941
  839   1HG   GLU 103          2HG       GLU 103   8.585 -17.495 -17.495
  840   2HG   GLU 103          1HG       GLU 103   7.433 -16.585 -16.585
  841    H    GLY 104           H        GLY 104   9.436 -15.031 -15.031
  842   1HA   GLY 104          2HA       GLY 104  11.992 -15.867 -15.867
  843   2HA   GLY 104          1HA       GLY 104  11.970 -14.312 -14.312
  844    HA   PRO 105           HA       PRO 105  10.220 -12.684 -12.684
  845   1HB   PRO 105          2HB       PRO 105   9.326 -10.270 -10.270
  846   2HB   PRO 105          1HB       PRO 105  11.038 -10.620 -10.620
  847   1HG   PRO 105          2HG       PRO 105   9.609 -10.362 -10.362
  848   2HG   PRO 105          1HG       PRO 105  11.337 -10.193 -10.193
  849   1HD   PRO 105          2HD       PRO 105  10.027 -12.474 -12.474
  850   2HD   PRO 105          1HD       PRO 105  11.730 -12.352 -12.352
  851    H    LYS 106           H        LYS 106   8.000 -11.381 -11.381
  852    HA   LYS 106           HA       LYS 106   5.771 -12.580 -12.580
  853   1HB   LYS 106          2HB       LYS 106   6.143 -13.899 -13.899
  854   2HB   LYS 106          1HB       LYS 106   6.004 -12.425 -12.425
  855   1HG   LYS 106          2HG       LYS 106   3.729 -12.226 -12.226
  856   2HG   LYS 106          1HG       LYS 106   3.797 -13.133 -13.133
  857   1HD   LYS 106          2HD       LYS 106   4.256 -15.208 -15.208
  858   2HD   LYS 106          1HD       LYS 106   4.133 -14.294 -14.294
  859   1HE   LYS 106          2HE       LYS 106   1.936 -14.701 -14.701
  860   2HE   LYS 106          1HE       LYS 106   2.002 -15.388 -15.388
  861   1HZ   LYS 106          2HZ       LYS 106   2.139 -12.995 -12.995
  862   2HZ   LYS 106          1HZ       LYS 106   1.639 -12.561 -12.561
  863   3HZ   LYS 106          3HZ       LYS 106   0.637 -13.524 -13.524
  864    H    THR 107           H        THR 107   4.001 -11.135 -11.135
  865    HA   THR 107           HA       THR 107   4.354  -8.476  -8.476
  866    HB   THR 107           HB       THR 107   2.938  -7.884  -7.884
  867    HG1  THR 107           HG1      THR 107   3.427 -10.108 -10.108
  868   1HG2  THR 107          2HG2      THR 107   5.804  -7.758  -7.758
  869   2HG2  THR 107          1HG2      THR 107   5.398  -7.335  -7.335
  870   3HG2  THR 107          3HG2      THR 107   4.668  -6.448  -6.448
  871    H    SER 108           H        SER 108   2.560  -7.444  -7.444
  872    HA   SER 108           HA       SER 108  -0.154  -8.366  -8.366
  873   1HB   SER 108          2HB       SER 108  -0.514  -8.775  -8.775
  874   2HB   SER 108          1HB       SER 108   0.271 -10.059 -10.059
  875    HG   SER 108           HG       SER 108   1.200  -8.671  -8.671
  876    H    TRP 109           H        TRP 109  -1.540  -6.580  -6.580
  877    HA   TRP 109           HA       TRP 109  -0.499  -4.467  -4.467
  878   1HB   TRP 109          2HB       TRP 109  -1.037  -2.703  -2.703
  879   2HB   TRP 109          1HB       TRP 109   0.366  -3.696  -3.696
  880    HD1  TRP 109           HD1      TRP 109   0.264  -5.234  -5.234
  881    HE1  TRP 109           HE1      TRP 109  -1.430  -5.507  -5.507
  882    HE3  TRP 109           HE3      TRP 109  -3.684  -2.609  -2.609
  883    HZ2  TRP 109           HZ2      TRP 109  -4.097  -4.717  -4.717
  884    HZ3  TRP 109           HZ3      TRP 109  -5.781  -2.389  -2.389
  885    HH2  TRP 109           HH2      TRP 109  -5.999  -3.439  -3.439
  886    H    THR 110           H        THR 110  -2.206  -2.617  -2.617
  887    HA   THR 110           HA       THR 110  -4.958  -3.727  -3.727
  888    HB   THR 110           HB       THR 110  -5.519  -3.251  -3.251
  889    HG1  THR 110           HG1      THR 110  -4.675  -1.599  -1.599
  890   1HG2  THR 110          2HG2      THR 110  -3.625  -5.101  -5.101
  891   2HG2  THR 110          1HG2      THR 110  -2.723  -4.057  -4.057
  892   3HG2  THR 110          3HG2      THR 110  -4.245  -4.780  -4.780
  893    H    MET 111           H        MET 111  -6.574  -1.920  -1.920
  894    HA   MET 111           HA       MET 111  -5.637   0.828   0.828
  895   1HB   MET 111          2HB       MET 111  -7.131   1.131   1.131
  896   2HB   MET 111          1HB       MET 111  -5.808   0.010   0.010
  897   1HG   MET 111          2HG       MET 111  -7.206  -1.861  -1.861
  898   2HG   MET 111          1HG       MET 111  -8.439  -1.030  -1.030
  899   1HE   MET 111          3HE       MET 111  -6.243  -0.564  -0.564
  900   2HE   MET 111          2HE       MET 111  -7.219  -1.096  -1.096
  901   3HE   MET 111          1HE       MET 111  -7.079   0.623   0.623
  902    H    GLU 112           H        GLU 112  -7.083   2.282   2.282
  903    HA   GLU 112           HA       GLU 112  -9.723   1.214   1.214
  904   1HB   GLU 112          2HB       GLU 112  -8.041   1.065   1.065
  905   2HB   GLU 112          1HB       GLU 112  -7.841   2.813   2.813
  906   1HG   GLU 112          2HG       GLU 112  -9.911   3.248   3.248
  907   2HG   GLU 112          1HG       GLU 112 -10.627   1.780   1.780
  908    H    LEU 113           H        LEU 113 -11.329   2.830   2.830
  909    HA   LEU 113           HA       LEU 113 -10.587   5.478   5.478
  910   1HB   LEU 113          2HB       LEU 113 -12.441   3.614   3.614
  911   2HB   LEU 113          1HB       LEU 113 -13.436   4.701   4.701
  912    HG   LEU 113           HG       LEU 113 -13.263   5.259   5.259
  913   1HD1  LEU 113          2HD1      LEU 113 -12.288   7.338   7.338
  914   2HD1  LEU 113          1HD1      LEU 113 -12.963   7.680   7.680
  915   3HD1  LEU 113          3HD1      LEU 113 -13.967   6.938   6.938
  916   1HD2  LEU 113          3HD2      LEU 113 -10.501   4.967   4.967
  917   2HD2  LEU 113          2HD2      LEU 113 -11.269   5.488   5.488
  918   3HD2  LEU 113          1HD2      LEU 113 -10.755   6.683   6.683
  919    H    THR 114           H        THR 114 -11.237   7.316   7.316
  920    HA   THR 114           HA       THR 114 -12.097   6.768   6.768
  921    HB   THR 114           HB       THR 114 -11.457   9.013   9.013
  922    HG1  THR 114           HG1      THR 114 -11.796  10.501  10.501
  923   1HG2  THR 114          1HG2      THR 114  -9.567   7.482   7.482
  924   2HG2  THR 114          3HG2      THR 114  -9.566   7.967   7.967
  925   3HG2  THR 114          2HG2      THR 114  -9.161   9.140   9.140
  926    H    ASN 115           H        ASN 115 -13.869   8.052   8.052
  927    HA   ASN 115           HA       ASN 115 -16.287   7.857   7.857
  928   1HB   ASN 115          2HB       ASN 115 -15.719   9.588   9.588
  929   2HB   ASN 115          1HB       ASN 115 -17.313   9.087   9.087
  930   1HD2  ASN 115          2HD2      ASN 115 -14.984   6.454   6.454
  931   2HD2  ASN 115          1HD2      ASN 115 -14.365   7.963   7.963
  932    H    ASP 116           H        ASP 116 -13.893  10.375  10.375
  933    HA   ASP 116           HA       ASP 116 -15.726  12.433  12.433
  934   1HB   ASP 116          2HB       ASP 116 -12.779  12.308  12.308
  935   2HB   ASP 116          1HB       ASP 116 -13.434  13.640  13.640
  936    H    GLY 117           H        GLY 117 -13.409  10.105  10.105
  937   1HA   GLY 117          2HA       GLY 117 -14.011   9.432   9.432
  938   2HA   GLY 117          1HA       GLY 117 -13.892  11.151  11.151
  939    H    GLU 118           H        GLU 118 -11.538  10.885  10.885
  940    HA   GLU 118           HA       GLU 118  -9.377  11.071  11.071
  941   1HB   GLU 118          2HB       GLU 118  -9.315  10.170  10.170
  942   2HB   GLU 118          1HB       GLU 118  -7.930  10.745  10.745
  943   1HG   GLU 118          2HG       GLU 118  -9.297  12.882  12.882
  944   2HG   GLU 118          1HG       GLU 118 -10.365  12.305  12.305
  945    H    LEU 119           H        LEU 119  -7.459   9.434   9.434
  946    HA   LEU 119           HA       LEU 119  -8.421   6.624   6.624
  947   1HB   LEU 119          2HB       LEU 119  -8.800   7.508   7.508
  948   2HB   LEU 119          1HB       LEU 119  -7.063   7.752   7.752
  949    HG   LEU 119           HG       LEU 119  -8.254   5.062   5.062
  950   1HD1  LEU 119          2HD1      LEU 119  -7.965   6.443   6.443
  951   2HD1  LEU 119          1HD1      LEU 119  -7.739   4.696   4.696
  952   3HD1  LEU 119          3HD1      LEU 119  -9.274   5.414   5.414
  953   1HD2  LEU 119          3HD2      LEU 119  -5.591   6.138   6.138
  954   2HD2  LEU 119          2HD2      LEU 119  -5.943   4.958   4.958
  955   3HD2  LEU 119          1HD2      LEU 119  -6.037   4.488   4.488
  956    H    ILE 120           H        ILE 120  -6.981   5.830   5.830
  957    HA   ILE 120           HA       ILE 120  -4.097   6.568   6.568
  958    HB   ILE 120           HB       ILE 120  -4.941   6.971   6.971
  959   1HG1  ILE 120          2HG1      ILE 120  -3.323   4.412   4.412
  960   2HG1  ILE 120          1HG1      ILE 120  -2.624   5.969   5.969
  961   1HG2  ILE 120          1HG2      ILE 120  -6.006   4.191   4.191
  962   2HG2  ILE 120          3HG2      ILE 120  -5.583   4.738   4.738
  963   3HG2  ILE 120          2HG2      ILE 120  -6.795   5.612   5.612
  964   1HD1  ILE 120          3HD1      ILE 120  -3.388   6.913   6.913
  965   2HD1  ILE 120          2HD1      ILE 120  -4.019   5.329   5.329
  966   3HD1  ILE 120          1HD1      ILE 120  -2.285   5.556   5.556
  967    H    LEU 121           H        LEU 121  -2.549   4.842   4.842
  968    HA   LEU 121           HA       LEU 121  -3.784   2.168   2.168
  969   1HB   LEU 121          2HB       LEU 121  -3.334   3.396   3.396
  970   2HB   LEU 121          1HB       LEU 121  -1.635   3.497   3.497
  971    HG   LEU 121           HG       LEU 121  -2.407   0.761   0.761
  972   1HD1  LEU 121          2HD1      LEU 121  -4.253   1.690   1.690
  973   2HD1  LEU 121          1HD1      LEU 121  -2.944   1.622   1.622
  974   3HD1  LEU 121          3HD1      LEU 121  -3.454   0.156   0.156
  975   1HD2  LEU 121          1HD2      LEU 121  -0.706   2.276   2.276
  976   2HD2  LEU 121          3HD2      LEU 121  -0.168   1.415   1.415
  977   3HD2  LEU 121          2HD2      LEU 121  -0.784   0.514   0.514
  978    H    THR 122           H        THR 122  -2.501   0.424   0.424
  979    HA   THR 122           HA       THR 122   0.099   1.087   1.087
  980    HB   THR 122           HB       THR 122  -0.941  -1.385  -1.385
  981    HG1  THR 122           HG1      THR 122  -2.860  -0.681  -0.681
  982   1HG2  THR 122          1HG2      THR 122  -0.387   1.359   1.359
  983   2HG2  THR 122          3HG2      THR 122  -0.959   0.036   0.036
  984   3HG2  THR 122          2HG2      THR 122   0.579  -0.107  -0.107
  985    H    MET 123           H        MET 123   1.634  -0.808  -0.808
  986    HA   MET 123           HA       MET 123   0.987  -2.678  -2.678
  987   1HB   MET 123          2HB       MET 123   3.479  -0.949  -0.949
  988   2HB   MET 123          1HB       MET 123   3.056  -2.142  -2.142
  989   1HG   MET 123          2HG       MET 123   0.854  -0.744  -0.744
  990   2HG   MET 123          1HG       MET 123   1.797   0.532   0.532
  991   1HE   MET 123          2HE       MET 123   0.630  -0.957  -0.957
  992   2HE   MET 123          1HE       MET 123   1.945  -1.038  -1.038
  993   3HE   MET 123          3HE       MET 123   1.889  -2.176  -2.176
  994    H    THR 124           H        THR 124   2.593  -4.421  -4.421
  995    HA   THR 124           HA       THR 124   4.339  -4.766  -4.766
  996    HB   THR 124           HB       THR 124   2.434  -6.956  -6.956
  997    HG1  THR 124           HG1      THR 124   1.061  -5.490  -5.490
  998   1HG2  THR 124          1HG2      THR 124   4.538  -7.500  -7.500
  999   2HG2  THR 124          3HG2      THR 124   4.016  -6.424  -6.424
 1000   3HG2  THR 124          2HG2      THR 124   3.085  -7.876  -7.876
 1001    H    ALA 125           H        ALA 125   5.954  -6.342  -6.342
 1002    HA   ALA 125           HA       ALA 125   6.087  -7.811  -7.811
 1003   1HB   ALA 125          3HB       ALA 125   6.807  -5.452  -5.452
 1004   2HB   ALA 125          2HB       ALA 125   8.173  -5.679  -5.679
 1005   3HB   ALA 125          1HB       ALA 125   8.011  -6.695  -6.695
 1006    H    ASP 126           H        ASP 126   6.477  -9.670  -9.670
 1007    HA   ASP 126           HA       ASP 126   7.856 -11.297 -11.297
 1008   1HB   ASP 126          2HB       ASP 126   9.732  -9.371  -9.371
 1009   2HB   ASP 126          1HB       ASP 126  10.145  -9.716  -9.716
 1010    H    ASP 127           H        ASP 127   9.046  -8.466  -8.466
 1011    HA   ASP 127           HA       ASP 127   7.237  -9.105  -9.105
 1012   1HB   ASP 127          2HB       ASP 127  10.152  -9.696  -9.696
 1013   2HB   ASP 127          1HB       ASP 127   9.507  -8.927  -8.927
 1014    H    VAL 128           H        VAL 128   7.897  -6.877  -6.877
 1015    HA   VAL 128           HA       VAL 128   8.370  -4.755  -4.755
 1016    HB   VAL 128           HB       VAL 128   9.336  -3.369  -3.369
 1017   1HG1  VAL 128          1HG1      VAL 128  10.435  -6.153  -6.153
 1018   2HG1  VAL 128          3HG1      VAL 128  11.263  -4.981  -4.981
 1019   3HG1  VAL 128          2HG1      VAL 128  11.026  -4.642  -4.642
 1020   1HG2  VAL 128          2HG2      VAL 128   8.250  -5.546  -5.546
 1021   2HG2  VAL 128          1HG2      VAL 128   8.391  -3.820  -3.820
 1022   3HG2  VAL 128          3HG2      VAL 128   9.800  -4.867  -4.867
 1023    H    VAL 129           H        VAL 129   7.348  -2.597  -2.597
 1024    HA   VAL 129           HA       VAL 129   4.942  -3.144  -3.144
 1025    HB   VAL 129           HB       VAL 129   4.893  -2.787  -2.787
 1026   1HG1  VAL 129          2HG1      VAL 129   2.994  -1.406  -1.406
 1027   2HG1  VAL 129          1HG1      VAL 129   2.366  -2.095  -2.095
 1028   3HG1  VAL 129          3HG1      VAL 129   3.622  -0.857  -0.857
 1029   1HG2  VAL 129          3HG2      VAL 129   3.494  -4.391  -4.391
 1030   2HG2  VAL 129          2HG2      VAL 129   4.267  -4.926  -4.926
 1031   3HG2  VAL 129          1HG2      VAL 129   2.690  -4.139  -4.139
 1032    H    CYS 130           H        CYS 130   4.918  -1.459  -1.459
 1033    HA   CYS 130           HA       CYS 130   5.953   1.176   1.176
 1034   1HB   CYS 130          2HB       CYS 130   6.782   0.022   0.022
 1035   2HB   CYS 130          1HB       CYS 130   5.227   0.487   0.487
 1036    HG   CYS 130           HG       CYS 130   6.322   2.670   2.670
 1037    H    THR 131           H        THR 131   4.384   2.512   2.512
 1038    HA   THR 131           HA       THR 131   1.643   2.327   2.327
 1039    HB   THR 131           HB       THR 131   2.684   3.667   3.667
 1040    HG1  THR 131           HG1      THR 131   2.647   1.623   1.623
 1041   1HG2  THR 131          2HG2      THR 131  -0.050   3.466   3.466
 1042   2HG2  THR 131          1HG2      THR 131   0.133   3.617   3.617
 1043   3HG2  THR 131          3HG2      THR 131   0.754   4.879   4.879
 1044    H    ARG 132           H        ARG 132   0.941   3.950   3.950
 1045    HA   ARG 132           HA       ARG 132   2.384   6.559   6.559
 1046   1HB   ARG 132          2HB       ARG 132   1.301   5.086   5.086
 1047   2HB   ARG 132          1HB       ARG 132   2.016   6.698   6.698
 1048   1HG   ARG 132          2HG       ARG 132   4.151   5.907   5.907
 1049   2HG   ARG 132          1HG       ARG 132   3.620   4.532   4.532
 1050   1HD   ARG 132          2HD       ARG 132   4.468   3.790   3.790
 1051   2HD   ARG 132          1HD       ARG 132   2.750   3.432   3.432
 1052    HE   ARG 132           HE       ARG 132   3.008   5.987   5.987
 1053   1HH1  ARG 132          2HH1      ARG 132   1.550   3.364   3.364
 1054   2HH1  ARG 132          1HH1      ARG 132   2.251   3.153   3.153
 1055   1HH2  ARG 132          1HH2      ARG 132   4.818   5.419   5.419
 1056   2HH2  ARG 132          2HH2      ARG 132   4.101   4.315   4.315
 1057    H    VAL 133           H        VAL 133   0.845   7.778   7.778
 1058    HA   VAL 133           HA       VAL 133  -2.004   7.383   7.383
 1059    HB   VAL 133           HB       VAL 133  -0.494   9.828   9.828
 1060   1HG1  VAL 133          3HG1      VAL 133  -2.947  10.111  10.111
 1061   2HG1  VAL 133          2HG1      VAL 133  -3.326   8.998   8.998
 1062   3HG1  VAL 133          1HG1      VAL 133  -2.546  10.541  10.541
 1063   1HG2  VAL 133          1HG2      VAL 133  -1.352   7.270   7.270
 1064   2HG2  VAL 133          3HG2      VAL 133   0.143   8.181   8.181
 1065   3HG2  VAL 133          2HG2      VAL 133  -1.350   8.751   8.751
 1066    H    TYR 134           H        TYR 134  -3.364   8.178   8.178
 1067    HA   TYR 134           HA       TYR 134  -2.179  10.139  10.139
 1068   1HB   TYR 134          2HB       TYR 134  -3.832   7.677   7.677
 1069   2HB   TYR 134          1HB       TYR 134  -3.955   9.013   9.013
 1070    HD1  TYR 134           HD2      TYR 134  -2.006   9.739   9.739
 1071    HD2  TYR 134           HD1      TYR 134  -1.800   6.371   6.371
 1072    HE1  TYR 134           HE2      TYR 134   0.084   8.993   8.993
 1073    HE2  TYR 134           HE1      TYR 134   0.297   5.627   5.627
 1074    HH   TYR 134           HH       TYR 134   2.104   7.584   7.584
 1075    H    VAL 135           H        VAL 135  -3.243  12.032  12.032
 1076    HA   VAL 135           HA       VAL 135  -6.099  12.033  12.033
 1077    HB   VAL 135           HB       VAL 135  -3.960  13.656  13.656
 1078   1HG1  VAL 135          2HG1      VAL 135  -4.240  14.911  14.911
 1079   2HG1  VAL 135          1HG1      VAL 135  -5.841  15.384  15.384
 1080   3HG1  VAL 135          3HG1      VAL 135  -4.404  15.897  15.897
 1081   1HG2  VAL 135          2HG2      VAL 135  -6.955  14.031  14.031
 1082   2HG2  VAL 135          1HG2      VAL 135  -5.919  13.192  13.192
 1083   3HG2  VAL 135          3HG2      VAL 135  -5.798  14.942  14.942
 1084    H    ARG 136           H        ARG 136  -7.654  12.793  12.793
 1085    HA   ARG 136           HA       ARG 136  -7.188  12.440  12.440
 1086   1HB   ARG 136          2HB       ARG 136  -9.323  13.479  13.479
 1087   2HB   ARG 136          1HB       ARG 136  -9.143  14.471  14.471
 1088   1HG   ARG 136          2HG       ARG 136  -9.592  12.726  12.726
 1089   2HG   ARG 136          1HG       ARG 136  -9.047  11.501  11.501
 1090   1HD   ARG 136          2HD       ARG 136 -11.633  13.080  13.080
 1091   2HD   ARG 136          1HD       ARG 136 -11.458  11.346  11.346
 1092    HE   ARG 136           HE       ARG 136 -10.239  11.850  11.850
 1093   1HH1  ARG 136          2HH1      ARG 136 -12.862  10.290  10.290
 1094   2HH1  ARG 136          1HH1      ARG 136 -13.957  10.988  10.988
 1095   1HH2  ARG 136          1HH2      ARG 136 -11.847  13.618  13.618
 1096   2HH2  ARG 136          2HH2      ARG 136 -13.382  12.873  12.873
 1097    H    GLU 137           HN       GLU 137  -6.128  13.462  13.462
 1098    HA   GLU 137           HA       GLU 137  -4.673  15.015  15.015
 1099   1HB   GLU 137          2HB       GLU 137  -7.134  15.699  15.699
 1100   2HB   GLU 137          1HB       GLU 137  -6.776  17.020  17.020
 1101   1HG   GLU 137          2HG       GLU 137  -4.722  17.487  17.487
 1102   2HG   GLU 137          1HG       GLU 137  -5.451  16.401  16.401

  Start of MODEL   24
    1   1H    PRO   1          1H        PRO   1 -17.341   8.877   8.877
    2   2H    PRO   1          2H        PRO   1 -16.613   8.576   8.576
    3    HA   PRO   1           HA       PRO   1 -16.056   6.529   6.529
    4   1HB   PRO   1          2HB       PRO   1 -18.508   5.447   5.447
    5   2HB   PRO   1          1HB       PRO   1 -17.763   5.155   5.155
    6   1HG   PRO   1          2HG       PRO   1 -20.096   6.712   6.712
    7   2HG   PRO   1          1HG       PRO   1 -19.354   6.406   6.406
    8   1HD   PRO   1          1HD       PRO   1 -19.345   8.843   8.843
    9   2HD   PRO   1          2HD       PRO   1 -18.589   8.526   8.526
   10    H    ASN   2           H        ASN   2 -14.768   7.146   7.146
   11    HA   ASN   2           HA       ASN   2 -15.515   6.057   6.057
   12   1HB   ASN   2          2HB       ASN   2 -16.143   8.899   8.899
   13   2HB   ASN   2          1HB       ASN   2 -15.213   8.606   8.606
   14   1HD2  ASN   2          2HD2      ASN   2 -19.108   7.891   7.891
   15   2HD2  ASN   2          1HD2      ASN   2 -18.343   8.909   8.909
   16    H    PHE   3           H        PHE   3 -13.626   5.474   5.474
   17    HA   PHE   3           HA       PHE   3 -11.119   6.812   6.812
   18   1HB   PHE   3          2HB       PHE   3 -11.628   4.233   4.233
   19   2HB   PHE   3          1HB       PHE   3 -10.042   4.843   4.843
   20    HD1  PHE   3           HD1      PHE   3 -13.330   4.210   4.210
   21    HD2  PHE   3           HD2      PHE   3  -9.048   3.870   3.870
   22    HE1  PHE   3           HE1      PHE   3 -13.480   3.045   3.045
   23    HE2  PHE   3           HE2      PHE   3  -9.207   2.696   2.696
   24    HZ   PHE   3           HZ       PHE   3 -11.425   2.271   2.271
   25    H    SER   4           H        SER   4 -13.305   6.615   6.615
   26    HA   SER   4           HA       SER   4 -11.547   6.892   6.892
   27   1HB   SER   4          2HB       SER   4 -14.140   6.485   6.485
   28   2HB   SER   4          1HB       SER   4 -14.224   8.241   8.241
   29    HG   SER   4           HG       SER   4 -14.131   6.822   6.822
   30    H    GLY   5           H        GLY   5 -10.119   8.473   8.473
   31   1HA   GLY   5          2HA       GLY   5 -10.632  11.137  11.137
   32   2HA   GLY   5          1HA       GLY   5 -10.320  11.094  11.094
   33    H    ASN   6           H        ASN   6  -8.432  12.492  12.492
   34    HA   ASN   6           HA       ASN   6  -6.199  10.790  10.790
   35   1HB   ASN   6          2HB       ASN   6  -6.687  13.767  13.767
   36   2HB   ASN   6          1HB       ASN   6  -5.034  13.158  13.158
   37   1HD2  ASN   6          2HD2      ASN   6  -5.783  11.577  11.577
   38   2HD2  ASN   6          1HD2      ASN   6  -5.180  11.066  11.066
   39    H    TRP   7           H        TRP   7  -4.050  11.266  11.266
   40    HA   TRP   7           HA       TRP   7  -4.576  11.875  11.875
   41   1HB   TRP   7          2HB       TRP   7  -3.657   9.180   9.180
   42   2HB   TRP   7          1HB       TRP   7  -3.609   9.666   9.666
   43    HD1  TRP   7           HD1      TRP   7  -5.903   8.361   8.361
   44    HE1  TRP   7           HE1      TRP   7  -8.328   8.247   8.247
   45    HE3  TRP   7           HE3      TRP   7  -5.313  10.987  10.987
   46    HZ2  TRP   7           HZ2      TRP   7  -9.811   9.195   9.195
   47    HZ3  TRP   7           HZ3      TRP   7  -7.234  11.410  11.410
   48    HH2  TRP   7           HH2      TRP   7  -9.463  10.511  10.511
   49    H    LYS   8           H        LYS   8  -2.968  13.106  13.106
   50    HA   LYS   8           HA       LYS   8  -0.236  12.665  12.665
   51   1HB   LYS   8          2HB       LYS   8  -1.525  15.169  15.169
   52   2HB   LYS   8          1HB       LYS   8   0.195  15.035  15.035
   53   1HG   LYS   8          2HG       LYS   8  -0.368  14.468  14.468
   54   2HG   LYS   8          1HG       LYS   8  -2.080  14.673  14.673
   55   1HD   LYS   8          2HD       LYS   8  -1.500  16.769  16.769
   56   2HD   LYS   8          1HD       LYS   8  -1.358  17.031  17.031
   57   1HE   LYS   8          2HE       LYS   8   1.031  16.771  16.771
   58   2HE   LYS   8          1HE       LYS   8   0.976  16.205  16.205
   59   1HZ   LYS   8          1HZ       LYS   8   0.096  18.899  18.899
   60   2HZ   LYS   8          3HZ       LYS   8   1.626  18.563  18.563
   61   3HZ   LYS   8          2HZ       LYS   8   0.235  18.343  18.343
   62    H    ILE   9           H        ILE   9   0.902  11.509  11.509
   63    HA   ILE   9           HA       ILE   9   0.260  11.030  11.030
   64    HB   ILE   9           HB       ILE   9   1.786   9.639   9.639
   65   1HG1  ILE   9          2HG1      ILE   9   3.161  10.924  10.924
   66   2HG1  ILE   9          1HG1      ILE   9   1.998   9.601   9.601
   67   1HG2  ILE   9          3HG2      ILE   9   2.847  11.884  11.884
   68   2HG2  ILE   9          2HG2      ILE   9   4.021  11.600  11.600
   69   3HG2  ILE   9          1HG2      ILE   9   3.758  10.374  10.374
   70   1HD1  ILE   9          2HD1      ILE   9   3.640   8.384   8.384
   71   2HD1  ILE   9          1HD1      ILE   9   4.814   9.578   9.578
   72   3HD1  ILE   9          3HD1      ILE   9   4.063   8.478   8.478
   73    H    ILE  10           H        ILE  10   0.827  11.967  11.967
   74    HA   ILE  10           HA       ILE  10   2.330  14.545  14.545
   75    HB   ILE  10           HB       ILE  10   0.901  15.370  15.370
   76   1HG1  ILE  10          2HG1      ILE  10  -1.296  13.703  13.703
   77   2HG1  ILE  10          1HG1      ILE  10   0.030  12.547  12.547
   78   1HG2  ILE  10          3HG2      ILE  10   0.278  15.334  15.334
   79   2HG2  ILE  10          2HG2      ILE  10  -1.043  14.313  14.313
   80   3HG2  ILE  10          1HG2      ILE  10  -0.860  15.950  15.950
   81   1HD1  ILE  10          3HD1      ILE  10   1.032  14.304  14.304
   82   2HD1  ILE  10          2HD1      ILE  10  -0.693  14.422  14.422
   83   3HD1  ILE  10          1HD1      ILE  10   0.119  12.859  12.859
   84    H    ARG  11           H        ARG  11   1.918  11.473  11.473
   85    HA   ARG  11           HA       ARG  11   4.329  12.080  12.080
   86   1HB   ARG  11          2HB       ARG  11   1.604  11.521  11.521
   87   2HB   ARG  11          1HB       ARG  11   2.924  10.661  10.661
   88   1HG   ARG  11          2HG       ARG  11   4.071  13.044  13.044
   89   2HG   ARG  11          1HG       ARG  11   2.406  13.611  13.611
   90   1HD   ARG  11          2HD       ARG  11   1.840  12.181  12.181
   91   2HD   ARG  11          1HD       ARG  11   3.563  11.851  11.851
   92    HE   ARG  11           HE       ARG  11   2.218  14.340  14.340
   93   1HH1  ARG  11          1HH1      ARG  11   5.430  15.886  15.886
   94   2HH1  ARG  11          2HH1      ARG  11   3.837  16.062  16.062
   95   1HH2  ARG  11          1HH2      ARG  11   4.842  12.714  12.714
   96   2HH2  ARG  11          2HH2      ARG  11   5.999  13.991  13.991
   97    H    SER  12           H        SER  12   5.106  10.006  10.006
   98    HA   SER  12           HA       SER  12   4.389   7.388   7.388
   99   1HB   SER  12          2HB       SER  12   4.731   7.771   7.771
  100   2HB   SER  12          1HB       SER  12   6.197   8.700   8.700
  101    HG   SER  12           HG       SER  12   7.209   6.877   6.877
  102    H    GLU  13           H        GLU  13   6.385   5.871   5.871
  103    HA   GLU  13           HA       GLU  13   8.743   7.155   7.155
  104   1HB   GLU  13          2HB       GLU  13   8.338   6.475   6.475
  105   2HB   GLU  13          1HB       GLU  13   7.029   7.513   7.513
  106   1HG   GLU  13          2HG       GLU  13   6.230   4.896   4.896
  107   2HG   GLU  13          1HG       GLU  13   6.914   4.766   4.766
  108    H    ASN  14           H        ASN  14   8.167   4.942   4.942
  109    HA   ASN  14           HA       ASN  14  10.094   3.044   3.044
  110   1HB   ASN  14          2HB       ASN  14   7.870   1.369   1.369
  111   2HB   ASN  14          1HB       ASN  14   8.748   1.396   1.396
  112   1HD2  ASN  14          2HD2      ASN  14   5.810   2.495   2.495
  113   2HD2  ASN  14          1HD2      ASN  14   7.117   1.428   1.428
  114    H    PHE  15           H        PHE  15   9.724   4.775   4.775
  115    HA   PHE  15           HA       PHE  15   9.091   3.228   3.228
  116   1HB   PHE  15          2HB       PHE  15   9.375   5.777   5.777
  117   2HB   PHE  15          1HB       PHE  15  11.102   5.482   5.482
  118    HD1  PHE  15           HD2      PHE  15  10.217   2.963   2.963
  119    HD2  PHE  15           HD1      PHE  15   9.878   7.240   7.240
  120    HE1  PHE  15           HE2      PHE  15  10.159   3.020   3.020
  121    HE2  PHE  15           HE1      PHE  15   9.805   7.281   7.281
  122    HZ   PHE  15           HZ       PHE  15   9.946   5.158   5.158
  123    H    GLU  16           H        GLU  16  12.326   4.174   4.174
  124    HA   GLU  16           HA       GLU  16  13.815   2.547   2.547
  125   1HB   GLU  16          2HB       GLU  16  14.399   3.661   3.661
  126   2HB   GLU  16          1HB       GLU  16  15.585   2.696   2.696
  127   1HG   GLU  16          2HG       GLU  16  15.121   4.319   4.319
  128   2HG   GLU  16          1HG       GLU  16  14.413   5.370   5.370
  129    H    GLU  17           H        GLU  17  12.181   1.677   1.677
  130    HA   GLU  17           HA       GLU  17  13.671  -0.786  -0.786
  131   1HB   GLU  17          2HB       GLU  17  12.068  -1.425  -1.425
  132   2HB   GLU  17          1HB       GLU  17  12.529   0.260   0.260
  133   1HG   GLU  17          2HG       GLU  17  10.446   1.028   1.028
  134   2HG   GLU  17          1HG       GLU  17  10.161  -0.187  -0.187
  135    H    LEU  18           H        LEU  18  10.835   0.097   0.097
  136    HA   LEU  18           HA       LEU  18  10.065  -2.675  -2.675
  137   1HB   LEU  18          2HB       LEU  18   8.751  -0.214  -0.214
  138   2HB   LEU  18          1HB       LEU  18   8.957  -0.694  -0.694
  139    HG   LEU  18           HG       LEU  18   7.983  -2.920  -2.920
  140   1HD1  LEU  18          3HD1      LEU  18   8.062  -1.725  -1.725
  141   2HD1  LEU  18          2HD1      LEU  18   6.620  -2.660  -2.660
  142   3HD1  LEU  18          1HD1      LEU  18   8.213  -3.410  -3.410
  143   1HD2  LEU  18          2HD2      LEU  18   6.552  -0.333  -0.333
  144   2HD2  LEU  18          1HD2      LEU  18   6.253  -1.695  -1.695
  145   3HD2  LEU  18          3HD2      LEU  18   5.658  -1.738  -1.738
  146    H    LEU  19           H        LEU  19  12.247  -0.378  -0.378
  147    HA   LEU  19           HA       LEU  19  12.253  -1.808  -1.808
  148   1HB   LEU  19          2HB       LEU  19  14.144   0.414   0.414
  149   2HB   LEU  19          1HB       LEU  19  13.706  -0.091  -0.091
  150    HG   LEU  19           HG       LEU  19  11.941   1.330   1.330
  151   1HD1  LEU  19          3HD1      LEU  19  13.654   2.254   2.254
  152   2HD1  LEU  19          2HD1      LEU  19  12.005   2.491   2.491
  153   3HD1  LEU  19          1HD1      LEU  19  12.506   3.180   3.180
  154   1HD2  LEU  19          1HD2      LEU  19  10.715  -0.494  -0.494
  155   2HD2  LEU  19          3HD2      LEU  19  10.090   1.135   1.135
  156   3HD2  LEU  19          2HD2      LEU  19  11.110   0.402   0.402
  157    H    LYS  20           H        LYS  20  13.837  -1.950  -1.950
  158    HA   LYS  20           HA       LYS  20  16.258  -3.270  -3.270
  159   1HB   LYS  20          2HB       LYS  20  15.349  -3.238  -3.238
  160   2HB   LYS  20          1HB       LYS  20  16.986  -3.427  -3.427
  161   1HG   LYS  20          2HG       LYS  20  15.887  -0.929  -0.929
  162   2HG   LYS  20          1HG       LYS  20  15.702  -1.031  -1.031
  163   1HD   LYS  20          2HD       LYS  20  18.289  -1.498  -1.498
  164   2HD   LYS  20          1HD       LYS  20  17.872  -0.017  -0.017
  165   1HE   LYS  20          2HE       LYS  20  17.415  -1.957  -1.957
  166   2HE   LYS  20          1HE       LYS  20  18.828  -2.583  -2.583
  167   1HZ   LYS  20          2HZ       LYS  20  19.885  -0.408  -0.408
  168   2HZ   LYS  20          1HZ       LYS  20  18.543   0.124   0.124
  169   3HZ   LYS  20          3HZ       LYS  20  19.510  -1.136  -1.136
  170    H    VAL  21           H        VAL  21  13.155  -4.025  -4.025
  171    HA   VAL  21           HA       VAL  21  13.679  -6.853  -6.853
  172    HB   VAL  21           HB       VAL  21  11.973  -5.544  -5.544
  173   1HG1  VAL  21          1HG1      VAL  21  11.197  -4.154  -4.154
  174   2HG1  VAL  21          3HG1      VAL  21  10.397  -5.563  -5.563
  175   3HG1  VAL  21          2HG1      VAL  21   9.873  -4.916  -4.916
  176   1HG2  VAL  21          1HG2      VAL  21  11.289  -8.000  -8.000
  177   2HG2  VAL  21          3HG2      VAL  21  11.536  -7.822  -7.822
  178   3HG2  VAL  21          2HG2      VAL  21  10.036  -7.263  -7.263
  179    H    LEU  22           H        LEU  22  12.125  -4.830  -4.830
  180    HA   LEU  22           HA       LEU  22  11.179  -6.908  -6.908
  181   1HB   LEU  22          2HB       LEU  22  11.561  -3.971  -3.971
  182   2HB   LEU  22          1HB       LEU  22  11.639  -4.736  -4.736
  183    HG   LEU  22           HG       LEU  22   9.431  -5.679  -5.679
  184   1HD1  LEU  22          3HD1      LEU  22   9.668  -6.149  -6.149
  185   2HD1  LEU  22          2HD1      LEU  22   9.370  -4.440  -4.440
  186   3HD1  LEU  22          1HD1      LEU  22   8.122  -5.432  -5.432
  187   1HD2  LEU  22          1HD2      LEU  22   9.890  -3.098  -3.098
  188   2HD2  LEU  22          3HD2      LEU  22   8.241  -3.697  -3.697
  189   3HD2  LEU  22          2HD2      LEU  22   9.062  -2.929  -2.929
  190    H    GLY  23           H        GLY  23  14.048  -4.852  -4.852
  191   1HA   GLY  23          2HA       GLY  23  15.285  -6.566  -6.566
  192   2HA   GLY  23          1HA       GLY  23  15.829  -4.948  -4.948
  193    H    VAL  24           H        VAL  24  17.960  -5.581  -5.581
  194    HA   VAL  24           HA       VAL  24  18.439  -6.774  -6.774
  195    HB   VAL  24           HB       VAL  24  20.088  -8.425  -8.425
  196   1HG1  VAL  24          2HG1      VAL  24  17.620  -8.910  -8.910
  197   2HG1  VAL  24          1HG1      VAL  24  17.346  -8.926  -8.926
  198   3HG1  VAL  24          3HG1      VAL  24  18.456 -10.086 -10.086
  199   1HG2  VAL  24          3HG2      VAL  24  18.830  -7.489  -7.489
  200   2HG2  VAL  24          2HG2      VAL  24  20.542  -7.503  -7.503
  201   3HG2  VAL  24          1HG2      VAL  24  19.692  -9.022  -9.022
  202    H    ASN  25           H        ASN  25  19.870  -5.536  -5.536
  203    HA   ASN  25           HA       ASN  25  22.437  -4.851  -4.851
  204   1HB   ASN  25          2HB       ASN  25  21.256  -4.683  -4.683
  205   2HB   ASN  25          1HB       ASN  25  21.074  -3.007  -3.007
  206   1HD2  ASN  25          2HD2      ASN  25  24.434  -2.223  -2.223
  207   2HD2  ASN  25          1HD2      ASN  25  22.872  -1.670  -1.670
  208    H    VAL  26           H        VAL  26  22.941  -2.224  -2.224
  209    HA   VAL  26           HA       VAL  26  21.194  -1.081  -1.081
  210    HB   VAL  26           HB       VAL  26  23.287   0.371   0.371
  211   1HG1  VAL  26          2HG1      VAL  26  22.326  -1.901  -1.901
  212   2HG1  VAL  26          1HG1      VAL  26  23.949  -2.433  -2.433
  213   3HG1  VAL  26          3HG1      VAL  26  23.734  -1.032  -1.032
  214   1HG2  VAL  26          2HG2      VAL  26  24.560  -1.931  -1.931
  215   2HG2  VAL  26          1HG2      VAL  26  24.541  -0.245  -0.245
  216   3HG2  VAL  26          3HG2      VAL  26  25.430  -0.714  -0.714
  217    H    MET  27           H        MET  27  23.080  -0.240  -0.240
  218    HA   MET  27           HA       MET  27  22.154   2.495   2.495
  219   1HB   MET  27          2HB       MET  27  24.133   1.227   1.227
  220   2HB   MET  27          1HB       MET  27  22.886   1.020   1.020
  221   1HG   MET  27          2HG       MET  27  22.743   3.281   3.281
  222   2HG   MET  27          1HG       MET  27  23.198   3.734   3.734
  223   1HE   MET  27          1HE       MET  27  24.663   5.098   5.098
  224   2HE   MET  27          3HE       MET  27  26.062   4.151   4.151
  225   3HE   MET  27          2HE       MET  27  26.220   5.303   5.303
  226    H    LEU  28           H        LEU  28  20.868  -0.580  -0.580
  227    HA   LEU  28           HA       LEU  28  18.991   0.179   0.179
  228   1HB   LEU  28          2HB       LEU  28  19.391  -2.046  -2.046
  229   2HB   LEU  28          1HB       LEU  28  17.716  -1.812  -1.812
  230    HG   LEU  28           HG       LEU  28  18.860  -3.372  -3.372
  231   1HD1  LEU  28          1HD1      LEU  28  17.159  -1.489  -1.489
  232   2HD1  LEU  28          3HD1      LEU  28  18.563  -0.860  -0.860
  233   3HD1  LEU  28          2HD1      LEU  28  17.971  -2.485  -2.485
  234   1HD2  LEU  28          3HD2      LEU  28  20.709  -1.012  -1.012
  235   2HD2  LEU  28          2HD2      LEU  28  21.145  -2.586  -2.586
  236   3HD2  LEU  28          1HD2      LEU  28  20.669  -2.445  -2.445
  237    H    ARG  29           H        ARG  29  18.544   0.027   0.027
  238    HA   ARG  29           HA       ARG  29  15.821   0.844   0.844
  239   1HB   ARG  29          2HB       ARG  29  17.793   1.580   1.580
  240   2HB   ARG  29          1HB       ARG  29  16.076   1.239   1.239
  241   1HG   ARG  29          2HG       ARG  29  16.612  -0.895  -0.895
  242   2HG   ARG  29          1HG       ARG  29  17.164  -1.078  -1.078
  243   1HD   ARG  29          2HD       ARG  29  18.874  -1.674  -1.674
  244   2HD   ARG  29          1HD       ARG  29  19.414  -0.511  -0.511
  245    HE   ARG  29           HE       ARG  29  18.282   0.843   0.843
  246   1HH1  ARG  29          1HH2      ARG  29  20.241  -1.194  -1.194
  247   2HH1  ARG  29          2HH2      ARG  29  21.698  -0.260  -0.260
  248   1HH2  ARG  29          2HH1      ARG  29  20.509   2.207   2.207
  249   2HH2  ARG  29          1HH1      ARG  29  21.850   1.665   1.665
  250    H    LYS  30           H        LYS  30  18.800   2.782   2.782
  251    HA   LYS  30           HA       LYS  30  17.554   5.284   5.284
  252   1HB   LYS  30          2HB       LYS  30  20.060   4.636   4.636
  253   2HB   LYS  30          1HB       LYS  30  20.096   5.003   5.003
  254   1HG   LYS  30          2HG       LYS  30  18.712   7.159   7.159
  255   2HG   LYS  30          1HG       LYS  30  20.061   6.830   6.830
  256   1HD   LYS  30          2HD       LYS  30  20.467   7.016   7.016
  257   2HD   LYS  30          1HD       LYS  30  20.487   8.454   8.454
  258   1HE   LYS  30          2HE       LYS  30  22.422   7.807   7.807
  259   2HE   LYS  30          1HE       LYS  30  22.148   6.092   6.092
  260   1HZ   LYS  30          1HZ       LYS  30  22.627   7.912   7.912
  261   2HZ   LYS  30          3HZ       LYS  30  23.943   7.377   7.377
  262   3HZ   LYS  30          2HZ       LYS  30  22.952   6.250   6.250
  263    H    ILE  31           H        ILE  31  17.843   3.442   3.442
  264    HA   ILE  31           HA       ILE  31  17.309   5.775   5.775
  265    HB   ILE  31           HB       ILE  31  17.268   2.808   2.808
  266   1HG1  ILE  31          2HG1      ILE  31  19.481   3.643   3.643
  267   2HG1  ILE  31          1HG1      ILE  31  19.489   3.236   3.236
  268   1HG2  ILE  31          2HG2      ILE  31  16.915   5.294   5.294
  269   2HG2  ILE  31          1HG2      ILE  31  17.660   3.868   3.868
  270   3HG2  ILE  31          3HG2      ILE  31  16.023   3.774   3.774
  271   1HD1  ILE  31          3HD1      ILE  31  18.704   5.917   5.917
  272   2HD1  ILE  31          2HD1      ILE  31  19.949   5.814   5.814
  273   3HD1  ILE  31          1HD1      ILE  31  20.310   5.312   5.312
  274    H    ALA  32           H        ALA  32  15.487   3.282   3.282
  275    HA   ALA  32           HA       ALA  32  13.026   3.821   3.821
  276   1HB   ALA  32          3HB       ALA  32  13.685   2.117   2.117
  277   2HB   ALA  32          2HB       ALA  32  12.032   2.326   2.326
  278   3HB   ALA  32          1HB       ALA  32  13.242   1.584   1.584
  279    H    VAL  33           H        VAL  33  14.585   4.925   4.925
  280    HA   VAL  33           HA       VAL  33  12.229   6.181   6.181
  281    HB   VAL  33           HB       VAL  33  15.088   6.906   6.906
  282   1HG1  VAL  33          1HG1      VAL  33  12.408   7.144   7.144
  283   2HG1  VAL  33          3HG1      VAL  33  13.757   6.801   6.801
  284   3HG1  VAL  33          2HG1      VAL  33  13.786   8.241   8.241
  285   1HG2  VAL  33          3HG2      VAL  33  14.099   4.263   4.263
  286   2HG2  VAL  33          2HG2      VAL  33  15.554   4.868   4.868
  287   3HG2  VAL  33          1HG2      VAL  33  14.033   4.836   4.836
  288    H    ALA  34           H        ALA  34  15.145   7.210   7.210
  289    HA   ALA  34           HA       ALA  34  14.426   9.987   9.987
  290   1HB   ALA  34          2HB       ALA  34  16.754   9.140   9.140
  291   2HB   ALA  34          1HB       ALA  34  16.242   8.398   8.398
  292   3HB   ALA  34          3HB       ALA  34  16.219  10.153  10.153
  293    H    ALA  35           H        ALA  35  13.835   7.163   7.163
  294    HA   ALA  35           HA       ALA  35  12.795   8.494   8.494
  295   1HB   ALA  35          2HB       ALA  35  12.385   5.739   5.739
  296   2HB   ALA  35          1HB       ALA  35  11.558   6.249   6.249
  297   3HB   ALA  35          3HB       ALA  35  13.320   6.192   6.192
  298    H    ALA  36           H        ALA  36  11.185   7.230   7.230
  299    HA   ALA  36           HA       ALA  36   8.539   7.957   7.957
  300   1HB   ALA  36          2HB       ALA  36   9.888   6.985   6.985
  301   2HB   ALA  36          1HB       ALA  36   8.610   8.128   8.128
  302   3HB   ALA  36          3HB       ALA  36   8.239   6.682   6.682
  303    H    SER  37           H        SER  37  10.513   9.518   9.518
  304    HA   SER  37           HA       SER  37  10.559  11.741  11.741
  305   1HB   SER  37          2HB       SER  37  10.969  13.385  13.385
  306   2HB   SER  37          1HB       SER  37  11.634  11.886  11.886
  307    HG   SER  37           HG       SER  37   9.993  13.385  13.385
  308    H    LYS  38           H        LYS  38   8.302  10.846  10.846
  309    HA   LYS  38           HA       LYS  38   6.095  11.423  11.423
  310   1HB   LYS  38          2HB       LYS  38   6.467  13.933  13.933
  311   2HB   LYS  38          1HB       LYS  38   5.324  13.674  13.674
  312   1HG   LYS  38          2HG       LYS  38   8.051  13.183  13.183
  313   2HG   LYS  38          1HG       LYS  38   7.896  14.797  14.797
  314   1HD   LYS  38          2HD       LYS  38   7.190  15.295  15.295
  315   2HD   LYS  38          1HD       LYS  38   5.643  14.747  14.747
  316   1HE   LYS  38          2HE       LYS  38   5.934  13.565  13.565
  317   2HE   LYS  38          1HE       LYS  38   6.310  12.404  12.404
  318   1HZ   LYS  38          3HZ       LYS  38   8.448  14.057  14.057
  319   2HZ   LYS  38          2HZ       LYS  38   7.914  12.667  12.667
  320   3HZ   LYS  38          1HZ       LYS  38   8.556  12.540  12.540
  321    HA   PRO  39           HA       PRO  39   5.175   9.926   9.926
  322   1HB   PRO  39          2HB       PRO  39   4.246   7.458   7.458
  323   2HB   PRO  39          1HB       PRO  39   5.930   7.808   7.808
  324   1HG   PRO  39          2HG       PRO  39   4.712   7.408   7.408
  325   2HG   PRO  39          1HG       PRO  39   6.367   7.086   7.086
  326   1HD   PRO  39          2HD       PRO  39   5.571   9.313   9.313
  327   2HD   PRO  39          1HD       PRO  39   7.083   9.183   9.183
  328    H    ALA  40           H        ALA  40   3.157  10.143  10.143
  329    HA   ALA  40           HA       ALA  40   0.924  10.867  10.867
  330   1HB   ALA  40          2HB       ALA  40   1.330  10.962  10.962
  331   2HB   ALA  40          1HB       ALA  40  -0.212  11.352  11.352
  332   3HB   ALA  40          3HB       ALA  40   1.218  12.320  12.320
  333    H    VAL  41           H        VAL  41  -1.309  10.023  10.023
  334    HA   VAL  41           HA       VAL  41  -1.244   7.259   7.259
  335    HB   VAL  41           HB       VAL  41  -1.971   8.033   8.033
  336   1HG1  VAL  41          2HG1      VAL  41  -2.796   5.520   5.520
  337   2HG1  VAL  41          1HG1      VAL  41  -2.907   5.733   5.733
  338   3HG1  VAL  41          3HG1      VAL  41  -3.877   6.740   6.740
  339   1HG2  VAL  41          3HG2      VAL  41  -0.174   5.989   5.989
  340   2HG2  VAL  41          2HG2      VAL  41   0.282   7.310   7.310
  341   3HG2  VAL  41          1HG2      VAL  41  -0.601   5.922   5.922
  342    H    GLU  42           H        GLU  42  -3.533   6.467   6.467
  343    HA   GLU  42           HA       GLU  42  -5.637   8.535   8.535
  344   1HB   GLU  42          2HB       GLU  42  -4.501   9.001   9.001
  345   2HB   GLU  42          1HB       GLU  42  -4.652   7.304   7.304
  346   1HG   GLU  42          2HG       GLU  42  -7.153   7.563   7.563
  347   2HG   GLU  42          1HG       GLU  42  -6.908   9.289   9.289
  348    H    ILE  43           H        ILE  43  -7.242   7.408   7.408
  349    HA   ILE  43           HA       ILE  43  -7.521   4.513   4.513
  350    HB   ILE  43           HB       ILE  43  -8.547   6.257   6.257
  351   1HG1  ILE  43          2HG1      ILE  43  -7.245   3.826   3.826
  352   2HG1  ILE  43          1HG1      ILE  43  -6.244   4.591   4.591
  353   1HG2  ILE  43          3HG2      ILE  43  -9.505   3.584   3.584
  354   2HG2  ILE  43          2HG2      ILE  43  -9.294   3.814   3.814
  355   3HG2  ILE  43          1HG2      ILE  43 -10.381   4.869   4.869
  356   1HD1  ILE  43          3HD1      ILE  43  -7.350   6.424   6.424
  357   2HD1  ILE  43          2HD1      ILE  43  -6.168   5.259   5.259
  358   3HD1  ILE  43          1HD1      ILE  43  -5.737   6.367   6.367
  359    H    LYS  44           H        LYS  44  -9.507   3.646   3.646
  360    HA   LYS  44           HA       LYS  44 -11.581   5.575   5.575
  361   1HB   LYS  44          2HB       LYS  44 -11.181   3.075   3.075
  362   2HB   LYS  44          1HB       LYS  44 -11.686   4.670   4.670
  363   1HG   LYS  44          2HG       LYS  44  -9.274   5.427   5.427
  364   2HG   LYS  44          1HG       LYS  44  -8.880   3.728   3.728
  365   1HD   LYS  44          2HD       LYS  44 -10.131   3.437   3.437
  366   2HD   LYS  44          1HD       LYS  44  -9.820   5.164   5.164
  367   1HE   LYS  44          2HE       LYS  44  -7.374   4.154   4.154
  368   2HE   LYS  44          1HE       LYS  44  -7.970   2.915   2.915
  369   1HZ   LYS  44          3HZ       LYS  44  -8.412   4.719   4.719
  370   2HZ   LYS  44          2HZ       LYS  44  -7.635   5.806   5.806
  371   3HZ   LYS  44          1HZ       LYS  44  -6.767   4.517   4.517
  372    H    GLN  45           H        GLN  45 -13.232   5.078   5.078
  373    HA   GLN  45           HA       GLN  45 -13.590   2.233   2.233
  374   1HB   GLN  45          2HB       GLN  45 -13.508   3.923   3.923
  375   2HB   GLN  45          1HB       GLN  45 -14.925   4.717   4.717
  376   1HG   GLN  45          2HG       GLN  45 -16.237   2.647   2.647
  377   2HG   GLN  45          1HG       GLN  45 -14.827   1.852   1.852
  378   1HE2  GLN  45          2HE2      GLN  45 -16.399   2.912   2.912
  379   2HE2  GLN  45          1HE2      GLN  45 -16.294   1.612   1.612
  380    H    GLU  46           H        GLU  46 -15.029   1.029   1.029
  381    HA   GLU  46           HA       GLU  46 -17.490   2.339   2.339
  382   1HB   GLU  46          2HB       GLU  46 -15.976  -0.013  -0.013
  383   2HB   GLU  46          1HB       GLU  46 -17.464   0.683   0.683
  384   1HG   GLU  46          2HG       GLU  46 -16.404   2.571   2.571
  385   2HG   GLU  46          1HG       GLU  46 -15.166   2.533   2.533
  386    H    GLY  47           H        GLY  47 -17.484   1.442   1.442
  387   1HA   GLY  47          2HA       GLY  47 -19.203   0.183   0.183
  388   2HA   GLY  47          1HA       GLY  47 -19.199  -0.990  -0.990
  389    H    ASP  48           H        ASP  48 -18.456  -2.898  -2.898
  390    HA   ASP  48           HA       ASP  48 -16.514  -3.003  -3.003
  391   1HB   ASP  48          2HB       ASP  48 -16.479  -5.492  -5.492
  392   2HB   ASP  48          1HB       ASP  48 -18.009  -4.850  -4.850
  393    H    THR  49           H        THR  49 -16.122  -2.341  -2.341
  394    HA   THR  49           HA       THR  49 -13.562  -3.802  -3.802
  395    HB   THR  49           HB       THR  49 -15.416  -2.407  -2.407
  396    HG1  THR  49           HG1      THR  49 -15.759  -4.525  -4.525
  397   1HG2  THR  49          1HG2      THR  49 -12.460  -2.729  -2.729
  398   2HG2  THR  49          3HG2      THR  49 -13.493  -3.046  -3.046
  399   3HG2  THR  49          2HG2      THR  49 -13.527  -1.466  -1.466
  400    H    PHE  50           H        PHE  50 -11.767  -2.747  -2.747
  401    HA   PHE  50           HA       PHE  50 -11.784   0.237   0.237
  402   1HB   PHE  50          2HB       PHE  50 -10.281  -1.576  -1.576
  403   2HB   PHE  50          1HB       PHE  50 -10.149   0.186   0.186
  404    HD1  PHE  50           HD1      PHE  50 -12.442  -2.644  -2.644
  405    HD2  PHE  50           HD2      PHE  50 -11.890   1.596   1.596
  406    HE1  PHE  50           HE1      PHE  50 -14.561  -2.457  -2.457
  407    HE2  PHE  50           HE2      PHE  50 -13.998   1.787   1.787
  408    HZ   PHE  50           HZ       PHE  50 -15.347  -0.244  -0.244
  409    H    TYR  51           H        TYR  51 -10.366   1.117   1.117
  410    HA   TYR  51           HA       TYR  51  -8.201  -0.567  -0.567
  411   1HB   TYR  51          2HB       TYR  51 -10.007   0.305   0.305
  412   2HB   TYR  51          1HB       TYR  51  -9.498   1.938   1.938
  413    HD1  TYR  51           HD1      TYR  51  -7.038   2.526   2.526
  414    HD2  TYR  51           HD2      TYR  51  -8.951  -0.868  -0.868
  415    HE1  TYR  51           HE1      TYR  51  -5.298   2.478   2.478
  416    HE2  TYR  51           HE2      TYR  51  -7.196  -0.922  -0.922
  417    HH   TYR  51           HH       TYR  51  -5.362   1.421   1.421
  418    H    ILE  52           H        ILE  52  -6.088   0.330   0.330
  419    HA   ILE  52           HA       ILE  52  -5.709   2.910   2.910
  420    HB   ILE  52           HB       ILE  52  -3.598   0.862   0.862
  421   1HG1  ILE  52          2HG1      ILE  52  -5.731  -0.482  -0.482
  422   2HG1  ILE  52          1HG1      ILE  52  -4.727  -0.407  -0.407
  423   1HG2  ILE  52          2HG2      ILE  52  -4.840   3.147   3.147
  424   2HG2  ILE  52          1HG2      ILE  52  -4.132   1.875   1.875
  425   3HG2  ILE  52          3HG2      ILE  52  -3.140   2.720   2.720
  426   1HD1  ILE  52          2HD1      ILE  52  -6.771   1.723   1.723
  427   2HD1  ILE  52          1HD1      ILE  52  -7.403   0.090   0.090
  428   3HD1  ILE  52          3HD1      ILE  52  -6.291   0.762   0.762
  429    H    LYS  53           H        LYS  53  -4.121   4.230   4.230
  430    HA   LYS  53           HA       LYS  53  -2.373   2.990   2.990
  431   1HB   LYS  53          2HB       LYS  53  -4.317   4.047   4.047
  432   2HB   LYS  53          1HB       LYS  53  -3.937   5.571   5.571
  433   1HG   LYS  53          2HG       LYS  53  -1.595   4.441   4.441
  434   2HG   LYS  53          1HG       LYS  53  -2.930   4.673   4.673
  435   1HD   LYS  53          2HD       LYS  53  -3.167   7.023   7.023
  436   2HD   LYS  53          1HD       LYS  53  -1.598   6.742   6.742
  437   1HE   LYS  53          2HE       LYS  53  -0.555   7.256   7.256
  438   2HE   LYS  53          1HE       LYS  53  -1.439   5.987   5.987
  439   1HZ   LYS  53          3HZ       LYS  53  -3.312   7.546   7.546
  440   2HZ   LYS  53          2HZ       LYS  53  -2.361   8.767   8.767
  441   3HZ   LYS  53          1HZ       LYS  53  -1.915   8.091   8.091
  442    H    THR  54           H        THR  54  -0.433   3.316   3.316
  443    HA   THR  54           HA       THR  54   0.047   5.958   5.958
  444    HB   THR  54           HB       THR  54   1.901   3.566   3.566
  445    HG1  THR  54           HG1      THR  54   0.793   2.780   2.780
  446   1HG2  THR  54          3HG2      THR  54   2.175   6.155   6.155
  447   2HG2  THR  54          2HG2      THR  54   1.645   5.265   5.265
  448   3HG2  THR  54          1HG2      THR  54   3.092   4.758   4.758
  449    H    SER  55           H        SER  55   1.700   7.325   7.325
  450    HA   SER  55           HA       SER  55   3.260   6.396   6.396
  451   1HB   SER  55          2HB       SER  55   2.746   8.835   8.835
  452   2HB   SER  55          1HB       SER  55   1.611   7.520   7.520
  453    HG   SER  55           HG       SER  55   0.249   8.379   8.379
  454    H    THR  56           H        THR  56   5.350   6.767   6.767
  455    HA   THR  56           HA       THR  56   6.064   8.973   8.973
  456    HB   THR  56           HB       THR  56   8.254   7.807   7.807
  457    HG1  THR  56           HG1      THR  56   8.734   6.616   6.616
  458   1HG2  THR  56          1HG2      THR  56   5.747   6.852   6.852
  459   2HG2  THR  56          3HG2      THR  56   6.672   5.442   5.442
  460   3HG2  THR  56          2HG2      THR  56   7.332   6.536   6.536
  461    H    THR  57           H        THR  57   8.773   9.262   9.262
  462    HA   THR  57           HA       THR  57   8.455  11.305  11.305
  463    HB   THR  57           HB       THR  57  10.460  11.101  11.101
  464    HG1  THR  57           HG1      THR  57  10.610  12.148  12.148
  465   1HG2  THR  57          3HG2      THR  57  10.511   8.567   8.567
  466   2HG2  THR  57          2HG2      THR  57  11.257   8.754   8.754
  467   3HG2  THR  57          1HG2      THR  57  12.077   9.365   9.365
  468    H    VAL  58           H        VAL  58   9.404   7.897   7.897
  469    HA   VAL  58           HA       VAL  58   8.634   8.299   8.299
  470    HB   VAL  58           HB       VAL  58  10.981   6.663   6.663
  471   1HG1  VAL  58          2HG1      VAL  58   9.677   7.234   7.234
  472   2HG1  VAL  58          1HG1      VAL  58  11.436   7.121   7.121
  473   3HG1  VAL  58          3HG1      VAL  58  10.458   5.757   5.757
  474   1HG2  VAL  58          2HG2      VAL  58  10.700   9.535   9.535
  475   2HG2  VAL  58          1HG2      VAL  58  11.955   8.709   8.709
  476   3HG2  VAL  58          3HG2      VAL  58  12.020   8.721   8.721
  477    H    ARG  59           H        ARG  59   8.166   6.429   6.429
  478    HA   ARG  59           HA       ARG  59   7.438   4.001   4.001
  479   1HB   ARG  59          2HB       ARG  59   8.770   3.829   3.829
  480   2HB   ARG  59          1HB       ARG  59   7.337   4.403   4.403
  481   1HG   ARG  59          2HG       ARG  59   6.121   2.478   2.478
  482   2HG   ARG  59          1HG       ARG  59   7.047   2.107   2.107
  483   1HD   ARG  59          2HD       ARG  59   7.545   0.562   0.562
  484   2HD   ARG  59          1HD       ARG  59   8.965   1.423   1.423
  485    HE   ARG  59           HE       ARG  59   7.496   2.139   2.139
  486   1HH1  ARG  59          2HH1      ARG  59   8.894   4.485   4.485
  487   2HH1  ARG  59          1HH1      ARG  59  10.529   4.201   4.201
  488   1HH2  ARG  59          1HH2      ARG  59  10.203   0.749   0.749
  489   2HH2  ARG  59          2HH2      ARG  59  11.270   2.087   2.087
  490    H    THR  60           H        THR  60   5.294   2.967   2.967
  491    HA   THR  60           HA       THR  60   3.208   4.685   4.685
  492    HB   THR  60           HB       THR  60   2.997   3.912   3.912
  493    HG1  THR  60           HG1      THR  60   3.526   6.071   6.071
  494   1HG2  THR  60          3HG2      THR  60   1.037   4.556   4.556
  495   2HG2  THR  60          2HG2      THR  60   1.540   6.185   6.185
  496   3HG2  THR  60          1HG2      THR  60   0.996   5.057   5.057
  497    H    THR  61           H        THR  61   2.721   2.890   2.890
  498    HA   THR  61           HA       THR  61   2.179   0.265   0.265
  499    HB   THR  61           HB       THR  61   1.406  -0.174  -0.174
  500    HG1  THR  61           HG1      THR  61   1.947   1.336   1.336
  501   1HG2  THR  61          1HG2      THR  61   3.549  -0.900  -0.900
  502   2HG2  THR  61          3HG2      THR  61   4.315   0.501   0.501
  503   3HG2  THR  61          2HG2      THR  61   3.639  -0.777  -0.777
  504    H    GLU  62           H        GLU  62   0.053  -0.796  -0.796
  505    HA   GLU  62           HA       GLU  62  -2.259   0.920   0.920
  506   1HB   GLU  62          2HB       GLU  62  -1.357   0.370   0.370
  507   2HB   GLU  62          1HB       GLU  62  -3.044  -0.058  -0.058
  508   1HG   GLU  62          2HG       GLU  62  -3.623   2.146   2.146
  509   2HG   GLU  62          1HG       GLU  62  -1.942   2.598   2.598
  510    H    ILE  63           H        ILE  63  -3.038  -0.568  -0.568
  511    HA   ILE  63           HA       ILE  63  -3.382  -3.393  -3.393
  512    HB   ILE  63           HB       ILE  63  -3.655  -4.012  -4.012
  513   1HG1  ILE  63          2HG1      ILE  63  -3.599  -1.040  -1.040
  514   2HG1  ILE  63          1HG1      ILE  63  -5.031  -2.066  -2.066
  515   1HG2  ILE  63          3HG2      ILE  63  -1.354  -3.593  -3.593
  516   2HG2  ILE  63          2HG2      ILE  63  -1.460  -1.939  -1.939
  517   3HG2  ILE  63          1HG2      ILE  63  -1.513  -3.293  -3.293
  518   1HD1  ILE  63          3HD1      ILE  63  -3.310  -3.536  -3.536
  519   2HD1  ILE  63          2HD1      ILE  63  -2.801  -1.895  -1.895
  520   3HD1  ILE  63          1HD1      ILE  63  -4.476  -2.384  -2.384
  521    H    ASN  64           H        ASN  64  -5.521  -4.421  -4.421
  522    HA   ASN  64           HA       ASN  64  -7.798  -2.655  -2.655
  523   1HB   ASN  64          2HB       ASN  64  -8.895  -2.919  -2.919
  524   2HB   ASN  64          1HB       ASN  64  -7.250  -2.400  -2.400
  525   1HD2  ASN  64          2HD2      ASN  64  -8.441  -6.154  -6.154
  526   2HD2  ASN  64          1HD2      ASN  64  -9.368  -5.242  -5.242
  527    H    PHE  65           H        PHE  65  -9.470  -3.832  -3.832
  528    HA   PHE  65           HA       PHE  65  -9.749  -6.719  -6.719
  529   1HB   PHE  65          2HB       PHE  65  -9.161  -7.420  -7.420
  530   2HB   PHE  65          1HB       PHE  65  -7.797  -6.586  -6.586
  531    HD1  PHE  65           HD2      PHE  65  -7.314  -4.197  -4.197
  532    HD2  PHE  65           HD1      PHE  65 -10.294  -6.518  -6.518
  533    HE1  PHE  65           HE2      PHE  65  -7.383  -2.511  -2.511
  534    HE2  PHE  65           HE1      PHE  65 -10.377  -4.837  -4.837
  535    HZ   PHE  65           HZ       PHE  65  -8.929  -2.824  -2.824
  536    H    LYS  66           H        LYS  66 -11.108  -7.596  -7.596
  537    HA   LYS  66           HA       LYS  66 -13.322  -5.686  -5.686
  538   1HB   LYS  66          2HB       LYS  66 -14.869  -7.711  -7.711
  539   2HB   LYS  66          1HB       LYS  66 -14.260  -7.107  -7.107
  540   1HG   LYS  66          2HG       LYS  66 -12.427  -8.823  -8.823
  541   2HG   LYS  66          1HG       LYS  66 -13.207  -9.481  -9.481
  542   1HD   LYS  66          2HD       LYS  66 -14.329 -10.799 -10.799
  543   2HD   LYS  66          1HD       LYS  66 -15.322  -9.366  -9.366
  544   1HE   LYS  66          2HE       LYS  66 -13.904  -8.688  -8.688
  545   2HE   LYS  66          1HE       LYS  66 -12.840 -10.066 -10.066
  546   1HZ   LYS  66          3HZ       LYS  66 -15.028 -11.403 -11.403
  547   2HZ   LYS  66          2HZ       LYS  66 -15.585 -10.021 -10.021
  548   3HZ   LYS  66          1HZ       LYS  66 -14.226 -10.861 -10.861
  549    H    VAL  67           H        VAL  67 -14.361  -6.171  -6.171
  550    HA   VAL  67           HA       VAL  67 -12.436  -7.376  -7.376
  551    HB   VAL  67           HB       VAL  67 -15.092  -6.645  -6.645
  552   1HG1  VAL  67          3HG1      VAL  67 -12.184  -6.133  -6.133
  553   2HG1  VAL  67          2HG1      VAL  67 -13.470  -5.299  -5.299
  554   3HG1  VAL  67          1HG1      VAL  67 -13.361  -7.059  -7.059
  555   1HG2  VAL  67          2HG2      VAL  67 -13.456  -4.703  -4.703
  556   2HG2  VAL  67          1HG2      VAL  67 -15.205  -4.790  -4.790
  557   3HG2  VAL  67          3HG2      VAL  67 -14.201  -4.148  -4.148
  558    H    GLY  68           H        GLY  68 -12.451  -9.621  -9.621
  559   1HA   GLY  68          2HA       GLY  68 -13.929 -11.378 -11.378
  560   2HA   GLY  68          1HA       GLY  68 -15.063 -11.024 -11.024
  561    H    GLU  69           H        GLU  69 -12.909 -10.720 -10.720
  562    HA   GLU  69           HA       GLU  69 -12.184 -13.621 -13.621
  563   1HB   GLU  69          2HB       GLU  69 -12.704 -11.636 -11.636
  564   2HB   GLU  69          1HB       GLU  69 -12.376 -13.359 -13.359
  565   1HG   GLU  69          2HG       GLU  69 -14.442 -13.590 -13.590
  566   2HG   GLU  69          1HG       GLU  69 -14.847 -12.000 -12.000
  567    H    GLU  70           H        GLU  70 -10.152 -14.078 -14.078
  568    HA   GLU  70           HA       GLU  70  -8.070 -12.114 -12.114
  569   1HB   GLU  70          2HB       GLU  70  -7.777 -14.833 -14.833
  570   2HB   GLU  70          1HB       GLU  70  -6.500 -13.888 -13.888
  571   1HG   GLU  70          2HG       GLU  70  -7.330 -14.272 -14.272
  572   2HG   GLU  70          1HG       GLU  70  -8.942 -14.677 -14.677
  573    H    PHE  71           H        PHE  71  -6.291 -11.781 -11.781
  574    HA   PHE  71           HA       PHE  71  -7.121 -11.906 -11.906
  575   1HB   PHE  71          2HB       PHE  71  -7.028  -9.421  -9.421
  576   2HB   PHE  71          1HB       PHE  71  -8.396  -9.948  -9.948
  577    HD1  PHE  71           HD2      PHE  71  -8.138  -9.904  -9.904
  578    HD2  PHE  71           HD1      PHE  71  -5.448  -7.903  -7.903
  579    HE1  PHE  71           HE2      PHE  71  -7.347  -8.468  -8.468
  580    HE2  PHE  71           HE1      PHE  71  -4.660  -6.463  -6.463
  581    HZ   PHE  71           HZ       PHE  71  -5.604  -6.744  -6.744
  582    H    GLU  72           H        GLU  72  -5.453 -10.632 -10.632
  583    HA   GLU  72           HA       GLU  72  -2.778 -11.044 -11.044
  584   1HB   GLU  72          2HB       GLU  72  -3.156 -10.587 -10.587
  585   2HB   GLU  72          1HB       GLU  72  -1.866 -11.443 -11.443
  586   1HG   GLU  72          2HG       GLU  72  -3.511 -13.217 -13.217
  587   2HG   GLU  72          1HG       GLU  72  -4.723 -12.398 -12.398
  588    H    GLU  73           H        GLU  73  -1.303  -9.339  -9.339
  589    HA   GLU  73           HA       GLU  73  -1.863  -6.809  -6.809
  590   1HB   GLU  73          2HB       GLU  73  -1.962  -5.494  -5.494
  591   2HB   GLU  73          1HB       GLU  73  -3.369  -6.532  -6.532
  592   1HG   GLU  73          2HG       GLU  73  -2.834  -7.887  -7.887
  593   2HG   GLU  73          1HG       GLU  73  -1.104  -7.794  -7.794
  594    H    GLN  74           H        GLN  74  -0.220  -5.113  -5.113
  595    HA   GLN  74           HA       GLN  74   2.405  -6.552  -6.552
  596   1HB   GLN  74          2HB       GLN  74   1.610  -3.677  -3.677
  597   2HB   GLN  74          1HB       GLN  74   3.290  -4.140  -4.140
  598   1HG   GLN  74          2HG       GLN  74   1.727  -5.734  -5.734
  599   2HG   GLN  74          1HG       GLN  74   2.235  -4.112  -4.112
  600   1HE2  GLN  74          2HE2      GLN  74   5.031  -7.059  -7.059
  601   2HE2  GLN  74          1HE2      GLN  74   3.427  -7.323  -7.323
  602    H    THR  75           H        THR  75   4.031  -5.851  -5.851
  603    HA   THR  75           HA       THR  75   2.732  -5.316  -5.316
  604    HB   THR  75           HB       THR  75   4.340  -7.250  -7.250
  605    HG1  THR  75           HG1      THR  75   5.185  -7.004  -7.004
  606   1HG2  THR  75          3HG2      THR  75   6.028  -5.156  -5.156
  607   2HG2  THR  75          2HG2      THR  75   6.750  -5.807  -5.807
  608   3HG2  THR  75          1HG2      THR  75   6.391  -6.877  -6.877
  609    H    VAL  76           H        VAL  76   5.469  -4.206  -4.206
  610    HA   VAL  76           HA       VAL  76   4.942  -1.435  -1.435
  611    HB   VAL  76           HB       VAL  76   6.426  -2.337  -2.337
  612   1HG1  VAL  76          2HG1      VAL  76   5.671   0.285   0.285
  613   2HG1  VAL  76          1HG1      VAL  76   5.561   0.137   0.137
  614   3HG1  VAL  76          3HG1      VAL  76   7.099  -0.149  -0.149
  615   1HG2  VAL  76          3HG2      VAL  76   3.958  -2.981  -2.981
  616   2HG2  VAL  76          2HG2      VAL  76   4.413  -1.962  -1.962
  617   3HG2  VAL  76          1HG2      VAL  76   3.606  -1.253  -1.253
  618    H    ASP  77           H        ASP  77   7.365  -3.928  -3.928
  619    HA   ASP  77           HA       ASP  77   9.535  -2.045  -2.045
  620   1HB   ASP  77          2HB       ASP  77   9.542  -4.441  -4.441
  621   2HB   ASP  77          1HB       ASP  77   9.974  -4.948  -4.948
  622    H    GLY  78           H        GLY  78   7.791  -4.700  -4.700
  623   1HA   GLY  78          2HA       GLY  78   7.201  -3.875  -3.875
  624   2HA   GLY  78          1HA       GLY  78   8.954  -3.915  -3.915
  625    H    ARG  79           H        ARG  79   6.795  -6.155  -6.155
  626    HA   ARG  79           HA       ARG  79   7.666  -8.319  -8.319
  627   1HB   ARG  79          2HB       ARG  79   7.761  -8.154  -8.154
  628   2HB   ARG  79          1HB       ARG  79   7.420  -9.710  -9.710
  629   1HG   ARG  79          2HG       ARG  79   9.702  -8.101  -8.101
  630   2HG   ARG  79          1HG       ARG  79   9.922  -8.939  -8.939
  631   1HD   ARG  79          2HD       ARG  79   8.912 -10.295 -10.295
  632   2HD   ARG  79          1HD       ARG  79  10.605 -10.288 -10.288
  633    HE   ARG  79           HE       ARG  79   8.532 -11.376 -11.376
  634   1HH1  ARG  79          2HH1      ARG  79  10.539 -12.207 -12.207
  635   2HH1  ARG  79          1HH1      ARG  79  11.357 -13.503 -13.503
  636   1HH2  ARG  79          1HH2      ARG  79   9.946 -12.821 -12.821
  637   2HH2  ARG  79          2HH2      ARG  79  11.021 -13.850 -13.850
  638    HA   PRO  80           HA       PRO  80   3.315  -9.127  -9.127
  639   1HB   PRO  80          2HB       PRO  80   3.343 -11.757 -11.757
  640   2HB   PRO  80          1HB       PRO  80   3.681 -10.393 -10.393
  641   1HG   PRO  80          2HG       PRO  80   5.575 -12.369 -12.369
  642   2HG   PRO  80          1HG       PRO  80   5.725 -11.421 -11.421
  643   1HD   PRO  80          2HD       PRO  80   7.004 -10.865 -10.865
  644   2HD   PRO  80          1HD       PRO  80   6.898  -9.771  -9.771
  645    H    CYS  81           H        CYS  81   1.748  -9.880  -9.880
  646    HA   CYS  81           HA       CYS  81   2.146 -12.217 -12.217
  647   1HB   CYS  81          2HB       CYS  81   1.862 -10.926 -10.926
  648   2HB   CYS  81          1HB       CYS  81   3.416 -10.660 -10.660
  649    HG   CYS  81           HG       CYS  81   1.977  -8.463  -8.463
  650    H    LYS  82           H        LYS  82   0.171 -12.971 -12.971
  651    HA   LYS  82           HA       LYS  82  -2.228 -11.604 -11.604
  652   1HB   LYS  82          2HB       LYS  82  -1.980 -14.026 -14.026
  653   2HB   LYS  82          1HB       LYS  82  -1.872 -14.280 -14.280
  654   1HG   LYS  82          2HG       LYS  82  -4.180 -13.029 -13.029
  655   2HG   LYS  82          1HG       LYS  82  -4.242 -13.513 -13.513
  656   1HD   LYS  82          2HD       LYS  82  -5.191 -15.395 -15.395
  657   2HD   LYS  82          1HD       LYS  82  -3.495 -15.861 -15.861
  658   1HE   LYS  82          2HE       LYS  82  -4.701 -14.253 -14.253
  659   2HE   LYS  82          1HE       LYS  82  -5.124 -15.961 -15.961
  660   1HZ   LYS  82          2HZ       LYS  82  -2.595 -16.276 -16.276
  661   2HZ   LYS  82          1HZ       LYS  82  -2.486 -14.728 -14.728
  662   3HZ   LYS  82          3HZ       LYS  82  -3.232 -15.988 -15.988
  663    H    SER  83           H        SER  83  -3.183 -10.145 -10.145
  664    HA   SER  83           HA       SER  83  -2.748 -10.276 -10.276
  665   1HB   SER  83          2HB       SER  83  -2.238  -8.122  -8.122
  666   2HB   SER  83          1HB       SER  83  -3.569  -8.131  -8.131
  667    HG   SER  83           HG       SER  83  -3.950  -6.826  -6.826
  668    H    LEU  84           H        LEU  84  -4.702  -9.657  -9.657
  669    HA   LEU  84           HA       LEU  84  -7.317 -10.340 -10.340
  670   1HB   LEU  84          2HB       LEU  84  -6.508 -12.523 -12.523
  671   2HB   LEU  84          1HB       LEU  84  -6.124 -11.832 -11.832
  672    HG   LEU  84           HG       LEU  84  -8.502 -11.380 -11.380
  673   1HD1  LEU  84          3HD1      LEU  84  -9.033 -11.100 -11.100
  674   2HD1  LEU  84          2HD1      LEU  84  -9.123 -12.853 -12.853
  675   3HD1  LEU  84          1HD1      LEU  84 -10.229 -11.950 -11.950
  676   1HD2  LEU  84          3HD2      LEU  84  -7.588 -14.129 -14.129
  677   2HD2  LEU  84          2HD2      LEU  84  -7.999 -13.483 -13.483
  678   3HD2  LEU  84          1HD2      LEU  84  -9.278 -13.893 -13.893
  679    H    VAL  85           H        VAL  85  -9.101  -9.545  -9.545
  680    HA   VAL  85           HA       VAL  85  -8.147  -7.893  -7.893
  681    HB   VAL  85           HB       VAL  85  -9.788  -6.734  -6.734
  682   1HG1  VAL  85          2HG1      VAL  85  -9.143  -5.875  -5.875
  683   2HG1  VAL  85          1HG1      VAL  85  -8.588  -4.706  -4.706
  684   3HG1  VAL  85          3HG1      VAL  85 -10.283  -5.186  -5.186
  685   1HG2  VAL  85          3HG2      VAL  85  -6.844  -6.588  -6.588
  686   2HG2  VAL  85          2HG2      VAL  85  -7.593  -7.048  -7.048
  687   3HG2  VAL  85          1HG2      VAL  85  -7.638  -5.369  -5.369
  688    H    LYS  86           H        LYS  86  -9.502  -7.963  -7.963
  689    HA   LYS  86           HA       LYS  86 -12.379  -8.591  -8.591
  690   1HB   LYS  86          2HB       LYS  86 -12.125  -9.499  -9.499
  691   2HB   LYS  86          1HB       LYS  86 -11.795 -10.543 -10.543
  692   1HG   LYS  86          2HG       LYS  86  -9.389 -10.051 -10.051
  693   2HG   LYS  86          1HG       LYS  86  -9.716  -8.962  -8.962
  694   1HD   LYS  86          2HD       LYS  86  -9.137 -10.943 -10.943
  695   2HD   LYS  86          1HD       LYS  86 -10.898 -11.046 -11.046
  696   1HE   LYS  86          2HE       LYS  86 -10.197 -13.170 -13.170
  697   2HE   LYS  86          1HE       LYS  86 -10.562 -12.297 -12.297
  698   1HZ   LYS  86          2HZ       LYS  86  -7.845 -12.199 -12.199
  699   2HZ   LYS  86          1HZ       LYS  86  -8.333 -13.558 -13.558
  700   3HZ   LYS  86          3HZ       LYS  86  -8.349 -12.021 -12.021
  701    H    TRP  87           H        TRP  87 -13.774  -7.637  -7.637
  702    HA   TRP  87           HA       TRP  87 -12.790  -4.942  -4.942
  703   1HB   TRP  87          2HB       TRP  87 -15.422  -6.367  -6.367
  704   2HB   TRP  87          1HB       TRP  87 -15.133  -4.789  -4.789
  705    HD1  TRP  87           HD1      TRP  87 -16.090  -6.454  -6.454
  706    HE1  TRP  87           HE1      TRP  87 -16.268  -4.750  -4.750
  707    HE3  TRP  87           HE3      TRP  87 -13.844  -2.453  -2.453
  708    HZ2  TRP  87           HZ2      TRP  87 -15.551  -2.034  -2.034
  709    HZ3  TRP  87           HZ3      TRP  87 -13.574  -0.320  -0.320
  710    HH2  TRP  87           HH2      TRP  87 -14.424  -0.112  -0.112
  711    H    GLU  88           H        GLU  88 -13.338  -4.101  -4.101
  712    HA   GLU  88           HA       GLU  88 -12.813  -6.082  -6.082
  713   1HB   GLU  88          2HB       GLU  88 -10.738  -4.735  -4.735
  714   2HB   GLU  88          1HB       GLU  88 -11.507  -3.368  -3.368
  715   1HG   GLU  88          2HG       GLU  88 -10.168  -4.232  -4.232
  716   2HG   GLU  88          1HG       GLU  88 -11.732  -4.976  -4.976
  717    H    SER  89           H        SER  89 -13.651  -2.773  -2.773
  718    HA   SER  89           HA       SER  89 -15.735  -2.745  -2.745
  719   1HB   SER  89          2HB       SER  89 -15.135  -0.511  -0.511
  720   2HB   SER  89          1HB       SER  89 -13.621  -1.411  -1.411
  721    HG   SER  89           HG       SER  89 -13.545   0.626   0.626
  722    H    GLU  90           H        GLU  90 -16.541  -0.034  -0.034
  723    HA   GLU  90           HA       GLU  90 -18.111  -0.800  -0.800
  724   1HB   GLU  90          2HB       GLU  90 -18.984   1.551   1.551
  725   2HB   GLU  90          1HB       GLU  90 -19.130   0.643   0.643
  726   1HG   GLU  90          2HG       GLU  90 -17.335   1.784   1.784
  727   2HG   GLU  90          1HG       GLU  90 -16.699   2.339   2.339
  728    H    ASN  91           H        ASN  91 -15.146   0.987   0.987
  729    HA   ASN  91           HA       ASN  91 -14.880   1.244   1.244
  730   1HB   ASN  91          2HB       ASN  91 -14.251   3.539   3.539
  731   2HB   ASN  91          1HB       ASN  91 -14.222   3.549   3.549
  732   1HD2  ASN  91          2HD2      ASN  91 -17.576   4.657   4.657
  733   2HD2  ASN  91          1HD2      ASN  91 -16.020   4.760   4.760
  734    H    LYS  92           H        LYS  92 -13.571  -0.475  -0.475
  735    HA   LYS  92           HA       LYS  92 -10.780   0.384   0.384
  736   1HB   LYS  92          2HB       LYS  92 -11.258   0.948   0.948
  737   2HB   LYS  92          1HB       LYS  92 -11.812  -0.696  -0.696
  738   1HG   LYS  92          2HG       LYS  92  -9.437  -1.384  -1.384
  739   2HG   LYS  92          1HG       LYS  92  -9.018   0.289   0.289
  740   1HD   LYS  92          2HD       LYS  92  -9.966  -0.062  -0.062
  741   2HD   LYS  92          1HD       LYS  92 -10.107  -1.776  -1.776
  742   1HE   LYS  92          2HE       LYS  92  -7.554  -1.417  -1.417
  743   2HE   LYS  92          1HE       LYS  92  -7.663  -0.135  -0.135
  744   1HZ   LYS  92          3HZ       LYS  92  -8.579  -2.898  -2.898
  745   2HZ   LYS  92          2HZ       LYS  92  -6.981  -2.400  -2.400
  746   3HZ   LYS  92          1HZ       LYS  92  -8.268  -1.662  -1.662
  747    H    MET  93           H        MET  93 -10.154  -1.173  -1.173
  748    HA   MET  93           HA       MET  93 -10.923  -3.997  -3.997
  749   1HB   MET  93          2HB       MET  93 -10.298  -4.290  -4.290
  750   2HB   MET  93          1HB       MET  93 -11.893  -3.713  -3.713
  751   1HG   MET  93          2HG       MET  93 -11.451  -1.535  -1.535
  752   2HG   MET  93          1HG       MET  93  -9.715  -1.710  -1.710
  753   1HE   MET  93          2HE       MET  93 -12.554  -3.524  -3.524
  754   2HE   MET  93          1HE       MET  93 -12.688  -1.987  -1.987
  755   3HE   MET  93          3HE       MET  93 -12.217  -3.448  -3.448
  756    H    VAL  94           H        VAL  94  -9.360  -5.599  -5.599
  757    HA   VAL  94           HA       VAL  94  -6.555  -4.633  -4.633
  758    HB   VAL  94           HB       VAL  94  -7.484  -7.434  -7.434
  759   1HG1  VAL  94          2HG1      VAL  94  -5.172  -5.672  -5.672
  760   2HG1  VAL  94          1HG1      VAL  94  -5.616  -6.961  -6.961
  761   3HG1  VAL  94          3HG1      VAL  94  -5.172  -7.346  -7.346
  762   1HG2  VAL  94          1HG2      VAL  94  -7.960  -4.944  -4.944
  763   2HG2  VAL  94          3HG2      VAL  94  -8.952  -6.397  -6.397
  764   3HG2  VAL  94          2HG2      VAL  94  -7.495  -6.406  -6.406
  765    H    CYS  95           H        CYS  95  -4.921  -6.333  -6.333
  766    HA   CYS  95           HA       CYS  95  -6.034  -7.621  -7.621
  767   1HB   CYS  95          2HB       CYS  95  -5.410  -5.309  -5.309
  768   2HB   CYS  95          1HB       CYS  95  -3.769  -5.610  -5.610
  769    HG   CYS  95           HG       CYS  95  -3.626  -7.535  -7.535
  770    H    GLU  96           H        GLU  96  -4.884  -9.344  -9.344
  771    HA   GLU  96           HA       GLU  96  -2.412 -10.069 -10.069
  772   1HB   GLU  96          2HB       GLU  96  -4.244 -11.933 -11.933
  773   2HB   GLU  96          1HB       GLU  96  -2.947 -12.385 -12.385
  774   1HG   GLU  96          2HG       GLU  96  -5.188 -10.673 -10.673
  775   2HG   GLU  96          1HG       GLU  96  -5.457 -12.405 -12.405
  776    H    GLN  97           H        GLN  97  -0.752 -11.228 -11.228
  777    HA   GLN  97           HA       GLN  97  -1.076 -10.869 -10.869
  778   1HB   GLN  97          2HB       GLN  97  -0.346  -8.631  -8.631
  779   2HB   GLN  97          1HB       GLN  97   1.241  -9.373  -9.373
  780   1HG   GLN  97          2HG       GLN  97   0.528  -9.772  -9.772
  781   2HG   GLN  97          1HG       GLN  97  -0.694  -8.545  -8.545
  782   1HE2  GLN  97          2HE2      GLN  97   1.588  -5.878  -5.878
  783   2HE2  GLN  97          1HE2      GLN  97  -0.030  -6.381  -6.381
  784    H    LYS  98           H        LYS  98   0.159 -12.289 -12.289
  785    HA   LYS  98           HA       LYS  98   2.670 -13.310 -13.310
  786   1HB   LYS  98          2HB       LYS  98   2.005 -15.655 -15.655
  787   2HB   LYS  98          1HB       LYS  98   0.959 -14.928 -14.928
  788   1HG   LYS  98          2HG       LYS  98  -0.799 -14.571 -14.571
  789   2HG   LYS  98          1HG       LYS  98   0.261 -14.910 -14.910
  790   1HD   LYS  98          2HD       LYS  98  -0.453 -16.940 -16.940
  791   2HD   LYS  98          1HD       LYS  98  -1.264 -16.821 -16.821
  792   1HE   LYS  98          2HE       LYS  98   0.324 -18.262 -18.262
  793   2HE   LYS  98          1HE       LYS  98   1.403 -16.868 -16.868
  794   1HZ   LYS  98          3HZ       LYS  98   1.641 -17.512 -17.512
  795   2HZ   LYS  98          2HZ       LYS  98   1.146 -19.042 -19.042
  796   3HZ   LYS  98          1HZ       LYS  98   2.546 -18.322 -18.322
  797    H    LEU  99           H        LEU  99   4.144 -14.086 -14.086
  798    HA   LEU  99           HA       LEU  99   4.003 -12.722 -12.722
  799   1HB   LEU  99          2HB       LEU  99   5.535 -15.196 -15.196
  800   2HB   LEU  99          1HB       LEU  99   5.775 -14.356 -14.356
  801    HG   LEU  99           HG       LEU  99   5.856 -12.697 -12.697
  802   1HD1  LEU  99          3HD1      LEU  99   7.150 -14.714 -14.714
  803   2HD1  LEU  99          2HD1      LEU  99   8.105 -14.548 -14.548
  804   3HD1  LEU  99          1HD1      LEU  99   8.206 -13.318 -13.318
  805   1HD2  LEU  99          3HD2      LEU  99   7.420 -12.844 -12.844
  806   2HD2  LEU  99          2HD2      LEU  99   6.166 -11.673 -11.673
  807   3HD2  LEU  99          1HD2      LEU  99   7.709 -11.647 -11.647
  808    H    LEU 100           H        LEU 100   4.029 -13.793 -13.793
  809    HA   LEU 100           HA       LEU 100   1.769 -15.686 -15.686
  810   1HB   LEU 100          2HB       LEU 100   3.205 -13.869 -13.869
  811   2HB   LEU 100          1HB       LEU 100   2.145 -15.157 -15.157
  812    HG   LEU 100           HG       LEU 100   1.308 -13.028 -13.028
  813   1HD1  LEU 100          3HD1      LEU 100   1.332 -13.112 -13.112
  814   2HD1  LEU 100          2HD1      LEU 100  -0.148 -12.516 -12.516
  815   3HD1  LEU 100          1HD1      LEU 100   1.392 -11.725 -11.725
  816   1HD2  LEU 100          2HD2      LEU 100  -0.081 -15.296 -15.296
  817   2HD2  LEU 100          1HD2      LEU 100  -0.087 -14.915 -14.915
  818   3HD2  LEU 100          3HD2      LEU 100  -0.988 -13.904 -13.904
  819    H    LYS 101           H        LYS 101   5.176 -15.714 -15.714
  820    HA   LYS 101           HA       LYS 101   5.233 -18.519 -18.519
  821   1HB   LYS 101          2HB       LYS 101   7.061 -18.154 -18.154
  822   2HB   LYS 101          1HB       LYS 101   5.548 -17.403 -17.403
  823   1HG   LYS 101          2HG       LYS 101   6.402 -15.302 -15.302
  824   2HG   LYS 101          1HG       LYS 101   7.250 -15.649 -15.649
  825   1HD   LYS 101          2HD       LYS 101   9.090 -15.457 -15.457
  826   2HD   LYS 101          1HD       LYS 101   8.728 -17.153 -17.153
  827   1HE   LYS 101          2HE       LYS 101   7.433 -16.525 -16.525
  828   2HE   LYS 101          1HE       LYS 101   7.721 -14.817 -14.817
  829   1HZ   LYS 101          1HZ       LYS 101  10.184 -15.510 -15.510
  830   2HZ   LYS 101          3HZ       LYS 101   9.630 -16.879 -16.879
  831   3HZ   LYS 101          2HZ       LYS 101   9.356 -15.327 -15.327
  832    H    GLY 102           H        GLY 102   7.270 -19.541 -19.541
  833   1HA   GLY 102          2HA       GLY 102   9.033 -19.867 -19.867
  834   2HA   GLY 102          1HA       GLY 102   9.440 -18.173 -18.173
  835    H    GLU 103           H        GLU 103   9.951 -18.117 -18.117
  836    HA   GLU 103           HA       GLU 103   7.835 -16.967 -16.967
  837   1HB   GLU 103          2HB       GLU 103   7.138 -19.379 -19.379
  838   2HB   GLU 103          1HB       GLU 103   8.657 -19.732 -19.732
  839   1HG   GLU 103          2HG       GLU 103   8.084 -18.280 -18.280
  840   2HG   GLU 103          1HG       GLU 103   6.665 -17.678 -17.678
  841    H    GLY 104           H        GLY 104   8.691 -15.857 -15.857
  842   1HA   GLY 104          2HA       GLY 104  11.199 -16.609 -16.609
  843   2HA   GLY 104          1HA       GLY 104  11.355 -15.194 -15.194
  844    HA   PRO 105           HA       PRO 105   9.683 -12.832 -12.832
  845   1HB   PRO 105          2HB       PRO 105   8.867 -10.600 -10.600
  846   2HB   PRO 105          1HB       PRO 105  10.569 -10.969 -10.969
  847   1HG   PRO 105          2HG       PRO 105   9.088 -11.137 -11.137
  848   2HG   PRO 105          1HG       PRO 105  10.829 -10.977 -10.977
  849   1HD   PRO 105          2HD       PRO 105   9.411 -13.370 -13.370
  850   2HD   PRO 105          1HD       PRO 105  11.126 -13.235 -13.235
  851    H    LYS 106           H        LYS 106   7.564 -11.338 -11.338
  852    HA   LYS 106           HA       LYS 106   5.205 -12.545 -12.545
  853   1HB   LYS 106          2HB       LYS 106   5.589 -13.806 -13.806
  854   2HB   LYS 106          1HB       LYS 106   5.604 -12.293 -12.293
  855   1HG   LYS 106          2HG       LYS 106   3.315 -11.868 -11.868
  856   2HG   LYS 106          1HG       LYS 106   3.265 -13.125 -13.125
  857   1HD   LYS 106          2HD       LYS 106   2.295 -14.273 -14.273
  858   2HD   LYS 106          1HD       LYS 106   3.991 -14.671 -14.671
  859   1HE   LYS 106          2HE       LYS 106   3.101 -13.947 -13.947
  860   2HE   LYS 106          1HE       LYS 106   4.113 -12.634 -12.634
  861   1HZ   LYS 106          3HZ       LYS 106   1.198 -12.752 -12.752
  862   2HZ   LYS 106          2HZ       LYS 106   1.854 -11.995 -11.995
  863   3HZ   LYS 106          1HZ       LYS 106   2.238 -11.425 -11.425
  864    H    THR 107           H        THR 107   3.579 -10.992 -10.992
  865    HA   THR 107           HA       THR 107   4.047  -8.331  -8.331
  866    HB   THR 107           HB       THR 107   2.737  -7.707  -7.707
  867    HG1  THR 107           HG1      THR 107   3.127  -9.970  -9.970
  868   1HG2  THR 107          2HG2      THR 107   5.662  -7.830  -7.830
  869   2HG2  THR 107          1HG2      THR 107   5.107  -7.129  -7.129
  870   3HG2  THR 107          3HG2      THR 107   4.587  -6.432  -6.432
  871    H    SER 108           H        SER 108   2.278  -7.175  -7.175
  872    HA   SER 108           HA       SER 108  -0.463  -7.976  -7.976
  873   1HB   SER 108          2HB       SER 108   0.664  -8.380  -8.380
  874   2HB   SER 108          1HB       SER 108  -1.047  -8.439  -8.439
  875    HG   SER 108           HG       SER 108   0.113 -10.505 -10.505
  876    H    TRP 109           H        TRP 109  -1.749  -6.095  -6.095
  877    HA   TRP 109           HA       TRP 109  -0.647  -3.971  -3.971
  878   1HB   TRP 109          2HB       TRP 109  -1.065  -2.254  -2.254
  879   2HB   TRP 109          1HB       TRP 109   0.274  -3.345  -3.345
  880    HD1  TRP 109           HD1      TRP 109   0.110  -4.867  -4.867
  881    HE1  TRP 109           HE1      TRP 109  -1.627  -5.143  -5.143
  882    HE3  TRP 109           HE3      TRP 109  -3.745  -2.134  -2.134
  883    HZ2  TRP 109           HZ2      TRP 109  -4.295  -4.316  -4.316
  884    HZ3  TRP 109           HZ3      TRP 109  -5.863  -1.899  -1.899
  885    HH2  TRP 109           HH2      TRP 109  -6.151  -2.982  -2.982
  886    H    THR 110           H        THR 110  -2.265  -2.039  -2.039
  887    HA   THR 110           HA       THR 110  -5.069  -3.047  -3.047
  888    HB   THR 110           HB       THR 110  -5.611  -2.375  -2.375
  889    HG1  THR 110           HG1      THR 110  -4.340  -1.056  -1.056
  890   1HG2  THR 110          3HG2      THR 110  -3.794  -4.350  -4.350
  891   2HG2  THR 110          2HG2      THR 110  -2.889  -3.307  -3.307
  892   3HG2  THR 110          1HG2      THR 110  -4.461  -3.942  -3.942
  893    H    MET 111           H        MET 111  -6.618  -1.132  -1.132
  894    HA   MET 111           HA       MET 111  -5.597   1.541   1.541
  895   1HB   MET 111          2HB       MET 111  -7.080   1.738   1.738
  896   2HB   MET 111          1HB       MET 111  -5.708   0.652   0.652
  897   1HG   MET 111          2HG       MET 111  -7.152  -1.282  -1.282
  898   2HG   MET 111          1HG       MET 111  -8.522  -0.198  -0.198
  899   1HE   MET 111          2HE       MET 111  -9.814   0.639   0.639
  900   2HE   MET 111          1HE       MET 111  -9.378   1.468   1.468
  901   3HE   MET 111          3HE       MET 111 -10.228  -0.081  -0.081
  902    H    GLU 112           H        GLU 112  -6.857   2.946   2.946
  903    HA   GLU 112           HA       GLU 112  -9.636   2.078   2.078
  904   1HB   GLU 112          2HB       GLU 112  -8.043   1.962   1.962
  905   2HB   GLU 112          1HB       GLU 112  -7.734   3.685   3.685
  906   1HG   GLU 112          2HG       GLU 112  -9.877   4.291   4.291
  907   2HG   GLU 112          1HG       GLU 112 -10.564   2.721   2.721
  908    H    LEU 113           H        LEU 113 -11.181   3.792   3.792
  909    HA   LEU 113           HA       LEU 113 -10.356   6.331   6.331
  910   1HB   LEU 113          2HB       LEU 113 -12.293   4.515   4.515
  911   2HB   LEU 113          1HB       LEU 113 -13.235   5.675   5.675
  912    HG   LEU 113           HG       LEU 113 -13.091   6.162   6.162
  913   1HD1  LEU 113          1HD1      LEU 113 -12.547   7.994   7.994
  914   2HD1  LEU 113          3HD1      LEU 113 -11.916   8.593   8.593
  915   3HD1  LEU 113          2HD1      LEU 113 -13.621   8.186   8.186
  916   1HD2  LEU 113          1HD2      LEU 113 -10.618   5.419   5.419
  917   2HD2  LEU 113          3HD2      LEU 113 -11.081   6.817   6.817
  918   3HD2  LEU 113          2HD2      LEU 113 -10.261   7.043   7.043
  919    H    THR 114           H        THR 114 -10.972   8.267   8.267
  920    HA   THR 114           HA       THR 114 -11.780   7.901   7.901
  921    HB   THR 114           HB       THR 114 -11.043  10.134  10.134
  922    HG1  THR 114           HG1      THR 114 -11.345  11.578  11.578
  923   1HG2  THR 114          1HG2      THR 114  -9.284   8.361   8.361
  924   2HG2  THR 114          3HG2      THR 114  -9.170   9.201   9.201
  925   3HG2  THR 114          2HG2      THR 114  -8.776  10.049  10.049
  926    H    ASN 115           H        ASN 115 -13.474   9.323   9.323
  927    HA   ASN 115           HA       ASN 115 -15.933   9.122   9.122
  928   1HB   ASN 115          2HB       ASN 115 -15.006  10.488  10.488
  929   2HB   ASN 115          1HB       ASN 115 -16.552  10.999  10.999
  930   1HD2  ASN 115          2HD2      ASN 115 -16.918   7.965   7.965
  931   2HD2  ASN 115          1HD2      ASN 115 -16.056   9.413   9.413
  932    H    ASP 116           H        ASP 116 -13.455  11.560  11.560
  933    HA   ASP 116           HA       ASP 116 -15.256  13.597  13.597
  934   1HB   ASP 116          2HB       ASP 116 -12.265  13.476  13.476
  935   2HB   ASP 116          1HB       ASP 116 -13.051  14.828  14.828
  936    H    GLY 117           H        GLY 117 -13.040  11.122  11.122
  937   1HA   GLY 117          2HA       GLY 117 -13.666  10.344  10.344
  938   2HA   GLY 117          1HA       GLY 117 -13.509  12.037  12.037
  939    H    GLU 118           H        GLU 118 -11.141  11.808  11.808
  940    HA   GLU 118           HA       GLU 118  -8.992  11.840  11.840
  941   1HB   GLU 118          2HB       GLU 118  -8.940  11.114  11.114
  942   2HB   GLU 118          1HB       GLU 118  -7.537  11.566  11.566
  943   1HG   GLU 118          2HG       GLU 118  -8.387  13.784  13.784
  944   2HG   GLU 118          1HG       GLU 118  -9.958  13.353  13.353
  945    H    LEU 119           H        LEU 119  -7.129  10.142  10.142
  946    HA   LEU 119           HA       LEU 119  -8.189   7.379   7.379
  947   1HB   LEU 119          2HB       LEU 119  -8.551   8.152   8.152
  948   2HB   LEU 119          1HB       LEU 119  -6.806   8.308   8.308
  949    HG   LEU 119           HG       LEU 119  -8.120   5.721   5.721
  950   1HD1  LEU 119          1HD1      LEU 119  -7.816   6.959   6.959
  951   2HD1  LEU 119          3HD1      LEU 119  -7.576   5.219   5.219
  952   3HD1  LEU 119          2HD1      LEU 119  -9.114   5.943   5.943
  953   1HD2  LEU 119          1HD2      LEU 119  -5.407   6.610   6.610
  954   2HD2  LEU 119          3HD2      LEU 119  -5.815   5.535   5.535
  955   3HD2  LEU 119          2HD2      LEU 119  -5.934   4.958   4.958
  956    H    ILE 120           H        ILE 120  -6.757   6.562   6.562
  957    HA   ILE 120           HA       ILE 120  -3.857   7.204   7.204
  958    HB   ILE 120           HB       ILE 120  -4.666   7.726   7.726
  959   1HG1  ILE 120          2HG1      ILE 120  -3.111   5.123   5.123
  960   2HG1  ILE 120          1HG1      ILE 120  -2.388   6.684   6.684
  961   1HG2  ILE 120          2HG2      ILE 120  -5.669   4.871   4.871
  962   2HG2  ILE 120          1HG2      ILE 120  -5.500   5.780   5.780
  963   3HG2  ILE 120          3HG2      ILE 120  -6.611   6.341   6.341
  964   1HD1  ILE 120          3HD1      ILE 120  -3.347   7.539   7.539
  965   2HD1  ILE 120          2HD1      ILE 120  -3.731   5.862   5.862
  966   3HD1  ILE 120          1HD1      ILE 120  -2.053   6.351   6.351
  967    H    LEU 121           H        LEU 121  -2.366   5.397   5.397
  968    HA   LEU 121           HA       LEU 121  -3.698   2.762   2.762
  969   1HB   LEU 121          2HB       LEU 121  -3.194   3.874   3.874
  970   2HB   LEU 121          1HB       LEU 121  -1.497   3.949   3.949
  971    HG   LEU 121           HG       LEU 121  -2.328   1.253   1.253
  972   1HD1  LEU 121          1HD1      LEU 121  -4.153   2.171   2.171
  973   2HD1  LEU 121          3HD1      LEU 121  -2.850   1.957   1.957
  974   3HD1  LEU 121          2HD1      LEU 121  -3.427   0.580   0.580
  975   1HD2  LEU 121          3HD2      LEU 121  -0.606   2.641   2.641
  976   2HD2  LEU 121          2HD2      LEU 121  -0.080   1.824   1.824
  977   3HD2  LEU 121          1HD2      LEU 121  -0.726   0.886   0.886
  978    H    THR 122           H        THR 122  -2.483   0.993   0.993
  979    HA   THR 122           HA       THR 122   0.139   1.621   1.621
  980    HB   THR 122           HB       THR 122  -1.056  -0.746  -0.746
  981    HG1  THR 122           HG1      THR 122  -2.604   1.629   1.629
  982   1HG2  THR 122          3HG2      THR 122  -0.256   1.983   1.983
  983   2HG2  THR 122          2HG2      THR 122  -0.860   0.714   0.714
  984   3HG2  THR 122          1HG2      THR 122   0.627   0.464   0.464
  985    H    MET 123           H        MET 123   1.475  -0.501  -0.501
  986    HA   MET 123           HA       MET 123   0.803  -2.400  -2.400
  987   1HB   MET 123          2HB       MET 123   3.386  -0.813  -0.813
  988   2HB   MET 123          1HB       MET 123   2.894  -2.038  -2.038
  989   1HG   MET 123          2HG       MET 123   0.862  -0.603  -0.603
  990   2HG   MET 123          1HG       MET 123   1.617   0.664   0.664
  991   1HE   MET 123          1HE       MET 123   2.014  -1.841  -1.841
  992   2HE   MET 123          3HE       MET 123   1.071  -0.503  -0.503
  993   3HE   MET 123          2HE       MET 123   2.666  -0.872  -0.872
  994    H    THR 124           H        THR 124   2.430  -4.170  -4.170
  995    HA   THR 124           HA       THR 124   4.074  -4.494  -4.494
  996    HB   THR 124           HB       THR 124   2.119  -6.645  -6.645
  997    HG1  THR 124           HG1      THR 124   0.700  -5.802  -5.802
  998   1HG2  THR 124          3HG2      THR 124   4.166  -7.226  -7.226
  999   2HG2  THR 124          2HG2      THR 124   3.662  -6.081  -6.081
 1000   3HG2  THR 124          1HG2      THR 124   2.681  -7.508  -7.508
 1001    H    ALA 125           H        ALA 125   5.644  -6.130  -6.130
 1002    HA   ALA 125           HA       ALA 125   5.805  -7.711  -7.711
 1003   1HB   ALA 125          2HB       ALA 125   6.684  -5.224  -5.224
 1004   2HB   ALA 125          1HB       ALA 125   8.136  -5.879  -5.879
 1005   3HB   ALA 125          3HB       ALA 125   7.508  -6.606  -6.606
 1006    H    ASP 126           H        ASP 126   6.118  -9.525  -9.525
 1007    HA   ASP 126           HA       ASP 126   7.421 -11.150 -11.150
 1008   1HB   ASP 126          2HB       ASP 126   9.374  -9.302  -9.302
 1009   2HB   ASP 126          1HB       ASP 126   9.724  -9.601  -9.601
 1010    H    ASP 127           H        ASP 127   8.628  -8.287  -8.287
 1011    HA   ASP 127           HA       ASP 127   6.730  -8.775  -8.775
 1012   1HB   ASP 127          2HB       ASP 127   9.543  -9.614  -9.614
 1013   2HB   ASP 127          1HB       ASP 127   9.098  -8.556  -8.556
 1014    H    VAL 128           H        VAL 128   7.498  -6.656  -6.656
 1015    HA   VAL 128           HA       VAL 128   8.005  -4.458  -4.458
 1016    HB   VAL 128           HB       VAL 128   9.069  -3.201  -3.201
 1017   1HG1  VAL 128          3HG1      VAL 128  10.105  -6.039  -6.039
 1018   2HG1  VAL 128          2HG1      VAL 128  11.030  -4.696  -4.696
 1019   3HG1  VAL 128          1HG1      VAL 128  10.538  -4.669  -4.669
 1020   1HG2  VAL 128          1HG2      VAL 128   7.907  -5.386  -5.386
 1021   2HG2  VAL 128          3HG2      VAL 128   8.198  -3.700  -3.700
 1022   3HG2  VAL 128          2HG2      VAL 128   9.523  -4.863  -4.863
 1023    H    VAL 129           H        VAL 129   7.121  -2.308  -2.308
 1024    HA   VAL 129           HA       VAL 129   4.700  -2.856  -2.856
 1025    HB   VAL 129           HB       VAL 129   4.662  -2.249  -2.249
 1026   1HG1  VAL 129          2HG1      VAL 129   2.912  -0.857  -0.857
 1027   2HG1  VAL 129          1HG1      VAL 129   2.159  -1.452  -1.452
 1028   3HG1  VAL 129          3HG1      VAL 129   3.487  -0.294  -0.294
 1029   1HG2  VAL 129          2HG2      VAL 129   3.286  -3.989  -3.989
 1030   2HG2  VAL 129          1HG2      VAL 129   3.852  -4.354  -4.354
 1031   3HG2  VAL 129          3HG2      VAL 129   2.338  -3.481  -3.481
 1032    H    CYS 130           H        CYS 130   4.699  -1.308  -1.308
 1033    HA   CYS 130           HA       CYS 130   5.947   1.324   1.324
 1034   1HB   CYS 130          2HB       CYS 130   6.496  -0.159  -0.159
 1035   2HB   CYS 130          1HB       CYS 130   4.996   0.516   0.516
 1036    HG   CYS 130           HG       CYS 130   6.015   2.861   2.861
 1037    H    THR 131           H        THR 131   4.557   2.932   2.932
 1038    HA   THR 131           HA       THR 131   1.743   2.789   2.789
 1039    HB   THR 131           HB       THR 131   2.931   4.175   4.175
 1040    HG1  THR 131           HG1      THR 131   2.731   2.200   2.200
 1041   1HG2  THR 131          1HG2      THR 131   0.149   4.106   4.106
 1042   2HG2  THR 131          3HG2      THR 131   0.410   4.362   4.362
 1043   3HG2  THR 131          2HG2      THR 131   1.078   5.499   5.499
 1044    H    ARG 132           H        ARG 132   1.072   4.401   4.401
 1045    HA   ARG 132           HA       ARG 132   2.632   6.936   6.936
 1046   1HB   ARG 132          2HB       ARG 132   1.484   5.399   5.399
 1047   2HB   ARG 132          1HB       ARG 132   2.284   6.968   6.968
 1048   1HG   ARG 132          2HG       ARG 132   4.354   5.974   5.974
 1049   2HG   ARG 132          1HG       ARG 132   3.557   4.404   4.404
 1050   1HD   ARG 132          2HD       ARG 132   3.038   4.974   4.974
 1051   2HD   ARG 132          1HD       ARG 132   4.545   5.870   5.870
 1052    HE   ARG 132           HE       ARG 132   4.784   3.195   3.195
 1053   1HH1  ARG 132          1HH2      ARG 132   7.121   4.028   4.028
 1054   2HH1  ARG 132          2HH2      ARG 132   7.029   3.387   3.387
 1055   1HH2  ARG 132          2HH1      ARG 132   3.613   2.811   2.811
 1056   2HH2  ARG 132          1HH1      ARG 132   5.043   2.697   2.697
 1057    H    VAL 133           H        VAL 133   1.147   8.281   8.281
 1058    HA   VAL 133           HA       VAL 133  -1.717   7.953   7.953
 1059    HB   VAL 133           HB       VAL 133  -0.136  10.402  10.402
 1060   1HG1  VAL 133          1HG1      VAL 133  -2.600  10.681  10.681
 1061   2HG1  VAL 133          3HG1      VAL 133  -2.967   9.657   9.657
 1062   3HG1  VAL 133          2HG1      VAL 133  -2.156  11.206  11.206
 1063   1HG2  VAL 133          2HG2      VAL 133   0.337   8.338   8.338
 1064   2HG2  VAL 133          1HG2      VAL 133  -0.434   9.614   9.614
 1065   3HG2  VAL 133          3HG2      VAL 133  -1.384   8.240   8.240
 1066    H    TYR 134           H        TYR 134  -3.106   8.825   8.825
 1067    HA   TYR 134           HA       TYR 134  -1.859  10.620  10.620
 1068   1HB   TYR 134          2HB       TYR 134  -3.571   8.185   8.185
 1069   2HB   TYR 134          1HB       TYR 134  -3.668   9.480   9.480
 1070    HD1  TYR 134           HD2      TYR 134  -1.698  10.121  10.121
 1071    HD2  TYR 134           HD1      TYR 134  -1.570   6.843   6.843
 1072    HE1  TYR 134           HE2      TYR 134   0.392   9.305   9.305
 1073    HE2  TYR 134           HE1      TYR 134   0.523   6.030   6.030
 1074    HH   TYR 134           HH       TYR 134   2.377   7.893   7.893
 1075    H    VAL 135           H        VAL 135  -2.897  12.487  12.487
 1076    HA   VAL 135           HA       VAL 135  -5.721  12.666  12.666
 1077    HB   VAL 135           HB       VAL 135  -3.485  14.263  14.263
 1078   1HG1  VAL 135          2HG1      VAL 135  -3.736  15.490  15.490
 1079   2HG1  VAL 135          1HG1      VAL 135  -5.405  15.865  15.865
 1080   3HG1  VAL 135          3HG1      VAL 135  -4.079  16.521  16.521
 1081   1HG2  VAL 135          2HG2      VAL 135  -6.452  14.415  14.415
 1082   2HG2  VAL 135          1HG2      VAL 135  -5.189  14.073  14.073
 1083   3HG2  VAL 135          3HG2      VAL 135  -5.433  15.721  15.721
 1084    H    ARG 136           H        ARG 136  -7.274  13.379  13.379
 1085    HA   ARG 136           HA       ARG 136  -6.857  12.877  12.877
 1086   1HB   ARG 136          2HB       ARG 136  -8.939  14.060  14.060
 1087   2HB   ARG 136          1HB       ARG 136  -8.747  14.975  14.975
 1088   1HG   ARG 136          2HG       ARG 136  -9.268  13.176  13.176
 1089   2HG   ARG 136          1HG       ARG 136  -8.747  11.991  11.991
 1090   1HD   ARG 136          2HD       ARG 136 -11.281  13.655  13.655
 1091   2HD   ARG 136          1HD       ARG 136 -11.164  11.905  11.905
 1092    HE   ARG 136           HE       ARG 136  -9.896  12.472  12.472
 1093   1HH1  ARG 136          1HH2      ARG 136 -12.662  11.095  11.095
 1094   2HH1  ARG 136          2HH2      ARG 136 -13.672  11.886  11.886
 1095   1HH2  ARG 136          2HH1      ARG 136 -11.330  14.328  14.328
 1096   2HH2  ARG 136          1HH1      ARG 136 -12.918  13.719  13.719
 1097    H    GLU 137           HN       GLU 137  -5.783  13.796  13.796
 1098    HA   GLU 137           HA       GLU 137  -4.308  15.264  15.264
 1099   1HB   GLU 137          2HB       GLU 137  -6.750  16.010  16.010
 1100   2HB   GLU 137          1HB       GLU 137  -6.337  17.356  17.356
 1101   1HG   GLU 137          2HG       GLU 137  -4.314  17.749  17.749
 1102   2HG   GLU 137          1HG       GLU 137  -5.054  16.613  16.613

  Start of MODEL   25
    1   1H    PRO   1          1H        PRO   1 -16.585   7.513   7.513
    2   2H    PRO   1          2H        PRO   1 -16.205   6.650   6.650
    3    HA   PRO   1           HA       PRO   1 -16.702   4.733   4.733
    4   1HB   PRO   1          2HB       PRO   1 -19.307   5.207   5.207
    5   2HB   PRO   1          1HB       PRO   1 -18.894   4.329   4.329
    6   1HG   PRO   1          2HG       PRO   1 -20.111   6.909   6.909
    7   2HG   PRO   1          1HG       PRO   1 -19.690   6.030   6.030
    8   1HD   PRO   1          1HD       PRO   1 -18.401   8.340   8.340
    9   2HD   PRO   1          2HD       PRO   1 -17.993   7.465   7.465
   10    H    ASN   2           H        ASN   2 -15.228   6.457   6.457
   11    HA   ASN   2           HA       ASN   2 -15.778   5.370   5.370
   12   1HB   ASN   2          2HB       ASN   2 -16.496   8.180   8.180
   13   2HB   ASN   2          1HB       ASN   2 -15.685   7.917   7.917
   14   1HD2  ASN   2          2HD2      ASN   2 -18.428   6.143   6.143
   15   2HD2  ASN   2          1HD2      ASN   2 -16.759   6.428   6.428
   16    H    PHE   3           H        PHE   3 -13.818   4.959   4.959
   17    HA   PHE   3           HA       PHE   3 -11.450   6.423   6.423
   18   1HB   PHE   3          2HB       PHE   3 -11.739   3.896   3.896
   19   2HB   PHE   3          1HB       PHE   3 -10.205   4.590   4.590
   20    HD1  PHE   3           HD1      PHE   3 -13.475   3.711   3.711
   21    HD2  PHE   3           HD2      PHE   3  -9.182   3.541   3.541
   22    HE1  PHE   3           HE1      PHE   3 -13.581   2.454   2.454
   23    HE2  PHE   3           HE2      PHE   3  -9.299   2.277   2.277
   24    HZ   PHE   3           HZ       PHE   3 -11.498   1.725   1.725
   25    H    SER   4           H        SER   4 -13.593   6.586   6.586
   26    HA   SER   4           HA       SER   4 -11.763   6.935   6.935
   27   1HB   SER   4          2HB       SER   4 -13.692   7.684   7.684
   28   2HB   SER   4          1HB       SER   4 -14.179   6.334   6.334
   29    HG   SER   4           HG       SER   4 -15.050   8.888   8.888
   30    H    GLY   5           H        GLY   5 -10.446   8.581   8.581
   31   1HA   GLY   5          2HA       GLY   5 -10.990  11.249  11.249
   32   2HA   GLY   5          1HA       GLY   5 -10.679  11.120  11.120
   33    H    ASN   6           H        ASN   6  -8.778  12.596  12.596
   34    HA   ASN   6           HA       ASN   6  -6.557  10.892  10.892
   35   1HB   ASN   6          2HB       ASN   6  -6.971  13.878  13.878
   36   2HB   ASN   6          1HB       ASN   6  -5.348  13.205  13.205
   37   1HD2  ASN   6          2HD2      ASN   6  -6.214  11.763  11.763
   38   2HD2  ASN   6          1HD2      ASN   6  -5.588  11.195  11.195
   39    H    TRP   7           H        TRP   7  -4.427  11.399  11.399
   40    HA   TRP   7           HA       TRP   7  -5.019  11.845  11.845
   41   1HB   TRP   7          2HB       TRP   7  -4.017   9.232   9.232
   42   2HB   TRP   7          1HB       TRP   7  -4.012   9.624   9.624
   43    HD1  TRP   7           HD1      TRP   7  -6.222   8.405   8.405
   44    HE1  TRP   7           HE1      TRP   7  -8.651   8.140   8.140
   45    HE3  TRP   7           HE3      TRP   7  -5.780  10.784  10.784
   46    HZ2  TRP   7           HZ2      TRP   7 -10.188   8.878   8.878
   47    HZ3  TRP   7           HZ3      TRP   7  -7.723  11.028  11.028
   48    HH2  TRP   7           HH2      TRP   7  -9.912  10.077  10.077
   49    H    LYS   8           H        LYS   8  -3.416  12.942  12.942
   50    HA   LYS   8           HA       LYS   8  -0.676  12.665  12.665
   51   1HB   LYS   8          2HB       LYS   8  -2.129  15.048  15.048
   52   2HB   LYS   8          1HB       LYS   8  -0.367  14.984  14.984
   53   1HG   LYS   8          2HG       LYS   8  -0.735  14.265  14.265
   54   2HG   LYS   8          1HG       LYS   8  -2.217  15.196  15.196
   55   1HD   LYS   8          2HD       LYS   8  -0.789  17.069  17.069
   56   2HD   LYS   8          1HD       LYS   8   0.627  16.151  16.151
   57   1HE   LYS   8          2HE       LYS   8  -1.623  16.924  16.924
   58   2HE   LYS   8          1HE       LYS   8  -0.159  17.886  17.886
   59   1HZ   LYS   8          1HZ       LYS   8  -0.117  15.013  15.013
   60   2HZ   LYS   8          3HZ       LYS   8  -0.120  16.254  16.254
   61   3HZ   LYS   8          2HZ       LYS   8   1.171  16.120  16.120
   62    H    ILE   9           H        ILE   9   0.461  11.405  11.405
   63    HA   ILE   9           HA       ILE   9  -0.220  10.885  10.885
   64    HB   ILE   9           HB       ILE   9   1.057   9.266   9.266
   65   1HG1  ILE   9          2HG1      ILE   9   1.606   9.832   9.832
   66   2HG1  ILE   9          1HG1      ILE   9   2.609   8.682   8.682
   67   1HG2  ILE   9          3HG2      ILE   9   2.935  11.537  11.537
   68   2HG2  ILE   9          2HG2      ILE   9   3.496   9.866   9.866
   69   3HG2  ILE   9          1HG2      ILE   9   2.182  10.402  10.402
   70   1HD1  ILE   9          3HD1      ILE   9   3.541  11.468  11.468
   71   2HD1  ILE   9          2HD1      ILE   9   3.550  10.884  10.884
   72   3HD1  ILE   9          1HD1      ILE   9   4.447  10.016  10.016
   73    H    ILE  10           H        ILE  10   0.494  11.755  11.755
   74    HA   ILE  10           HA       ILE  10   2.296  14.132  14.132
   75    HB   ILE  10           HB       ILE  10   0.948  15.213  15.213
   76   1HG1  ILE  10          2HG1      ILE  10  -1.457  13.908  13.908
   77   2HG1  ILE  10          1HG1      ILE  10  -0.344  12.544  12.544
   78   1HG2  ILE  10          2HG2      ILE  10  -0.261  14.330  14.330
   79   2HG2  ILE  10          1HG2      ILE  10  -1.276  15.222  15.222
   80   3HG2  ILE  10          3HG2      ILE  10   0.211  15.947  15.947
   81   1HD1  ILE  10          2HD1      ILE  10  -0.151  14.835  14.835
   82   2HD1  ILE  10          1HD1      ILE  10  -0.788  13.232  13.232
   83   3HD1  ILE  10          3HD1      ILE  10   0.912  13.429  13.429
   84    H    ARG  11           H        ARG  11   1.456  11.215  11.215
   85    HA   ARG  11           HA       ARG  11   3.813  11.698  11.698
   86   1HB   ARG  11          2HB       ARG  11   1.010  11.342  11.342
   87   2HB   ARG  11          1HB       ARG  11   2.105  10.224  10.224
   88   1HG   ARG  11          2HG       ARG  11   2.927  13.093  13.093
   89   2HG   ARG  11          1HG       ARG  11   1.669  12.669  12.669
   90   1HD   ARG  11          2HD       ARG  11   3.116  11.539  11.539
   91   2HD   ARG  11          1HD       ARG  11   4.007  10.857  10.857
   92    HE   ARG  11           HE       ARG  11   4.436  13.732  13.732
   93   1HH1  ARG  11          1HH2      ARG  11   6.448  12.037  12.037
   94   2HH1  ARG  11          2HH2      ARG  11   7.625  11.768  11.768
   95   1HH2  ARG  11          2HH1      ARG  11   5.510  12.719  12.719
   96   2HH2  ARG  11          1HH1      ARG  11   7.093  12.154  12.154
   97    H    SER  12           H        SER  12   4.649   9.691   9.691
   98    HA   SER  12           HA       SER  12   3.891   7.061   7.061
   99   1HB   SER  12          2HB       SER  12   5.462   6.520   6.520
  100   2HB   SER  12          1HB       SER  12   4.520   7.903   7.903
  101    HG   SER  12           HG       SER  12   6.709   8.287   8.287
  102    H    GLU  13           H        GLU  13   5.864   5.528   5.528
  103    HA   GLU  13           HA       GLU  13   8.092   6.782   6.782
  104   1HB   GLU  13          2HB       GLU  13   7.511   5.826   5.826
  105   2HB   GLU  13          1HB       GLU  13   6.306   6.991   6.991
  106   1HG   GLU  13          2HG       GLU  13   5.548   4.423   4.423
  107   2HG   GLU  13          1HG       GLU  13   5.924   4.241   4.241
  108    H    ASN  14           H        ASN  14   7.561   4.688   4.688
  109    HA   ASN  14           HA       ASN  14   9.572   2.773   2.773
  110   1HB   ASN  14          2HB       ASN  14   7.420   1.085   1.085
  111   2HB   ASN  14          1HB       ASN  14   8.266   1.047   1.047
  112   1HD2  ASN  14          2HD2      ASN  14   5.304   2.014   2.014
  113   2HD2  ASN  14          1HD2      ASN  14   6.667   1.020   1.020
  114    H    PHE  15           H        PHE  15   9.082   4.711   4.711
  115    HA   PHE  15           HA       PHE  15   8.505   3.315   3.315
  116   1HB   PHE  15          2HB       PHE  15   8.606   5.842   5.842
  117   2HB   PHE  15          1HB       PHE  15  10.353   5.687   5.687
  118    HD1  PHE  15           HD2      PHE  15   9.659   3.210   3.210
  119    HD2  PHE  15           HD1      PHE  15   9.225   7.468   7.468
  120    HE1  PHE  15           HE2      PHE  15   9.754   3.400   3.400
  121    HE2  PHE  15           HE1      PHE  15   9.304   7.635   7.635
  122    HZ   PHE  15           HZ       PHE  15   9.561   5.580   5.580
  123    H    GLU  16           H        GLU  16  11.709   4.442   4.442
  124    HA   GLU  16           HA       GLU  16  13.244   2.849   2.849
  125   1HB   GLU  16          2HB       GLU  16  14.040   4.746   4.746
  126   2HB   GLU  16          1HB       GLU  16  14.097   3.538   3.538
  127   1HG   GLU  16          2HG       GLU  16  15.887   2.433   2.433
  128   2HG   GLU  16          1HG       GLU  16  15.406   2.821   2.821
  129    H    GLU  17           H        GLU  17  11.657   2.051   2.051
  130    HA   GLU  17           HA       GLU  17  13.044  -0.365  -0.365
  131   1HB   GLU  17          2HB       GLU  17  10.208   0.483   0.483
  132   2HB   GLU  17          1HB       GLU  17  11.063  -0.850  -0.850
  133   1HG   GLU  17          2HG       GLU  17  12.908   1.003   1.003
  134   2HG   GLU  17          1HG       GLU  17  11.531   2.091   2.091
  135    H    LEU  18           H        LEU  18  10.266   0.337   0.337
  136    HA   LEU  18           HA       LEU  18   9.756  -2.474  -2.474
  137   1HB   LEU  18          2HB       LEU  18   8.156  -0.287  -0.287
  138   2HB   LEU  18          1HB       LEU  18   8.619  -0.398  -0.398
  139    HG   LEU  18           HG       LEU  18   7.945  -2.802  -2.802
  140   1HD1  LEU  18          2HD1      LEU  18   7.368  -2.090  -2.090
  141   2HD1  LEU  18          1HD1      LEU  18   6.329  -3.268  -3.268
  142   3HD1  LEU  18          3HD1      LEU  18   8.061  -3.568  -3.568
  143   1HD2  LEU  18          1HD2      LEU  18   6.130  -0.499  -0.499
  144   2HD2  LEU  18          3HD2      LEU  18   6.156  -1.698  -1.698
  145   3HD2  LEU  18          2HD2      LEU  18   5.384  -2.078  -2.078
  146    H    LEU  19           H        LEU  19  11.837  -0.038  -0.038
  147    HA   LEU  19           HA       LEU  19  12.000  -1.443  -1.443
  148   1HB   LEU  19          2HB       LEU  19  13.773   0.842   0.842
  149   2HB   LEU  19          1HB       LEU  19  13.390   0.341   0.341
  150    HG   LEU  19           HG       LEU  19  11.626   1.793   1.793
  151   1HD1  LEU  19          1HD1      LEU  19  13.275   2.639   2.639
  152   2HD1  LEU  19          3HD1      LEU  19  11.664   2.656   2.656
  153   3HD1  LEU  19          2HD1      LEU  19  11.984   3.571   3.571
  154   1HD2  LEU  19          1HD2      LEU  19  10.308  -0.081  -0.081
  155   2HD2  LEU  19          3HD2      LEU  19   9.727   1.517   1.517
  156   3HD2  LEU  19          2HD2      LEU  19  10.710   0.579   0.579
  157    H    LYS  20           H        LYS  20  13.520  -1.439  -1.439
  158    HA   LYS  20           HA       LYS  20  16.023  -2.626  -2.626
  159   1HB   LYS  20          2HB       LYS  20  15.053  -2.496  -2.496
  160   2HB   LYS  20          1HB       LYS  20  16.710  -2.717  -2.717
  161   1HG   LYS  20          2HG       LYS  20  15.561  -0.295  -0.295
  162   2HG   LYS  20          1HG       LYS  20  15.444  -0.280  -0.280
  163   1HD   LYS  20          2HD       LYS  20  17.982  -0.822  -0.822
  164   2HD   LYS  20          1HD       LYS  20  17.577   0.708   0.708
  165   1HE   LYS  20          2HE       LYS  20  17.377  -1.647  -1.647
  166   2HE   LYS  20          1HE       LYS  20  19.008  -1.293  -1.293
  167   1HZ   LYS  20          2HZ       LYS  20  17.193   0.712   0.712
  168   2HZ   LYS  20          1HZ       LYS  20  18.404  -0.123  -0.123
  169   3HZ   LYS  20          3HZ       LYS  20  18.827   0.930   0.930
  170    H    VAL  21           H        VAL  21  12.936  -3.588  -3.588
  171    HA   VAL  21           HA       VAL  21  13.674  -6.369  -6.369
  172    HB   VAL  21           HB       VAL  21  11.829  -5.186  -5.186
  173   1HG1  VAL  21          1HG1      VAL  21  11.007  -3.870  -3.870
  174   2HG1  VAL  21          3HG1      VAL  21  10.354  -5.344  -5.344
  175   3HG1  VAL  21          2HG1      VAL  21   9.719  -4.735  -4.735
  176   1HG2  VAL  21          3HG2      VAL  21  11.957  -7.766  -7.766
  177   2HG2  VAL  21          2HG2      VAL  21  10.571  -7.117  -7.117
  178   3HG2  VAL  21          1HG2      VAL  21  10.480  -7.352  -7.352
  179    H    LEU  22           H        LEU  22  12.077  -4.471  -4.471
  180    HA   LEU  22           HA       LEU  22  11.313  -6.616  -6.616
  181   1HB   LEU  22          2HB       LEU  22  11.458  -3.663  -3.663
  182   2HB   LEU  22          1HB       LEU  22  11.643  -4.398  -4.398
  183    HG   LEU  22           HG       LEU  22   9.513  -5.523  -5.523
  184   1HD1  LEU  22          3HD1      LEU  22   9.708  -5.992  -5.992
  185   2HD1  LEU  22          2HD1      LEU  22   9.293  -4.308  -4.308
  186   3HD1  LEU  22          1HD1      LEU  22   8.129  -5.373  -5.373
  187   1HD2  LEU  22          2HD2      LEU  22   9.736  -2.961  -2.961
  188   2HD2  LEU  22          1HD2      LEU  22   8.132  -3.627  -3.627
  189   3HD2  LEU  22          3HD2      LEU  22   8.996  -2.774  -2.774
  190    H    GLY  23           H        GLY  23  14.032  -4.368  -4.368
  191   1HA   GLY  23          2HA       GLY  23  15.361  -5.896  -5.896
  192   2HA   GLY  23          1HA       GLY  23  15.800  -4.272  -4.272
  193    H    VAL  24           H        VAL  24  17.989  -4.990  -4.990
  194    HA   VAL  24           HA       VAL  24  18.685  -6.180  -6.180
  195    HB   VAL  24           HB       VAL  24  20.312  -7.744  -7.744
  196   1HG1  VAL  24          3HG1      VAL  24  18.001  -8.431  -8.431
  197   2HG1  VAL  24          2HG1      VAL  24  17.458  -8.184  -8.184
  198   3HG1  VAL  24          1HG1      VAL  24  18.662  -9.421  -9.421
  199   1HG2  VAL  24          2HG2      VAL  24  18.819  -6.912  -6.912
  200   2HG2  VAL  24          1HG2      VAL  24  20.514  -6.577  -6.577
  201   3HG2  VAL  24          3HG2      VAL  24  19.979  -8.238  -8.238
  202    H    ASN  25           H        ASN  25  19.788  -4.608  -4.608
  203    HA   ASN  25           HA       ASN  25  22.439  -3.984  -3.984
  204   1HB   ASN  25          2HB       ASN  25  21.067  -3.705  -3.705
  205   2HB   ASN  25          1HB       ASN  25  20.995  -2.047  -2.047
  206   1HD2  ASN  25          2HD2      ASN  25  24.319  -1.404  -1.404
  207   2HD2  ASN  25          1HD2      ASN  25  22.783  -0.793  -0.793
  208    H    VAL  26           H        VAL  26  22.214  -0.991  -0.991
  209    HA   VAL  26           HA       VAL  26  20.823  -0.195  -0.195
  210    HB   VAL  26           HB       VAL  26  23.501   1.001   1.001
  211   1HG1  VAL  26          2HG1      VAL  26  21.926   0.444   0.444
  212   2HG1  VAL  26          1HG1      VAL  26  23.502   1.233   1.233
  213   3HG1  VAL  26          3HG1      VAL  26  22.107   2.007   2.007
  214   1HG2  VAL  26          1HG2      VAL  26  22.985  -1.719  -1.719
  215   2HG2  VAL  26          3HG2      VAL  26  24.224  -1.237  -1.237
  216   3HG2  VAL  26          2HG2      VAL  26  24.369  -0.765  -0.765
  217    H    MET  27           H        MET  27  22.558   0.932   0.932
  218    HA   MET  27           HA       MET  27  21.399   3.580   3.580
  219   1HB   MET  27          2HB       MET  27  23.471   2.770   2.770
  220   2HB   MET  27          1HB       MET  27  22.320   2.130   2.130
  221   1HG   MET  27          2HG       MET  27  21.313   4.390   4.390
  222   2HG   MET  27          1HG       MET  27  22.522   5.017   5.017
  223   1HE   MET  27          2HE       MET  27  23.064   6.660   6.660
  224   2HE   MET  27          1HE       MET  27  24.791   6.335   6.335
  225   3HE   MET  27          3HE       MET  27  23.854   6.718   6.718
  226    H    LEU  28           H        LEU  28  20.476   0.473   0.473
  227    HA   LEU  28           HA       LEU  28  18.383   1.223   1.223
  228   1HB   LEU  28          2HB       LEU  28  19.295  -1.164  -1.164
  229   2HB   LEU  28          1HB       LEU  28  17.555  -1.143  -1.143
  230    HG   LEU  28           HG       LEU  28  18.703  -2.242  -2.242
  231   1HD1  LEU  28          2HD1      LEU  28  16.662  -0.592  -0.592
  232   2HD1  LEU  28          1HD1      LEU  28  17.834   0.405   0.405
  233   3HD1  LEU  28          3HD1      LEU  28  17.466  -1.221  -1.221
  234   1HD2  LEU  28          2HD2      LEU  28  20.129   0.423   0.423
  235   2HD2  LEU  28          1HD2      LEU  28  20.857  -1.155  -1.155
  236   3HD2  LEU  28          3HD2      LEU  28  20.144  -0.799  -0.799
  237    H    ARG  29           H        ARG  29  18.504   1.225   1.225
  238    HA   ARG  29           HA       ARG  29  15.563   1.447   1.447
  239   1HB   ARG  29          2HB       ARG  29  17.704   1.536   1.536
  240   2HB   ARG  29          1HB       ARG  29  15.967   1.438   1.438
  241   1HG   ARG  29          2HG       ARG  29  16.053  -0.801  -0.801
  242   2HG   ARG  29          1HG       ARG  29  16.674  -0.658  -0.658
  243   1HD   ARG  29          2HD       ARG  29  18.958  -0.540  -0.540
  244   2HD   ARG  29          1HD       ARG  29  18.397  -0.493  -0.493
  245    HE   ARG  29           HE       ARG  29  17.984  -2.875  -2.875
  246   1HH1  ARG  29          1HH2      ARG  29  19.781  -1.674  -1.674
  247   2HH1  ARG  29          2HH2      ARG  29  19.493  -3.022  -3.022
  248   1HH2  ARG  29          2HH1      ARG  29  17.165  -4.501  -4.501
  249   2HH2  ARG  29          1HH1      ARG  29  18.014  -4.620  -4.620
  250    H    LYS  30           H        LYS  30  18.439   3.393   3.393
  251    HA   LYS  30           HA       LYS  30  17.000   5.677   5.677
  252   1HB   LYS  30          2HB       LYS  30  19.628   4.958   4.958
  253   2HB   LYS  30          1HB       LYS  30  19.613   6.197   6.197
  254   1HG   LYS  30          2HG       LYS  30  18.111   6.837   6.837
  255   2HG   LYS  30          1HG       LYS  30  19.867   6.768   6.768
  256   1HD   LYS  30          2HD       LYS  30  19.986   8.281   8.281
  257   2HD   LYS  30          1HD       LYS  30  18.245   8.509   8.509
  258   1HE   LYS  30          2HE       LYS  30  18.469   9.593   9.593
  259   2HE   LYS  30          1HE       LYS  30  20.091   8.952   8.952
  260   1HZ   LYS  30          2HZ       LYS  30  20.717  10.284  10.284
  261   2HZ   LYS  30          1HZ       LYS  30  19.239  11.096  11.096
  262   3HZ   LYS  30          3HZ       LYS  30  20.415  11.159  11.159
  263    H    ILE  31           H        ILE  31  17.489   4.523   4.523
  264    HA   ILE  31           HA       ILE  31  17.121   7.187   7.187
  265    HB   ILE  31           HB       ILE  31  17.280   4.401   4.401
  266   1HG1  ILE  31          2HG1      ILE  31  19.375   5.325   5.325
  267   2HG1  ILE  31          1HG1      ILE  31  19.477   5.179   5.179
  268   1HG2  ILE  31          1HG2      ILE  31  17.015   7.119   7.119
  269   2HG2  ILE  31          3HG2      ILE  31  17.470   5.640   5.640
  270   3HG2  ILE  31          2HG2      ILE  31  15.877   5.776   5.776
  271   1HD1  ILE  31          1HD1      ILE  31  18.419   7.749   7.749
  272   2HD1  ILE  31          3HD1      ILE  31  19.706   7.550   7.550
  273   3HD1  ILE  31          2HD1      ILE  31  20.056   7.361   7.361
  274    H    ALA  32           H        ALA  32  15.217   4.397   4.397
  275    HA   ALA  32           HA       ALA  32  12.847   5.275   5.275
  276   1HB   ALA  32          2HB       ALA  32  13.376   3.077   3.077
  277   2HB   ALA  32          1HB       ALA  32  11.752   3.433   3.433
  278   3HB   ALA  32          3HB       ALA  32  13.005   2.917   2.917
  279    H    VAL  33           H        VAL  33  14.251   5.704   5.704
  280    HA   VAL  33           HA       VAL  33  11.828   6.690   6.690
  281    HB   VAL  33           HB       VAL  33  14.645   7.193   7.193
  282   1HG1  VAL  33          3HG1      VAL  33  11.893   7.170   7.170
  283   2HG1  VAL  33          2HG1      VAL  33  13.205   6.627   6.627
  284   3HG1  VAL  33          1HG1      VAL  33  13.247   8.245   8.245
  285   1HG2  VAL  33          2HG2      VAL  33  13.627   4.621   4.621
  286   2HG2  VAL  33          1HG2      VAL  33  15.032   5.006   5.006
  287   3HG2  VAL  33          3HG2      VAL  33  13.452   4.811   4.811
  288    H    ALA  34           H        ALA  34  14.862   8.062   8.062
  289    HA   ALA  34           HA       ALA  34  14.166  10.797  10.797
  290   1HB   ALA  34          3HB       ALA  34  16.480   9.711   9.711
  291   2HB   ALA  34          2HB       ALA  34  15.952   9.946   9.946
  292   3HB   ALA  34          1HB       ALA  34  16.118  11.333  11.333
  293    H    ALA  35           H        ALA  35  13.691   8.567   8.567
  294    HA   ALA  35           HA       ALA  35  12.707  10.408  10.408
  295   1HB   ALA  35          1HB       ALA  35  12.192   7.464   7.464
  296   2HB   ALA  35          3HB       ALA  35  11.512   8.325   8.325
  297   3HB   ALA  35          2HB       ALA  35  13.261   8.187   8.187
  298    H    ALA  36           H        ALA  36  10.917   8.324   8.324
  299    HA   ALA  36           HA       ALA  36   8.404   9.745   9.745
  300   1HB   ALA  36          3HB       ALA  36   9.250   7.303   7.303
  301   2HB   ALA  36          2HB       ALA  36   7.873   8.122   8.122
  302   3HB   ALA  36          1HB       ALA  36   7.804   7.596   7.596
  303    H    SER  37           H        SER  37   9.944  11.751  11.751
  304    HA   SER  37           HA       SER  37  10.073  12.032  12.032
  305   1HB   SER  37          2HB       SER  37  11.348  13.436  13.436
  306   2HB   SER  37          1HB       SER  37   9.835  14.277  14.277
  307    HG   SER  37           HG       SER  37  11.310  14.134  14.134
  308    H    LYS  38           H        LYS  38   7.707  12.776  12.776
  309    HA   LYS  38           HA       LYS  38   5.544  12.835  12.835
  310   1HB   LYS  38          2HB       LYS  38   6.453  15.274  15.274
  311   2HB   LYS  38          1HB       LYS  38   4.740  15.061  15.061
  312   1HG   LYS  38          2HG       LYS  38   5.562  14.598  14.598
  313   2HG   LYS  38          1HG       LYS  38   7.042  15.401  15.401
  314   1HD   LYS  38          2HD       LYS  38   5.388  17.233  17.233
  315   2HD   LYS  38          1HD       LYS  38   4.270  16.526  16.526
  316   1HE   LYS  38          2HE       LYS  38   7.037  17.122  17.122
  317   2HE   LYS  38          1HE       LYS  38   5.956  18.490  18.490
  318   1HZ   LYS  38          3HZ       LYS  38   4.291  17.182  17.182
  319   2HZ   LYS  38          2HZ       LYS  38   5.586  16.182  16.182
  320   3HZ   LYS  38          1HZ       LYS  38   5.608  17.835  17.835
  321    HA   PRO  39           HA       PRO  39   4.832  11.016  11.016
  322   1HB   PRO  39          2HB       PRO  39   3.922   8.586   8.586
  323   2HB   PRO  39          1HB       PRO  39   5.622   8.952   8.952
  324   1HG   PRO  39          2HG       PRO  39   4.232   8.728   8.728
  325   2HG   PRO  39          1HG       PRO  39   5.921   8.386   8.386
  326   1HD   PRO  39          2HD       PRO  39   5.022  10.710  10.710
  327   2HD   PRO  39          1HD       PRO  39   6.582  10.535  10.535
  328    H    ALA  40           H        ALA  40   2.737  10.319  10.319
  329    HA   ALA  40           HA       ALA  40   0.413  11.269  11.269
  330   1HB   ALA  40          1HB       ALA  40   1.105  11.597  11.597
  331   2HB   ALA  40          3HB       ALA  40  -0.572  11.688  11.688
  332   3HB   ALA  40          2HB       ALA  40   0.618  12.829  12.829
  333    H    VAL  41           H        VAL  41  -1.708  10.332  10.332
  334    HA   VAL  41           HA       VAL  41  -1.484   7.654   7.654
  335    HB   VAL  41           HB       VAL  41  -2.414   8.161   8.161
  336   1HG1  VAL  41          2HG1      VAL  41  -2.845   5.754   5.754
  337   2HG1  VAL  41          1HG1      VAL  41  -2.973   5.688   5.688
  338   3HG1  VAL  41          3HG1      VAL  41  -4.073   6.710   6.710
  339   1HG2  VAL  41          2HG2      VAL  41  -0.296   6.405   6.405
  340   2HG2  VAL  41          1HG2      VAL  41  -0.049   7.755   7.755
  341   3HG2  VAL  41          3HG2      VAL  41  -0.800   6.267   6.267
  342    H    GLU  42           H        GLU  42  -3.769   6.797   6.797
  343    HA   GLU  42           HA       GLU  42  -5.933   8.794   8.794
  344   1HB   GLU  42          2HB       GLU  42  -4.794   9.397   9.397
  345   2HB   GLU  42          1HB       GLU  42  -4.968   7.741   7.741
  346   1HG   GLU  42          2HG       GLU  42  -7.479   8.029   8.029
  347   2HG   GLU  42          1HG       GLU  42  -7.170   9.744   9.744
  348    H    ILE  43           H        ILE  43  -7.412   7.492   7.492
  349    HA   ILE  43           HA       ILE  43  -7.595   4.656   4.656
  350    HB   ILE  43           HB       ILE  43  -8.706   6.189   6.189
  351   1HG1  ILE  43          2HG1      ILE  43  -7.088   3.820   3.820
  352   2HG1  ILE  43          1HG1      ILE  43  -6.218   4.953   4.953
  353   1HG2  ILE  43          3HG2      ILE  43  -9.371   3.469   3.469
  354   2HG2  ILE  43          2HG2      ILE  43  -9.185   3.653   3.653
  355   3HG2  ILE  43          1HG2      ILE  43 -10.384   4.614   4.614
  356   1HD1  ILE  43          3HD1      ILE  43  -7.608   6.317   6.317
  357   2HD1  ILE  43          2HD1      ILE  43  -6.469   5.113   5.113
  358   3HD1  ILE  43          1HD1      ILE  43  -5.911   6.397   6.397
  359    H    LYS  44           H        LYS  44  -9.317   3.860   3.860
  360    HA   LYS  44           HA       LYS  44 -11.583   5.719   5.719
  361   1HB   LYS  44          2HB       LYS  44 -11.374   3.439   3.439
  362   2HB   LYS  44          1HB       LYS  44 -11.502   5.151   5.151
  363   1HG   LYS  44          2HG       LYS  44  -9.106   5.444   5.444
  364   2HG   LYS  44          1HG       LYS  44  -8.898   3.857   3.857
  365   1HD   LYS  44          2HD       LYS  44  -9.285   2.746   2.746
  366   2HD   LYS  44          1HD       LYS  44 -10.208   4.087   4.087
  367   1HE   LYS  44          2HE       LYS  44  -7.996   5.416   5.416
  368   2HE   LYS  44          1HE       LYS  44  -7.218   3.847   3.847
  369   1HZ   LYS  44          2HZ       LYS  44  -8.252   3.096   3.096
  370   2HZ   LYS  44          1HZ       LYS  44  -8.997   4.610   4.610
  371   3HZ   LYS  44          3HZ       LYS  44  -7.307   4.481   4.481
  372    H    GLN  45           H        GLN  45 -13.300   5.077   5.077
  373    HA   GLN  45           HA       GLN  45 -13.489   2.202   2.202
  374   1HB   GLN  45          2HB       GLN  45 -13.618   3.848   3.848
  375   2HB   GLN  45          1HB       GLN  45 -15.031   4.585   4.585
  376   1HG   GLN  45          2HG       GLN  45 -16.261   2.455   2.455
  377   2HG   GLN  45          1HG       GLN  45 -14.852   1.707   1.707
  378   1HE2  GLN  45          2HE2      GLN  45 -16.423   2.623   2.623
  379   2HE2  GLN  45          1HE2      GLN  45 -16.070   1.339   1.339
  380    H    GLU  46           H        GLU  46 -14.824   0.903   0.903
  381    HA   GLU  46           HA       GLU  46 -17.281   2.076   2.076
  382   1HB   GLU  46          2HB       GLU  46 -15.317   0.051   0.051
  383   2HB   GLU  46          1HB       GLU  46 -16.991   0.047   0.047
  384   1HG   GLU  46          2HG       GLU  46 -15.206   2.495   2.495
  385   2HG   GLU  46          1HG       GLU  46 -15.450   1.427   1.427
  386    H    GLY  47           H        GLY  47 -17.476   1.257   1.257
  387   1HA   GLY  47          2HA       GLY  47 -19.124  -0.075  -0.075
  388   2HA   GLY  47          1HA       GLY  47 -19.105  -1.214  -1.214
  389    H    ASP  48           H        ASP  48 -18.336  -3.150  -3.150
  390    HA   ASP  48           HA       ASP  48 -16.471  -3.330  -3.330
  391   1HB   ASP  48          2HB       ASP  48 -16.362  -5.783  -5.783
  392   2HB   ASP  48          1HB       ASP  48 -17.924  -5.199  -5.199
  393    H    THR  49           H        THR  49 -15.960  -2.470  -2.470
  394    HA   THR  49           HA       THR  49 -13.383  -3.897  -3.897
  395    HB   THR  49           HB       THR  49 -15.098  -2.284  -2.284
  396    HG1  THR  49           HG1      THR  49 -14.974  -4.213  -4.213
  397   1HG2  THR  49          2HG2      THR  49 -12.204  -3.083  -3.083
  398   2HG2  THR  49          1HG2      THR  49 -13.287  -2.673  -2.673
  399   3HG2  THR  49          3HG2      THR  49 -12.894  -1.463  -1.463
  400    H    PHE  50           H        PHE  50 -11.464  -2.832  -2.832
  401    HA   PHE  50           HA       PHE  50 -11.581   0.126   0.126
  402   1HB   PHE  50          2HB       PHE  50 -10.190  -1.864  -1.864
  403   2HB   PHE  50          1HB       PHE  50  -9.974  -0.113  -0.113
  404    HD1  PHE  50           HD2      PHE  50 -11.826   1.351   1.351
  405    HD2  PHE  50           HD1      PHE  50 -12.279  -2.910  -2.910
  406    HE1  PHE  50           HE2      PHE  50 -13.949   1.534   1.534
  407    HE2  PHE  50           HE1      PHE  50 -14.410  -2.729  -2.729
  408    HZ   PHE  50           HZ       PHE  50 -15.252  -0.509  -0.509
  409    H    TYR  51           H        TYR  51 -10.313   0.984   0.984
  410    HA   TYR  51           HA       TYR  51  -7.954  -0.498  -0.498
  411   1HB   TYR  51          2HB       TYR  51  -9.770   0.364   0.364
  412   2HB   TYR  51          1HB       TYR  51  -9.304   1.991   1.991
  413    HD1  TYR  51           HD1      TYR  51  -6.741   2.539   2.539
  414    HD2  TYR  51           HD2      TYR  51  -8.743  -0.641  -0.641
  415    HE1  TYR  51           HE1      TYR  51  -4.946   2.522   2.522
  416    HE2  TYR  51           HE2      TYR  51  -6.947  -0.646  -0.646
  417    HH   TYR  51           HH       TYR  51  -5.226   1.187   1.187
  418    H    ILE  52           H        ILE  52  -5.871   0.596   0.596
  419    HA   ILE  52           HA       ILE  52  -5.786   3.174   3.174
  420    HB   ILE  52           HB       ILE  52  -3.899   1.051   1.051
  421   1HG1  ILE  52          2HG1      ILE  52  -6.839   1.194   1.194
  422   2HG1  ILE  52          1HG1      ILE  52  -6.014  -0.172  -0.172
  423   1HG2  ILE  52          1HG2      ILE  52  -4.329   3.648   3.648
  424   2HG2  ILE  52          3HG2      ILE  52  -5.395   2.851   2.851
  425   3HG2  ILE  52          2HG2      ILE  52  -3.677   2.456   2.456
  426   1HD1  ILE  52          2HD1      ILE  52  -4.511   0.315   0.315
  427   2HD1  ILE  52          1HD1      ILE  52  -6.168   0.603   0.603
  428   3HD1  ILE  52          3HD1      ILE  52  -5.728  -0.948  -0.948
  429    H    LYS  53           H        LYS  53  -4.771   4.316   4.316
  430    HA   LYS  53           HA       LYS  53  -2.349   3.162   3.162
  431   1HB   LYS  53          2HB       LYS  53  -4.276   4.298   4.298
  432   2HB   LYS  53          1HB       LYS  53  -3.639   5.809   5.809
  433   1HG   LYS  53          2HG       LYS  53  -1.367   4.497   4.497
  434   2HG   LYS  53          1HG       LYS  53  -2.596   4.111   4.111
  435   1HD   LYS  53          2HD       LYS  53  -2.337   6.938   6.938
  436   2HD   LYS  53          1HD       LYS  53  -1.200   6.330   6.330
  437   1HE   LYS  53          2HE       LYS  53  -2.939   5.855   5.855
  438   2HE   LYS  53          1HE       LYS  53  -4.189   6.030   6.030
  439   1HZ   LYS  53          2HZ       LYS  53  -2.408   8.238   8.238
  440   2HZ   LYS  53          1HZ       LYS  53  -3.956   7.968   7.968
  441   3HZ   LYS  53          3HZ       LYS  53  -3.779   8.352   8.352
  442    H    THR  54           H        THR  54  -0.475   3.640   3.640
  443    HA   THR  54           HA       THR  54  -0.295   6.229   6.229
  444    HB   THR  54           HB       THR  54   1.610   3.867   3.867
  445    HG1  THR  54           HG1      THR  54  -0.461   3.311   3.311
  446   1HG2  THR  54          3HG2      THR  54   1.795   6.523   6.523
  447   2HG2  THR  54          2HG2      THR  54   1.483   5.492   5.492
  448   3HG2  THR  54          1HG2      THR  54   2.867   5.168   5.168
  449    H    SER  55           H        SER  55   1.326   7.733   7.733
  450    HA   SER  55           HA       SER  55   3.081   6.991   6.991
  451   1HB   SER  55          2HB       SER  55   2.038   9.750   9.750
  452   2HB   SER  55          1HB       SER  55   2.271   8.582   8.582
  453    HG   SER  55           HG       SER  55   0.079   8.904   8.904
  454    H    THR  56           H        THR  56   5.102   7.308   7.308
  455    HA   THR  56           HA       THR  56   5.655   9.418   9.418
  456    HB   THR  56           HB       THR  56   8.036   8.165   8.165
  457    HG1  THR  56           HG1      THR  56   7.773   6.433   6.433
  458   1HG2  THR  56          1HG2      THR  56   5.640   7.636   7.636
  459   2HG2  THR  56          3HG2      THR  56   6.990   6.505   6.505
  460   3HG2  THR  56          2HG2      THR  56   7.240   8.212   8.212
  461    H    THR  57           H        THR  57   8.210  10.100  10.100
  462    HA   THR  57           HA       THR  57   8.031  12.013  12.013
  463    HB   THR  57           HB       THR  57   9.611  12.179  12.179
  464    HG1  THR  57           HG1      THR  57  10.195  13.337  13.337
  465   1HG2  THR  57          3HG2      THR  57  10.122   9.592   9.592
  466   2HG2  THR  57          2HG2      THR  57  11.441  10.194  10.194
  467   3HG2  THR  57          1HG2      THR  57  11.323  10.688  10.688
  468    H    VAL  58           H        VAL  58   9.406   8.730   8.730
  469    HA   VAL  58           HA       VAL  58   9.733   9.064   9.064
  470    HB   VAL  58           HB       VAL  58  11.442   7.355   7.355
  471   1HG1  VAL  58          2HG1      VAL  58  11.380   7.984   7.984
  472   2HG1  VAL  58          1HG1      VAL  58  12.933   7.656   7.656
  473   3HG1  VAL  58          3HG1      VAL  58  11.657   6.438   6.438
  474   1HG2  VAL  58          2HG2      VAL  58  11.477  10.164  10.164
  475   2HG2  VAL  58          1HG2      VAL  58  12.744   9.145   9.145
  476   3HG2  VAL  58          3HG2      VAL  58  12.799   9.608   9.608
  477    H    ARG  59           H        ARG  59   8.121   7.266   7.266
  478    HA   ARG  59           HA       ARG  59   7.804   4.992   4.992
  479   1HB   ARG  59          2HB       ARG  59   8.794   4.639   4.639
  480   2HB   ARG  59          1HB       ARG  59   7.104   4.744   4.744
  481   1HG   ARG  59          2HG       ARG  59   6.504   2.818   2.818
  482   2HG   ARG  59          1HG       ARG  59   7.743   3.012   3.012
  483   1HD   ARG  59          2HD       ARG  59   9.455   2.190   2.190
  484   2HD   ARG  59          1HD       ARG  59   8.484   2.425   2.425
  485    HE   ARG  59           HE       ARG  59   7.279   0.410   0.410
  486   1HH1  ARG  59          1HH2      ARG  59   6.888   0.394   0.394
  487   2HH1  ARG  59          2HH2      ARG  59   8.065  -0.728  -0.728
  488   1HH2  ARG  59          2HH1      ARG  59   9.986  -0.652  -0.652
  489   2HH2  ARG  59          1HH1      ARG  59   9.818  -1.322  -1.322
  490    H    THR  60           H        THR  60   5.620   3.838   3.838
  491    HA   THR  60           HA       THR  60   3.362   5.432   5.432
  492    HB   THR  60           HB       THR  60   3.605   4.895   4.895
  493    HG1  THR  60           HG1      THR  60   4.768   6.616   6.616
  494   1HG2  THR  60          1HG2      THR  60   1.623   6.175   6.175
  495   2HG2  THR  60          3HG2      THR  60   1.820   6.872   6.872
  496   3HG2  THR  60          2HG2      THR  60   1.348   5.181   5.181
  497    H    THR  61           H        THR  61   2.756   3.492   3.492
  498    HA   THR  61           HA       THR  61   2.275   1.081   1.081
  499    HB   THR  61           HB       THR  61   2.096  -0.127  -0.127
  500    HG1  THR  61           HG1      THR  61   2.863   2.341   2.341
  501   1HG2  THR  61          3HG2      THR  61   4.567   1.607   1.607
  502   2HG2  THR  61          2HG2      THR  61   4.468   0.120   0.120
  503   3HG2  THR  61          1HG2      THR  61   4.287   0.066   0.066
  504    H    GLU  62           H        GLU  62   0.274  -0.214  -0.214
  505    HA   GLU  62           HA       GLU  62  -1.942   1.267   1.267
  506   1HB   GLU  62          2HB       GLU  62  -3.330   1.454   1.454
  507   2HB   GLU  62          1HB       GLU  62  -1.832   2.355   2.355
  508   1HG   GLU  62          2HG       GLU  62  -1.142  -0.142  -0.142
  509   2HG   GLU  62          1HG       GLU  62  -2.828  -0.005  -0.005
  510    H    ILE  63           H        ILE  63  -3.054  -0.278  -0.278
  511    HA   ILE  63           HA       ILE  63  -3.097  -3.040  -3.040
  512    HB   ILE  63           HB       ILE  63  -3.613  -3.777  -3.777
  513   1HG1  ILE  63          2HG1      ILE  63  -3.082  -0.883  -0.883
  514   2HG1  ILE  63          1HG1      ILE  63  -4.690  -1.606  -1.606
  515   1HG2  ILE  63          1HG2      ILE  63  -1.225  -3.352  -3.352
  516   2HG2  ILE  63          3HG2      ILE  63  -1.190  -2.000  -2.000
  517   3HG2  ILE  63          2HG2      ILE  63  -1.396  -3.646  -3.646
  518   1HD1  ILE  63          2HD1      ILE  63  -2.492  -2.874  -2.874
  519   2HD1  ILE  63          1HD1      ILE  63  -3.459  -1.556  -1.556
  520   3HD1  ILE  63          3HD1      ILE  63  -4.238  -3.060  -3.060
  521    H    ASN  64           H        ASN  64  -5.252  -4.211  -4.211
  522    HA   ASN  64           HA       ASN  64  -7.570  -2.500  -2.500
  523   1HB   ASN  64          2HB       ASN  64  -8.587  -2.696  -2.696
  524   2HB   ASN  64          1HB       ASN  64  -6.940  -2.134  -2.134
  525   1HD2  ASN  64          2HD2      ASN  64  -7.996  -5.877  -5.877
  526   2HD2  ASN  64          1HD2      ASN  64  -8.973  -5.045  -5.045
  527    H    PHE  65           H        PHE  65  -9.234  -3.755  -3.755
  528    HA   PHE  65           HA       PHE  65  -9.434  -6.619  -6.619
  529   1HB   PHE  65          2HB       PHE  65  -8.895  -7.425  -7.425
  530   2HB   PHE  65          1HB       PHE  65  -7.531  -6.528  -6.528
  531    HD1  PHE  65           HD2      PHE  65  -7.074  -4.192  -4.192
  532    HD2  PHE  65           HD1      PHE  65 -10.122  -6.625  -6.625
  533    HE1  PHE  65           HE2      PHE  65  -7.199  -2.627  -2.627
  534    HE2  PHE  65           HE1      PHE  65 -10.260  -5.062  -5.062
  535    HZ   PHE  65           HZ       PHE  65  -8.805  -3.060  -3.060
  536    H    LYS  66           H        LYS  66 -10.818  -7.627  -7.627
  537    HA   LYS  66           HA       LYS  66 -13.121  -5.820  -5.820
  538   1HB   LYS  66          2HB       LYS  66 -14.574  -7.912  -7.912
  539   2HB   LYS  66          1HB       LYS  66 -13.955  -7.199  -7.199
  540   1HG   LYS  66          2HG       LYS  66 -12.005  -8.846  -8.846
  541   2HG   LYS  66          1HG       LYS  66 -12.934  -9.654  -9.654
  542   1HD   LYS  66          2HD       LYS  66 -14.457 -10.502 -10.502
  543   2HD   LYS  66          1HD       LYS  66 -14.417  -9.064  -9.064
  544   1HE   LYS  66          2HE       LYS  66 -12.639  -9.828  -9.828
  545   2HE   LYS  66          1HE       LYS  66 -11.951 -10.741 -10.741
  546   1HZ   LYS  66          2HZ       LYS  66 -14.539 -11.581 -11.581
  547   2HZ   LYS  66          1HZ       LYS  66 -13.128 -11.952 -11.952
  548   3HZ   LYS  66          3HZ       LYS  66 -13.314 -12.514 -12.514
  549    H    VAL  67           H        VAL  67 -14.211  -6.406  -6.406
  550    HA   VAL  67           HA       VAL  67 -12.317  -7.618  -7.618
  551    HB   VAL  67           HB       VAL  67 -15.037  -7.000  -7.000
  552   1HG1  VAL  67          3HG1      VAL  67 -12.174  -6.428  -6.428
  553   2HG1  VAL  67          2HG1      VAL  67 -13.531  -5.702  -5.702
  554   3HG1  VAL  67          1HG1      VAL  67 -13.345  -7.455  -7.455
  555   1HG2  VAL  67          2HG2      VAL  67 -13.377  -4.967  -4.967
  556   2HG2  VAL  67          1HG2      VAL  67 -15.132  -5.093  -5.093
  557   3HG2  VAL  67          3HG2      VAL  67 -14.192  -4.482  -4.482
  558    H    GLY  68           H        GLY  68 -12.237  -9.837  -9.837
  559   1HA   GLY  68          2HA       GLY  68 -13.659 -11.709 -11.709
  560   2HA   GLY  68          1HA       GLY  68 -14.807 -11.331 -11.331
  561    H    GLU  69           H        GLU  69 -12.779 -10.884 -10.884
  562    HA   GLU  69           HA       GLU  69 -11.956 -13.735 -13.735
  563   1HB   GLU  69          2HB       GLU  69 -12.893 -11.583 -11.583
  564   2HB   GLU  69          1HB       GLU  69 -11.830 -12.847 -12.847
  565   1HG   GLU  69          2HG       GLU  69 -14.303 -13.508 -13.508
  566   2HG   GLU  69          1HG       GLU  69 -14.369 -13.277 -13.277
  567    H    GLU  70           H        GLU  70  -9.876 -14.121 -14.121
  568    HA   GLU  70           HA       GLU  70  -7.840 -12.176 -12.176
  569   1HB   GLU  70          2HB       GLU  70  -7.448 -14.825 -14.825
  570   2HB   GLU  70          1HB       GLU  70  -6.236 -13.916 -13.916
  571   1HG   GLU  70          2HG       GLU  70  -7.398 -14.293 -14.293
  572   2HG   GLU  70          1HG       GLU  70  -8.778 -14.999 -14.999
  573    H    PHE  71           H        PHE  71  -5.984 -11.750 -11.750
  574    HA   PHE  71           HA       PHE  71  -6.700 -11.761 -11.761
  575   1HB   PHE  71          2HB       PHE  71  -6.630  -9.263  -9.263
  576   2HB   PHE  71          1HB       PHE  71  -8.027  -9.850  -9.850
  577    HD1  PHE  71           HD2      PHE  71  -7.871  -9.921  -9.921
  578    HD2  PHE  71           HD1      PHE  71  -5.104  -7.762  -7.762
  579    HE1  PHE  71           HE2      PHE  71  -7.175  -8.565  -8.565
  580    HE2  PHE  71           HE1      PHE  71  -4.407  -6.406  -6.406
  581    HZ   PHE  71           HZ       PHE  71  -5.441  -6.805  -6.805
  582    H    GLU  72           H        GLU  72  -5.000 -10.379 -10.379
  583    HA   GLU  72           HA       GLU  72  -2.372 -10.816 -10.816
  584   1HB   GLU  72          2HB       GLU  72  -2.625 -10.256 -10.256
  585   2HB   GLU  72          1HB       GLU  72  -1.365 -11.132 -11.132
  586   1HG   GLU  72          2HG       GLU  72  -2.993 -12.954 -12.954
  587   2HG   GLU  72          1HG       GLU  72  -4.196 -12.104 -12.104
  588    H    GLU  73           H        GLU  73  -0.932  -9.081  -9.081
  589    HA   GLU  73           HA       GLU  73  -1.493  -6.520  -6.520
  590   1HB   GLU  73          2HB       GLU  73  -1.725  -5.284  -5.284
  591   2HB   GLU  73          1HB       GLU  73  -3.090  -6.348  -6.348
  592   1HG   GLU  73          2HG       GLU  73  -2.609  -7.737  -7.737
  593   2HG   GLU  73          1HG       GLU  73  -0.868  -7.610  -7.610
  594    H    GLN  74           H        GLN  74   0.050  -4.820  -4.820
  595    HA   GLN  74           HA       GLN  74   2.709  -6.191  -6.191
  596   1HB   GLN  74          2HB       GLN  74   1.785  -3.410  -3.410
  597   2HB   GLN  74          1HB       GLN  74   3.424  -3.629  -3.629
  598   1HG   GLN  74          2HG       GLN  74   3.381  -5.611  -5.611
  599   2HG   GLN  74          1HG       GLN  74   2.241  -4.499  -4.499
  600   1HE2  GLN  74          2HE2      GLN  74   6.190  -3.632  -3.632
  601   2HE2  GLN  74          1HE2      GLN  74   5.599  -5.089  -5.089
  602    H    THR  75           H        THR  75   4.225  -5.589  -5.589
  603    HA   THR  75           HA       THR  75   2.814  -5.076  -5.076
  604    HB   THR  75           HB       THR  75   4.380  -7.043  -7.043
  605    HG1  THR  75           HG1      THR  75   5.299  -6.756  -6.756
  606   1HG2  THR  75          3HG2      THR  75   6.162  -4.978  -4.978
  607   2HG2  THR  75          2HG2      THR  75   6.815  -5.697  -5.697
  608   3HG2  THR  75          1HG2      THR  75   6.461  -6.713  -6.713
  609    H    VAL  76           H        VAL  76   5.554  -4.061  -4.061
  610    HA   VAL  76           HA       VAL  76   5.167  -1.264  -1.264
  611    HB   VAL  76           HB       VAL  76   6.342  -2.220  -2.220
  612   1HG1  VAL  76          2HG1      VAL  76   5.801   0.442   0.442
  613   2HG1  VAL  76          1HG1      VAL  76   5.559   0.278   0.278
  614   3HG1  VAL  76          3HG1      VAL  76   7.140  -0.060  -0.060
  615   1HG2  VAL  76          3HG2      VAL  76   3.547  -1.507  -1.507
  616   2HG2  VAL  76          2HG2      VAL  76   4.090  -2.834  -2.834
  617   3HG2  VAL  76          1HG2      VAL  76   4.071  -1.186  -1.186
  618    H    ASP  77           H        ASP  77   7.486  -3.840  -3.840
  619    HA   ASP  77           HA       ASP  77   9.785  -2.041  -2.041
  620   1HB   ASP  77          2HB       ASP  77   9.577  -4.459  -4.459
  621   2HB   ASP  77          1HB       ASP  77  10.088  -4.959  -4.959
  622    H    GLY  78           H        GLY  78   7.945  -4.398  -4.398
  623   1HA   GLY  78          2HA       GLY  78   7.676  -3.511  -3.511
  624   2HA   GLY  78          1HA       GLY  78   9.436  -3.586  -3.586
  625    H    ARG  79           H        ARG  79   7.084  -5.853  -5.853
  626    HA   ARG  79           HA       ARG  79   8.048  -7.938  -7.938
  627   1HB   ARG  79          2HB       ARG  79   8.019  -7.907  -7.907
  628   2HB   ARG  79          1HB       ARG  79   7.681  -9.425  -9.425
  629   1HG   ARG  79          2HG       ARG  79  10.066  -7.741  -7.741
  630   2HG   ARG  79          1HG       ARG  79  10.148  -8.908  -8.908
  631   1HD   ARG  79          2HD       ARG  79   9.199  -9.641  -9.641
  632   2HD   ARG  79          1HD       ARG  79  10.882  -9.790  -9.790
  633    HE   ARG  79           HE       ARG  79   8.716 -11.197 -11.197
  634   1HH1  ARG  79          2HH1      ARG  79  11.997 -10.988 -10.988
  635   2HH1  ARG  79          1HH1      ARG  79  12.290 -12.668 -12.668
  636   1HH2  ARG  79          1HH2      ARG  79   8.946 -13.429 -13.429
  637   2HH2  ARG  79          2HH2      ARG  79  10.562 -14.050 -14.050
  638    HA   PRO  80           HA       PRO  80   3.696  -8.720  -8.720
  639   1HB   PRO  80          2HB       PRO  80   3.763 -11.293 -11.293
  640   2HB   PRO  80          1HB       PRO  80   4.135  -9.862  -9.862
  641   1HG   PRO  80          2HG       PRO  80   5.992 -11.907 -11.907
  642   2HG   PRO  80          1HG       PRO  80   6.191 -10.864 -10.864
  643   1HD   PRO  80          2HD       PRO  80   7.379 -10.468 -10.468
  644   2HD   PRO  80          1HD       PRO  80   7.322  -9.288  -9.288
  645    H    CYS  81           H        CYS  81   2.077  -9.596  -9.596
  646    HA   CYS  81           HA       CYS  81   2.472 -12.013 -12.013
  647   1HB   CYS  81          2HB       CYS  81   2.079 -10.825 -10.825
  648   2HB   CYS  81          1HB       CYS  81   3.655 -10.499 -10.499
  649    HG   CYS  81           HG       CYS  81   1.318  -8.467  -8.467
  650    H    LYS  82           H        LYS  82   0.479 -12.840 -12.840
  651    HA   LYS  82           HA       LYS  82  -1.904 -11.468 -11.468
  652   1HB   LYS  82          2HB       LYS  82  -1.710 -13.848 -13.848
  653   2HB   LYS  82          1HB       LYS  82  -1.500 -14.210 -14.210
  654   1HG   LYS  82          2HG       LYS  82  -3.722 -14.527 -14.527
  655   2HG   LYS  82          1HG       LYS  82  -3.905 -12.790 -12.790
  656   1HD   LYS  82          2HD       LYS  82  -5.103 -13.380 -13.380
  657   2HD   LYS  82          1HD       LYS  82  -3.514 -13.572 -13.572
  658   1HE   LYS  82          2HE       LYS  82  -3.562 -15.980 -15.980
  659   2HE   LYS  82          1HE       LYS  82  -5.267 -15.716 -15.716
  660   1HZ   LYS  82          1HZ       LYS  82  -5.569 -15.049 -15.049
  661   2HZ   LYS  82          3HZ       LYS  82  -3.958 -15.481 -15.481
  662   3HZ   LYS  82          2HZ       LYS  82  -5.075 -16.666 -16.666
  663    H    SER  83           H        SER  83  -2.925 -10.078 -10.078
  664    HA   SER  83           HA       SER  83  -2.581 -10.318 -10.318
  665   1HB   SER  83          2HB       SER  83  -2.075  -8.126  -8.126
  666   2HB   SER  83          1HB       SER  83  -3.358  -8.103  -8.103
  667    HG   SER  83           HG       SER  83  -3.749  -6.893  -6.893
  668    H    LEU  84           H        LEU  84  -4.580  -9.777  -9.777
  669    HA   LEU  84           HA       LEU  84  -7.163 -10.372 -10.372
  670   1HB   LEU  84          2HB       LEU  84  -6.374 -12.627 -12.627
  671   2HB   LEU  84          1HB       LEU  84  -6.061 -12.074 -12.074
  672    HG   LEU  84           HG       LEU  84  -8.460 -11.586 -11.586
  673   1HD1  LEU  84          1HD1      LEU  84  -8.939 -11.130 -11.130
  674   2HD1  LEU  84          3HD1      LEU  84  -8.826 -12.860 -12.860
  675   3HD1  LEU  84          2HD1      LEU  84 -10.093 -12.227 -12.227
  676   1HD2  LEU  84          2HD2      LEU  84  -7.506 -14.303 -14.303
  677   2HD2  LEU  84          1HD2      LEU  84  -8.039 -13.721 -13.721
  678   3HD2  LEU  84          3HD2      LEU  84  -9.225 -14.082 -14.082
  679    H    VAL  85           H        VAL  85  -8.923  -9.598  -9.598
  680    HA   VAL  85           HA       VAL  85  -8.045  -8.179  -8.179
  681    HB   VAL  85           HB       VAL  85  -9.732  -6.829  -6.829
  682   1HG1  VAL  85          2HG1      VAL  85  -9.707  -6.159  -6.159
  683   2HG1  VAL  85          1HG1      VAL  85  -8.084  -5.554  -5.554
  684   3HG1  VAL  85          3HG1      VAL  85  -9.468  -4.889  -4.889
  685   1HG2  VAL  85          1HG2      VAL  85  -6.770  -7.039  -7.039
  686   2HG2  VAL  85          3HG2      VAL  85  -7.742  -6.868  -6.868
  687   3HG2  VAL  85          2HG2      VAL  85  -7.431  -5.466  -5.466
  688    H    LYS  86           H        LYS  86  -9.430  -8.473  -8.473
  689    HA   LYS  86           HA       LYS  86 -12.288  -9.062  -9.062
  690   1HB   LYS  86          2HB       LYS  86 -12.094 -10.007 -10.007
  691   2HB   LYS  86          1HB       LYS  86 -11.800 -11.027 -11.027
  692   1HG   LYS  86          2HG       LYS  86  -9.339 -10.407 -10.407
  693   2HG   LYS  86          1HG       LYS  86  -9.745  -9.663  -9.663
  694   1HD   LYS  86          2HD       LYS  86 -10.529 -11.772 -11.772
  695   2HD   LYS  86          1HD       LYS  86 -10.368 -12.545 -12.545
  696   1HE   LYS  86          2HE       LYS  86  -8.044 -12.599 -12.599
  697   2HE   LYS  86          1HE       LYS  86  -7.964 -11.240 -11.240
  698   1HZ   LYS  86          3HZ       LYS  86  -9.241 -13.762 -13.762
  699   2HZ   LYS  86          2HZ       LYS  86  -7.549 -13.615 -13.615
  700   3HZ   LYS  86          1HZ       LYS  86  -8.519 -12.564 -12.564
  701    H    TRP  87           H        TRP  87 -13.779  -8.060  -8.060
  702    HA   TRP  87           HA       TRP  87 -12.837  -5.398  -5.398
  703   1HB   TRP  87          2HB       TRP  87 -15.446  -6.887  -6.887
  704   2HB   TRP  87          1HB       TRP  87 -15.217  -5.334  -5.334
  705    HD1  TRP  87           HD1      TRP  87 -16.109  -6.884  -6.884
  706    HE1  TRP  87           HE1      TRP  87 -16.298  -5.104  -5.104
  707    HE3  TRP  87           HE3      TRP  87 -13.944  -2.946  -2.946
  708    HZ2  TRP  87           HZ2      TRP  87 -15.617  -2.348  -2.348
  709    HZ3  TRP  87           HZ3      TRP  87 -13.705  -0.756  -0.756
  710    HH2  TRP  87           HH2      TRP  87 -14.536  -0.460  -0.460
  711    H    GLU  88           H        GLU  88 -13.853  -4.717  -4.717
  712    HA   GLU  88           HA       GLU  88 -13.004  -6.619  -6.619
  713   1HB   GLU  88          2HB       GLU  88 -11.160  -4.950  -4.950
  714   2HB   GLU  88          1HB       GLU  88 -12.173  -3.715  -3.715
  715   1HG   GLU  88          2HG       GLU  88 -11.393  -6.187  -6.187
  716   2HG   GLU  88          1HG       GLU  88 -10.354  -4.763  -4.763
  717    H    SER  89           H        SER  89 -14.088  -3.358  -3.358
  718    HA   SER  89           HA       SER  89 -16.389  -3.661  -3.661
  719   1HB   SER  89          2HB       SER  89 -16.028  -1.377  -1.377
  720   2HB   SER  89          1HB       SER  89 -14.529  -2.274  -2.274
  721    HG   SER  89           HG       SER  89 -14.483  -0.104  -0.104
  722    H    GLU  90           H        GLU  90 -17.230  -0.903  -0.903
  723    HA   GLU  90           HA       GLU  90 -18.484  -1.593  -1.593
  724   1HB   GLU  90          2HB       GLU  90 -19.527   0.688   0.688
  725   2HB   GLU  90          1HB       GLU  90 -19.806  -0.362  -0.362
  726   1HG   GLU  90          2HG       GLU  90 -18.245   0.783   0.783
  727   2HG   GLU  90          1HG       GLU  90 -17.454   1.518   1.518
  728    H    ASN  91           H        ASN  91 -15.694   0.271   0.271
  729    HA   ASN  91           HA       ASN  91 -15.249   0.905   0.905
  730   1HB   ASN  91          2HB       ASN  91 -14.668   2.887   2.887
  731   2HB   ASN  91          1HB       ASN  91 -14.607   3.158   3.158
  732   1HD2  ASN  91          2HD2      ASN  91 -17.930   4.205   4.205
  733   2HD2  ASN  91          1HD2      ASN  91 -16.352   4.308   4.308
  734    H    LYS  92           H        LYS  92 -14.016  -1.052  -1.052
  735    HA   LYS  92           HA       LYS  92 -11.215  -0.165  -0.165
  736   1HB   LYS  92          2HB       LYS  92 -11.788   0.204   0.204
  737   2HB   LYS  92          1HB       LYS  92 -12.199  -1.504  -1.504
  738   1HG   LYS  92          2HG       LYS  92  -9.838  -2.001  -2.001
  739   2HG   LYS  92          1HG       LYS  92  -9.492  -0.292  -0.292
  740   1HD   LYS  92          2HD       LYS  92 -10.295  -0.584  -0.584
  741   2HD   LYS  92          1HD       LYS  92 -10.370  -2.319  -2.319
  742   1HE   LYS  92          2HE       LYS  92  -7.924  -2.136  -2.136
  743   2HE   LYS  92          1HE       LYS  92  -7.935  -0.530  -0.530
  744   1HZ   LYS  92          2HZ       LYS  92  -8.628  -3.058  -3.058
  745   2HZ   LYS  92          1HZ       LYS  92  -7.153  -2.227  -2.227
  746   3HZ   LYS  92          3HZ       LYS  92  -8.588  -1.509  -1.509
  747    H    MET  93           H        MET  93 -10.072  -1.753  -1.753
  748    HA   MET  93           HA       MET  93 -11.051  -4.550  -4.550
  749   1HB   MET  93          2HB       MET  93 -10.786  -4.917  -4.917
  750   2HB   MET  93          1HB       MET  93 -11.962  -3.647  -3.647
  751   1HG   MET  93          2HG       MET  93  -9.233  -2.616  -2.616
  752   2HG   MET  93          1HG       MET  93  -9.758  -3.469  -3.469
  753   1HE   MET  93          1HE       MET  93 -11.214  -2.917  -2.917
  754   2HE   MET  93          3HE       MET  93 -12.724  -2.938  -2.938
  755   3HE   MET  93          2HE       MET  93 -12.330  -1.559  -1.559
  756    H    VAL  94           H        VAL  94  -9.441  -6.148  -6.148
  757    HA   VAL  94           HA       VAL  94  -6.660  -5.128  -5.128
  758    HB   VAL  94           HB       VAL  94  -7.512  -7.976  -7.976
  759   1HG1  VAL  94          3HG1      VAL  94  -5.244  -6.193  -6.193
  760   2HG1  VAL  94          2HG1      VAL  94  -5.702  -7.388  -7.388
  761   3HG1  VAL  94          1HG1      VAL  94  -5.241  -7.904  -7.904
  762   1HG2  VAL  94          1HG2      VAL  94  -8.133  -5.574  -5.574
  763   2HG2  VAL  94          3HG2      VAL  94  -9.050  -7.068  -7.068
  764   3HG2  VAL  94          2HG2      VAL  94  -7.618  -7.040  -7.040
  765    H    CYS  95           H        CYS  95  -4.969  -6.743  -6.743
  766    HA   CYS  95           HA       CYS  95  -5.994  -7.980  -7.980
  767   1HB   CYS  95          2HB       CYS  95  -5.462  -5.610  -5.610
  768   2HB   CYS  95          1HB       CYS  95  -3.813  -5.877  -5.877
  769    HG   CYS  95           HG       CYS  95  -3.758  -7.831  -7.831
  770    H    GLU  96           H        GLU  96  -4.890  -9.786  -9.786
  771    HA   GLU  96           HA       GLU  96  -2.312 -10.313 -10.313
  772   1HB   GLU  96          2HB       GLU  96  -2.777 -12.723 -12.723
  773   2HB   GLU  96          1HB       GLU  96  -3.991 -12.014 -12.014
  774   1HG   GLU  96          2HG       GLU  96  -5.592 -11.876 -11.876
  775   2HG   GLU  96          1HG       GLU  96  -4.379 -11.931 -11.931
  776    H    GLN  97           H        GLN  97  -0.550 -11.193 -11.193
  777    HA   GLN  97           HA       GLN  97  -1.012 -11.045 -11.045
  778   1HB   GLN  97          2HB       GLN  97  -0.408  -8.745  -8.745
  779   2HB   GLN  97          1HB       GLN  97   1.221  -9.412  -9.412
  780   1HG   GLN  97          2HG       GLN  97   0.737 -10.015 -10.015
  781   2HG   GLN  97          1HG       GLN  97  -0.534  -8.804  -8.804
  782   1HE2  GLN  97          2HE2      GLN  97   1.704  -6.051  -6.051
  783   2HE2  GLN  97          1HE2      GLN  97   0.102  -6.562  -6.562
  784    H    LYS  98           H        LYS  98   0.372 -12.271 -12.271
  785    HA   LYS  98           HA       LYS  98   2.874 -13.286 -13.286
  786   1HB   LYS  98          2HB       LYS  98   2.287 -15.622 -15.622
  787   2HB   LYS  98          1HB       LYS  98   1.192 -14.983 -14.983
  788   1HG   LYS  98          2HG       LYS  98  -0.350 -14.307 -14.307
  789   2HG   LYS  98          1HG       LYS  98   0.671 -15.298 -15.298
  790   1HD   LYS  98          2HD       LYS  98   0.072 -17.286 -17.286
  791   2HD   LYS  98          1HD       LYS  98  -0.423 -16.451 -16.451
  792   1HE   LYS  98          2HE       LYS  98  -1.867 -16.243 -16.243
  793   2HE   LYS  98          1HE       LYS  98  -2.366 -17.287 -17.287
  794   1HZ   LYS  98          1HZ       LYS  98  -2.278 -15.127 -15.127
  795   2HZ   LYS  98          3HZ       LYS  98  -2.350 -14.343 -14.343
  796   3HZ   LYS  98          2HZ       LYS  98  -3.605 -15.386 -15.386
  797    H    LEU  99           H        LEU  99   4.424 -13.878 -13.878
  798    HA   LEU  99           HA       LEU  99   4.256 -12.436 -12.436
  799   1HB   LEU  99          2HB       LEU  99   5.891 -14.856 -14.856
  800   2HB   LEU  99          1HB       LEU  99   6.106 -13.985 -13.985
  801    HG   LEU  99           HG       LEU  99   6.087 -12.358 -12.358
  802   1HD1  LEU  99          1HD1      LEU  99   8.105 -14.460 -14.460
  803   2HD1  LEU  99          3HD1      LEU  99   8.688 -12.925 -12.925
  804   3HD1  LEU  99          2HD1      LEU  99   7.559 -13.903 -13.903
  805   1HD2  LEU  99          3HD2      LEU  99   7.434 -12.382 -12.382
  806   2HD2  LEU  99          2HD2      LEU  99   6.439 -11.120 -11.120
  807   3HD2  LEU  99          1HD2      LEU  99   8.083 -11.389 -11.389
  808    H    LEU 100           H        LEU 100   4.387 -13.447 -13.447
  809    HA   LEU 100           HA       LEU 100   2.194 -15.398 -15.398
  810   1HB   LEU 100          2HB       LEU 100   3.635 -13.493 -13.493
  811   2HB   LEU 100          1HB       LEU 100   2.632 -14.797 -14.797
  812    HG   LEU 100           HG       LEU 100   1.670 -12.749 -12.749
  813   1HD1  LEU 100          2HD1      LEU 100   1.791 -12.746 -12.746
  814   2HD1  LEU 100          1HD1      LEU 100   0.271 -12.217 -12.217
  815   3HD1  LEU 100          3HD1      LEU 100   1.774 -11.390 -11.390
  816   1HD2  LEU 100          3HD2      LEU 100   0.483 -15.113 -15.113
  817   2HD2  LEU 100          2HD2      LEU 100   0.217 -14.535 -14.535
  818   3HD2  LEU 100          1HD2      LEU 100  -0.554 -13.715 -13.715
  819    H    LYS 101           H        LYS 101   5.600 -15.326 -15.326
  820    HA   LYS 101           HA       LYS 101   5.769 -18.119 -18.119
  821   1HB   LYS 101          2HB       LYS 101   7.589 -17.680 -17.680
  822   2HB   LYS 101          1HB       LYS 101   6.029 -17.038 -17.038
  823   1HG   LYS 101          2HG       LYS 101   6.701 -14.859 -14.859
  824   2HG   LYS 101          1HG       LYS 101   7.729 -15.204 -15.204
  825   1HD   LYS 101          2HD       LYS 101   9.424 -14.919 -14.919
  826   2HD   LYS 101          1HD       LYS 101   9.050 -16.585 -16.585
  827   1HE   LYS 101          2HE       LYS 101   7.216 -15.260 -15.260
  828   2HE   LYS 101          1HE       LYS 101   8.520 -14.072 -14.072
  829   1HZ   LYS 101          3HZ       LYS 101   9.117 -16.900 -16.900
  830   2HZ   LYS 101          2HZ       LYS 101   8.517 -15.903 -15.903
  831   3HZ   LYS 101          1HZ       LYS 101   9.976 -15.512 -15.512
  832    H    GLY 102           H        GLY 102   7.939 -19.010 -19.010
  833   1HA   GLY 102          2HA       GLY 102   9.744 -19.227 -19.227
  834   2HA   GLY 102          1HA       GLY 102   9.970 -17.486 -17.486
  835    H    GLU 103           H        GLU 103  10.473 -17.558 -17.558
  836    HA   GLU 103           HA       GLU 103   8.255 -16.691 -16.691
  837   1HB   GLU 103          2HB       GLU 103   7.753 -19.152 -19.152
  838   2HB   GLU 103          1HB       GLU 103   9.284 -19.438 -19.438
  839   1HG   GLU 103          2HG       GLU 103   8.576 -18.248 -18.248
  840   2HG   GLU 103          1HG       GLU 103   7.183 -17.570 -17.570
  841    H    GLY 104           H        GLY 104   9.006 -15.615 -15.615
  842   1HA   GLY 104          2HA       GLY 104  11.520 -16.270 -16.270
  843   2HA   GLY 104          1HA       GLY 104  11.617 -14.797 -14.797
  844    HA   PRO 105           HA       PRO 105   9.694 -12.746 -12.746
  845   1HB   PRO 105          2HB       PRO 105   8.877 -10.450 -10.450
  846   2HB   PRO 105          1HB       PRO 105  10.570 -10.787 -10.787
  847   1HG   PRO 105          2HG       PRO 105   9.242 -10.803 -10.803
  848   2HG   PRO 105          1HG       PRO 105  10.961 -10.637 -10.637
  849   1HD   PRO 105          2HD       PRO 105   9.615 -13.002 -13.002
  850   2HD   PRO 105          1HD       PRO 105  11.311 -12.861 -12.861
  851    H    LYS 106           H        LYS 106   7.511 -11.340 -11.340
  852    HA   LYS 106           HA       LYS 106   5.266 -12.508 -12.508
  853   1HB   LYS 106          2HB       LYS 106   5.516 -13.932 -13.932
  854   2HB   LYS 106          1HB       LYS 106   5.534 -12.508 -12.508
  855   1HG   LYS 106          2HG       LYS 106   3.268 -12.010 -12.010
  856   2HG   LYS 106          1HG       LYS 106   3.224 -13.092 -13.092
  857   1HD   LYS 106          2HD       LYS 106   3.527 -15.033 -15.033
  858   2HD   LYS 106          1HD       LYS 106   3.536 -13.944 -13.944
  859   1HE   LYS 106          2HE       LYS 106   1.239 -14.045 -14.045
  860   2HE   LYS 106          1HE       LYS 106   1.297 -15.059 -15.059
  861   1HZ   LYS 106          2HZ       LYS 106   1.576 -12.107 -12.107
  862   2HZ   LYS 106          1HZ       LYS 106   0.094 -12.911 -12.911
  863   3HZ   LYS 106          3HZ       LYS 106   1.354 -13.155 -13.155
  864    H    THR 107           H        THR 107   3.604 -10.973 -10.973
  865    HA   THR 107           HA       THR 107   3.979  -8.388  -8.388
  866    HB   THR 107           HB       THR 107   2.694  -7.656  -7.656
  867    HG1  THR 107           HG1      THR 107   3.143  -9.867  -9.867
  868   1HG2  THR 107          3HG2      THR 107   4.790  -6.766  -6.766
  869   2HG2  THR 107          2HG2      THR 107   5.695  -7.822  -7.822
  870   3HG2  THR 107          1HG2      THR 107   4.691  -6.531  -6.531
  871    H    SER 108           H        SER 108   2.173  -7.304  -7.304
  872    HA   SER 108           HA       SER 108  -0.539  -8.139  -8.139
  873   1HB   SER 108          2HB       SER 108   0.348  -8.496  -8.496
  874   2HB   SER 108          1HB       SER 108  -1.203  -8.938  -8.938
  875    HG   SER 108           HG       SER 108  -0.281 -10.801 -10.801
  876    H    TRP 109           H        TRP 109  -1.777  -6.248  -6.248
  877    HA   TRP 109           HA       TRP 109  -0.815  -4.203  -4.203
  878   1HB   TRP 109          2HB       TRP 109  -1.307  -2.433  -2.433
  879   2HB   TRP 109          1HB       TRP 109   0.116  -3.420  -3.420
  880    HD1  TRP 109           HD1      TRP 109   0.100  -4.998  -4.998
  881    HE1  TRP 109           HE1      TRP 109  -1.511  -5.287  -5.287
  882    HE3  TRP 109           HE3      TRP 109  -3.904  -2.325  -2.325
  883    HZ2  TRP 109           HZ2      TRP 109  -4.149  -4.492  -4.492
  884    HZ3  TRP 109           HZ3      TRP 109  -5.948  -2.108  -2.108
  885    HH2  TRP 109           HH2      TRP 109  -6.077  -3.187  -3.187
  886    H    THR 110           H        THR 110  -2.461  -2.382  -2.382
  887    HA   THR 110           HA       THR 110  -5.247  -3.426  -3.426
  888    HB   THR 110           HB       THR 110  -5.842  -2.875  -2.875
  889    HG1  THR 110           HG1      THR 110  -4.624  -1.592  -1.592
  890   1HG2  THR 110          2HG2      THR 110  -3.899  -4.761  -4.761
  891   2HG2  THR 110          1HG2      THR 110  -3.165  -3.794  -3.794
  892   3HG2  THR 110          3HG2      THR 110  -4.738  -4.548  -4.548
  893    H    MET 111           H        MET 111  -6.828  -1.543  -1.543
  894    HA   MET 111           HA       MET 111  -5.858   1.172   1.172
  895   1HB   MET 111          2HB       MET 111  -7.322   1.461   1.461
  896   2HB   MET 111          1HB       MET 111  -5.880   0.481   0.481
  897   1HG   MET 111          2HG       MET 111  -7.135  -1.552  -1.552
  898   2HG   MET 111          1HG       MET 111  -8.572  -0.728  -0.728
  899   1HE   MET 111          2HE       MET 111  -8.012  -2.689  -2.689
  900   2HE   MET 111          1HE       MET 111  -9.337  -2.287  -2.287
  901   3HE   MET 111          3HE       MET 111  -7.664  -2.185  -2.185
  902    H    GLU 112           H        GLU 112  -7.136   2.453   2.453
  903    HA   GLU 112           HA       GLU 112  -9.929   1.525   1.525
  904   1HB   GLU 112          2HB       GLU 112  -8.434   1.375   1.375
  905   2HB   GLU 112          1HB       GLU 112  -8.093   3.098   3.098
  906   1HG   GLU 112          2HG       GLU 112 -10.415   3.658   3.658
  907   2HG   GLU 112          1HG       GLU 112 -10.876   1.957   1.957
  908    H    LEU 113           H        LEU 113 -11.554   3.114   3.114
  909    HA   LEU 113           HA       LEU 113 -10.740   5.742   5.742
  910   1HB   LEU 113          2HB       LEU 113 -12.559   3.883   3.883
  911   2HB   LEU 113          1HB       LEU 113 -13.598   4.951   4.951
  912    HG   LEU 113           HG       LEU 113 -13.389   5.544   5.544
  913   1HD1  LEU 113          3HD1      LEU 113 -13.131   7.289   7.289
  914   2HD1  LEU 113          2HD1      LEU 113 -12.377   8.011   8.011
  915   3HD1  LEU 113          1HD1      LEU 113 -14.064   7.512   7.512
  916   1HD2  LEU 113          2HD2      LEU 113 -10.627   5.231   5.231
  917   2HD2  LEU 113          1HD2      LEU 113 -11.381   5.732   5.732
  918   3HD2  LEU 113          3HD2      LEU 113 -10.873   6.943   6.943
  919    H    THR 114           H        THR 114 -11.503   7.635   7.635
  920    HA   THR 114           HA       THR 114 -12.427   7.128   7.128
  921    HB   THR 114           HB       THR 114 -11.784   9.367   9.367
  922    HG1  THR 114           HG1      THR 114 -11.515  10.895  10.895
  923   1HG2  THR 114          1HG2      THR 114  -9.854   8.222   8.222
  924   2HG2  THR 114          3HG2      THR 114  -9.460   9.491   9.491
  925   3HG2  THR 114          2HG2      THR 114  -9.876   7.874   7.874
  926    H    ASN 115           H        ASN 115 -14.202   8.467   8.467
  927    HA   ASN 115           HA       ASN 115 -16.584   8.262   8.262
  928   1HB   ASN 115          2HB       ASN 115 -16.014   9.991   9.991
  929   2HB   ASN 115          1HB       ASN 115 -17.621   9.613   9.613
  930   1HD2  ASN 115          2HD2      ASN 115 -17.497   6.920   6.920
  931   2HD2  ASN 115          1HD2      ASN 115 -18.148   8.456   8.456
  932    H    ASP 116           H        ASP 116 -14.182  10.784  10.784
  933    HA   ASP 116           HA       ASP 116 -15.951  12.827  12.827
  934   1HB   ASP 116          2HB       ASP 116 -12.974  12.721  12.721
  935   2HB   ASP 116          1HB       ASP 116 -13.760  14.105  14.105
  936    H    GLY 117           H        GLY 117 -13.632  10.439  10.439
  937   1HA   GLY 117          2HA       GLY 117 -14.153   9.723   9.723
  938   2HA   GLY 117          1HA       GLY 117 -14.014  11.433  11.433
  939    H    GLU 118           H        GLU 118 -11.729  11.203  11.203
  940    HA   GLU 118           HA       GLU 118  -9.509  11.347  11.347
  941   1HB   GLU 118          2HB       GLU 118  -9.604  10.506  10.506
  942   2HB   GLU 118          1HB       GLU 118  -8.134  10.936  10.936
  943   1HG   GLU 118          2HG       GLU 118  -8.768  13.187  13.187
  944   2HG   GLU 118          1HG       GLU 118 -10.472  12.831  12.831
  945    H    LEU 119           H        LEU 119  -7.612   9.692   9.692
  946    HA   LEU 119           HA       LEU 119  -8.587   6.889   6.889
  947   1HB   LEU 119          2HB       LEU 119  -8.951   7.769   7.769
  948   2HB   LEU 119          1HB       LEU 119  -7.213   8.007   8.007
  949    HG   LEU 119           HG       LEU 119  -8.421   5.318   5.318
  950   1HD1  LEU 119          1HD1      LEU 119  -8.093   6.711   6.711
  951   2HD1  LEU 119          3HD1      LEU 119  -7.867   4.964   4.964
  952   3HD1  LEU 119          2HD1      LEU 119  -9.409   5.679   5.679
  953   1HD2  LEU 119          1HD2      LEU 119  -5.738   6.392   6.392
  954   2HD2  LEU 119          3HD2      LEU 119  -6.127   5.160   5.160
  955   3HD2  LEU 119          2HD2      LEU 119  -6.180   4.766   4.766
  956    H    ILE 120           H        ILE 120  -7.142   6.045   6.045
  957    HA   ILE 120           HA       ILE 120  -4.257   6.789   6.789
  958    HB   ILE 120           HB       ILE 120  -5.100   7.233   7.233
  959   1HG1  ILE 120          2HG1      ILE 120  -3.510   4.664   4.664
  960   2HG1  ILE 120          1HG1      ILE 120  -2.789   6.186   6.186
  961   1HG2  ILE 120          1HG2      ILE 120  -6.101   4.402   4.402
  962   2HG2  ILE 120          3HG2      ILE 120  -5.804   5.114   5.114
  963   3HG2  ILE 120          2HG2      ILE 120  -6.983   5.846   5.846
  964   1HD1  ILE 120          1HD1      ILE 120  -3.878   7.135   7.135
  965   2HD1  ILE 120          3HD1      ILE 120  -3.883   5.444   5.444
  966   3HD1  ILE 120          2HD1      ILE 120  -2.361   6.240   6.240
  967    H    LEU 121           H        LEU 121  -2.738   5.073   5.073
  968    HA   LEU 121           HA       LEU 121  -3.993   2.395   2.395
  969   1HB   LEU 121          2HB       LEU 121  -3.517   3.535   3.535
  970   2HB   LEU 121          1HB       LEU 121  -1.834   3.729   3.729
  971    HG   LEU 121           HG       LEU 121  -2.659   0.947   0.947
  972   1HD1  LEU 121          1HD1      LEU 121  -3.208   2.359   2.359
  973   2HD1  LEU 121          3HD1      LEU 121  -2.704   0.668   0.668
  974   3HD1  LEU 121          2HD1      LEU 121  -4.187   1.152   1.152
  975   1HD2  LEU 121          3HD2      LEU 121  -0.330   2.053   2.053
  976   2HD2  LEU 121          2HD2      LEU 121  -0.615   0.547   0.547
  977   3HD2  LEU 121          1HD2      LEU 121  -0.679   2.088   2.088
  978    H    THR 122           H        THR 122  -2.800   0.657   0.657
  979    HA   THR 122           HA       THR 122  -0.181   1.275   1.275
  980    HB   THR 122           HB       THR 122  -1.352  -1.126  -1.126
  981    HG1  THR 122           HG1      THR 122  -3.200  -0.245  -0.245
  982   1HG2  THR 122          1HG2      THR 122  -0.605   1.603   1.603
  983   2HG2  THR 122          3HG2      THR 122  -1.224   0.331   0.331
  984   3HG2  THR 122          2HG2      THR 122   0.283   0.089   0.089
  985    H    MET 123           H        MET 123   1.146  -0.864  -0.864
  986    HA   MET 123           HA       MET 123   0.563  -2.706  -2.706
  987   1HB   MET 123          2HB       MET 123   3.096  -1.037  -1.037
  988   2HB   MET 123          1HB       MET 123   2.701  -2.269  -2.269
  989   1HG   MET 123          2HG       MET 123   0.627  -0.903  -0.903
  990   2HG   MET 123          1HG       MET 123   1.312   0.381   0.381
  991   1HE   MET 123          3HE       MET 123   1.842  -2.189  -2.189
  992   2HE   MET 123          2HE       MET 123   2.054  -1.279  -1.279
  993   3HE   MET 123          1HE       MET 123   3.465  -1.901  -1.901
  994    H    THR 124           H        THR 124   2.232  -4.438  -4.438
  995    HA   THR 124           HA       THR 124   3.843  -4.789  -4.789
  996    HB   THR 124           HB       THR 124   1.979  -6.981  -6.981
  997    HG1  THR 124           HG1      THR 124   0.447  -6.103  -6.103
  998   1HG2  THR 124          3HG2      THR 124   4.011  -7.531  -7.531
  999   2HG2  THR 124          2HG2      THR 124   3.451  -6.432  -6.432
 1000   3HG2  THR 124          1HG2      THR 124   2.519  -7.879  -7.879
 1001    H    ALA 125           H        ALA 125   5.471  -6.369  -6.369
 1002    HA   ALA 125           HA       ALA 125   5.721  -7.832  -7.832
 1003   1HB   ALA 125          2HB       ALA 125   7.553  -5.505  -5.505
 1004   2HB   ALA 125          1HB       ALA 125   7.904  -6.727  -6.727
 1005   3HB   ALA 125          3HB       ALA 125   6.500  -5.675  -5.675
 1006    H    ASP 126           H        ASP 126   6.029  -9.692  -9.692
 1007    HA   ASP 126           HA       ASP 126   7.339 -11.331 -11.331
 1008   1HB   ASP 126          2HB       ASP 126   9.277  -9.429  -9.429
 1009   2HB   ASP 126          1HB       ASP 126   9.618  -9.787  -9.787
 1010    H    ASP 127           H        ASP 127   8.503  -8.510  -8.510
 1011    HA   ASP 127           HA       ASP 127   6.593  -9.105  -9.105
 1012   1HB   ASP 127          2HB       ASP 127   8.976 -10.384 -10.384
 1013   2HB   ASP 127          1HB       ASP 127   9.403  -8.859  -8.859
 1014    H    VAL 128           H        VAL 128   7.339  -6.907  -6.907
 1015    HA   VAL 128           HA       VAL 128   7.755  -4.756  -4.756
 1016    HB   VAL 128           HB       VAL 128   8.790  -3.408  -3.408
 1017   1HG1  VAL 128          3HG1      VAL 128  10.035  -5.344  -5.344
 1018   2HG1  VAL 128          2HG1      VAL 128  10.134  -6.072  -6.072
 1019   3HG1  VAL 128          1HG1      VAL 128  10.850  -4.487  -4.487
 1020   1HG2  VAL 128          3HG2      VAL 128   7.706  -5.579  -5.579
 1021   2HG2  VAL 128          2HG2      VAL 128   7.970  -3.878  -3.878
 1022   3HG2  VAL 128          1HG2      VAL 128   9.317  -5.014  -5.014
 1023    H    VAL 129           H        VAL 129   6.816  -2.604  -2.604
 1024    HA   VAL 129           HA       VAL 129   4.429  -3.162  -3.162
 1025    HB   VAL 129           HB       VAL 129   4.335  -2.665  -2.665
 1026   1HG1  VAL 129          2HG1      VAL 129   2.552  -1.293  -1.293
 1027   2HG1  VAL 129          1HG1      VAL 129   1.812  -1.952  -1.952
 1028   3HG1  VAL 129          3HG1      VAL 129   3.092  -0.745  -0.745
 1029   1HG2  VAL 129          1HG2      VAL 129   3.000  -4.368  -4.368
 1030   2HG2  VAL 129          3HG2      VAL 129   3.646  -4.805  -4.805
 1031   3HG2  VAL 129          2HG2      VAL 129   2.091  -3.982  -3.982
 1032    H    CYS 130           H        CYS 130   4.425  -1.547  -1.547
 1033    HA   CYS 130           HA       CYS 130   5.556   1.098   1.098
 1034   1HB   CYS 130          2HB       CYS 130   6.228  -0.228  -0.228
 1035   2HB   CYS 130          1HB       CYS 130   4.693   0.363   0.363
 1036    HG   CYS 130           HG       CYS 130   5.635   2.654   2.654
 1037    H    THR 131           H        THR 131   4.204   2.859   2.859
 1038    HA   THR 131           HA       THR 131   1.365   2.524   2.524
 1039    HB   THR 131           HB       THR 131   2.450   3.888   3.888
 1040    HG1  THR 131           HG1      THR 131   1.642   2.163   2.163
 1041   1HG2  THR 131          3HG2      THR 131  -0.148   3.984   3.984
 1042   2HG2  THR 131          2HG2      THR 131  -0.257   3.583   3.583
 1043   3HG2  THR 131          1HG2      THR 131   0.530   5.077   5.077
 1044    H    ARG 132           H        ARG 132   0.739   4.120   4.120
 1045    HA   ARG 132           HA       ARG 132   2.206   6.719   6.719
 1046   1HB   ARG 132          2HB       ARG 132   1.115   5.204   5.204
 1047   2HB   ARG 132          1HB       ARG 132   1.736   6.853   6.853
 1048   1HG   ARG 132          2HG       ARG 132   3.768   5.500   5.500
 1049   2HG   ARG 132          1HG       ARG 132   3.201   4.307   4.307
 1050   1HD   ARG 132          2HD       ARG 132   3.641   7.131   7.131
 1051   2HD   ARG 132          1HD       ARG 132   5.037   6.075   6.075
 1052    HE   ARG 132           HE       ARG 132   2.869   5.690   5.690
 1053   1HH1  ARG 132          1HH2      ARG 132   3.794   3.066   3.066
 1054   2HH1  ARG 132          2HH2      ARG 132   5.093   2.651   2.651
 1055   1HH2  ARG 132          2HH1      ARG 132   5.410   5.855   5.855
 1056   2HH2  ARG 132          1HH1      ARG 132   6.007   4.230   4.230
 1057    H    VAL 133           H        VAL 133   0.687   7.909   7.909
 1058    HA   VAL 133           HA       VAL 133  -2.164   7.580   7.580
 1059    HB   VAL 133           HB       VAL 133  -0.616   9.973   9.973
 1060   1HG1  VAL 133          3HG1      VAL 133  -3.521   9.180   9.180
 1061   2HG1  VAL 133          2HG1      VAL 133  -2.838  10.222  10.222
 1062   3HG1  VAL 133          1HG1      VAL 133  -2.819  10.737  10.737
 1063   1HG2  VAL 133          3HG2      VAL 133  -1.421   7.360   7.360
 1064   2HG2  VAL 133          2HG2      VAL 133   0.007   8.343   8.343
 1065   3HG2  VAL 133          1HG2      VAL 133  -1.547   8.788   8.788
 1066    H    TYR 134           H        TYR 134  -3.497   8.391   8.391
 1067    HA   TYR 134           HA       TYR 134  -2.306  10.392  10.392
 1068   1HB   TYR 134          2HB       TYR 134  -4.037   7.984   7.984
 1069   2HB   TYR 134          1HB       TYR 134  -4.122   9.343   9.343
 1070    HD1  TYR 134           HD2      TYR 134  -2.153  10.021  10.021
 1071    HD2  TYR 134           HD1      TYR 134  -2.064   6.599   6.599
 1072    HE1  TYR 134           HE2      TYR 134  -0.105   9.212   9.212
 1073    HE2  TYR 134           HE1      TYR 134  -0.013   5.787   5.787
 1074    HH   TYR 134           HH       TYR 134   1.969   7.422   7.422
 1075    H    VAL 135           H        VAL 135  -3.451  12.244  12.244
 1076    HA   VAL 135           HA       VAL 135  -6.252  12.307  12.307
 1077    HB   VAL 135           HB       VAL 135  -4.052  13.921  13.921
 1078   1HG1  VAL 135          2HG1      VAL 135  -4.464  15.232  15.232
 1079   2HG1  VAL 135          1HG1      VAL 135  -6.063  15.625  15.625
 1080   3HG1  VAL 135          3HG1      VAL 135  -4.620  16.177  16.177
 1081   1HG2  VAL 135          2HG2      VAL 135  -7.039  14.137  14.137
 1082   2HG2  VAL 135          1HG2      VAL 135  -5.851  13.444  13.444
 1083   3HG2  VAL 135          3HG2      VAL 135  -5.901  15.188  15.188
 1084    H    ARG 136           H        ARG 136  -7.805  12.997  12.997
 1085    HA   ARG 136           HA       ARG 136  -7.340  12.704  12.704
 1086   1HB   ARG 136          2HB       ARG 136  -9.499  13.683  13.683
 1087   2HB   ARG 136          1HB       ARG 136  -9.369  14.654  14.654
 1088   1HG   ARG 136          2HG       ARG 136  -9.767  12.866  12.866
 1089   2HG   ARG 136          1HG       ARG 136  -9.179  11.681  11.681
 1090   1HD   ARG 136          2HD       ARG 136 -11.824  13.157  13.157
 1091   2HD   ARG 136          1HD       ARG 136 -11.567  11.419  11.419
 1092    HE   ARG 136           HE       ARG 136 -10.406  12.040  12.040
 1093   1HH1  ARG 136          2HH1      ARG 136 -13.355  11.060  11.060
 1094   2HH1  ARG 136          1HH1      ARG 136 -14.289  11.764  11.764
 1095   1HH2  ARG 136          1HH2      ARG 136 -11.648  13.632  13.632
 1096   2HH2  ARG 136          2HH2      ARG 136 -13.322  13.225  13.225
 1097    H    GLU 137           HN       GLU 137  -6.383  13.785  13.785
 1098    HA   GLU 137           HA       GLU 137  -4.739  15.998  15.998
 1099   1HB   GLU 137          2HB       GLU 137  -5.147  14.381  14.381
 1100   2HB   GLU 137          1HB       GLU 137  -6.333  15.573  15.573
 1101   1HG   GLU 137          2HG       GLU 137  -3.507  16.345  16.345
 1102   2HG   GLU 137          1HG       GLU 137  -3.950  15.812  15.812

  Start of MODEL   26
    1   1H    PRO   1          1H        PRO   1  16.459   7.514   7.514
    2   2H    PRO   1          2H        PRO   1  15.949   6.860   6.860
    3    HA   PRO   1           HA       PRO   1  16.232   4.804   4.804
    4   1HB   PRO   1          2HB       PRO   1  18.907   4.844   4.844
    5   2HB   PRO   1          1HB       PRO   1  18.347   4.188   4.188
    6   1HG   PRO   1          2HG       PRO   1  19.880   6.560   6.560
    7   2HG   PRO   1          1HG       PRO   1  19.303   5.909   5.909
    8   1HD   PRO   1          1HD       PRO   1  18.346   8.217   8.217
    9   2HD   PRO   1          2HD       PRO   1  17.796   7.581   7.581
   10    H    ASN   2           H        ASN   2  15.088   6.597   6.597
   11    HA   ASN   2           HA       ASN   2  15.693   5.182   5.182
   12   1HB   ASN   2          2HB       ASN   2  16.072   8.163   8.163
   13   2HB   ASN   2          1HB       ASN   2  15.817   7.425   7.425
   14   1HD2  ASN   2          2HD2      ASN   2  19.075   6.024   6.024
   15   2HD2  ASN   2          1HD2      ASN   2  17.525   6.058   6.058
   16    H    PHE   3           H        PHE   3  13.788   4.721   4.721
   17    HA   PHE   3           HA       PHE   3  11.364   6.211   6.211
   18   1HB   PHE   3          2HB       PHE   3  11.743   3.600   3.600
   19   2HB   PHE   3          1HB       PHE   3  10.184   4.306   4.306
   20    HD1  PHE   3           HD1      PHE   3  13.393   3.514   3.514
   21    HD2  PHE   3           HD2      PHE   3   9.096   3.403   3.403
   22    HE1  PHE   3           HE1      PHE   3  13.429   2.393   2.393
   23    HE2  PHE   3           HE2      PHE   3   9.142   2.276   2.276
   24    HZ   PHE   3           HZ       PHE   3  11.307   1.765   1.765
   25    H    SER   4           H        SER   4  13.614   6.222   6.222
   26    HA   SER   4           HA       SER   4  11.854   6.489   6.489
   27   1HB   SER   4          2HB       SER   4  13.821   7.120   7.120
   28   2HB   SER   4          1HB       SER   4  14.289   5.860   5.860
   29    HG   SER   4           HG       SER   4  15.321   8.250   8.250
   30    H    GLY   5           H        GLY   5  10.550   8.132   8.132
   31   1HA   GLY   5          2HA       GLY   5  11.146  10.777  10.777
   32   2HA   GLY   5          1HA       GLY   5  10.788  10.726  10.726
   33    H    ASN   6           H        ASN   6   8.929  12.181  12.181
   34    HA   ASN   6           HA       ASN   6   6.718  10.460  10.460
   35   1HB   ASN   6          2HB       ASN   6   7.154  13.452  13.452
   36   2HB   ASN   6          1HB       ASN   6   5.533  12.783  12.783
   37   1HD2  ASN   6          2HD2      ASN   6   6.497  11.201  11.201
   38   2HD2  ASN   6          1HD2      ASN   6   5.812  10.703  10.703
   39    H    TRP   7           H        TRP   7   4.551  11.047  11.047
   40    HA   TRP   7           HA       TRP   7   5.077  11.599  11.599
   41   1HB   TRP   7          2HB       TRP   7   4.053   8.962   8.962
   42   2HB   TRP   7          1HB       TRP   7   4.000   9.423   9.423
   43    HD1  TRP   7           HD1      TRP   7   6.283   8.050   8.050
   44    HE1  TRP   7           HE1      TRP   7   8.681   7.806   7.806
   45    HE3  TRP   7           HE3      TRP   7   5.730  10.634  10.634
   46    HZ2  TRP   7           HZ2      TRP   7  10.158   8.646   8.646
   47    HZ3  TRP   7           HZ3      TRP   7   7.636  10.936  10.936
   48    HH2  TRP   7           HH2      TRP   7   9.834   9.942   9.942
   49    H    LYS   8           H        LYS   8   3.496  12.784  12.784
   50    HA   LYS   8           HA       LYS   8   0.756  12.523  12.523
   51   1HB   LYS   8          2HB       LYS   8   2.290  14.947  14.947
   52   2HB   LYS   8          1HB       LYS   8   0.526  14.943  14.943
   53   1HG   LYS   8          2HG       LYS   8   0.535  14.302  14.302
   54   2HG   LYS   8          1HG       LYS   8   2.292  14.447  14.447
   55   1HD   LYS   8          2HD       LYS   8   1.741  16.577  16.577
   56   2HD   LYS   8          1HD       LYS   8   1.729  16.841  16.841
   57   1HE   LYS   8          2HE       LYS   8  -0.801  15.860  15.860
   58   2HE   LYS   8          1HE       LYS   8  -0.344  17.531  17.531
   59   1HZ   LYS   8          1HZ       LYS   8   0.071  17.600  17.600
   60   2HZ   LYS   8          3HZ       LYS   8  -0.964  16.257  16.257
   61   3HZ   LYS   8          2HZ       LYS   8  -1.515  17.736  17.736
   62    H    ILE   9           H        ILE   9  -0.480  11.497  11.497
   63    HA   ILE   9           HA       ILE   9   0.182  10.998  10.998
   64    HB   ILE   9           HB       ILE   9  -1.429   9.663   9.663
   65   1HG1  ILE   9          2HG1      ILE   9  -2.753  11.064  11.064
   66   2HG1  ILE   9          1HG1      ILE   9  -1.616   9.723   9.723
   67   1HG2  ILE   9          2HG2      ILE   9  -2.390  12.000  12.000
   68   2HG2  ILE   9          1HG2      ILE   9  -3.598  11.676  11.676
   69   3HG2  ILE   9          3HG2      ILE   9  -3.310  10.497  10.497
   70   1HD1  ILE   9          3HD1      ILE   9  -3.232   8.427   8.427
   71   2HD1  ILE   9          2HD1      ILE   9  -4.397   9.705   9.705
   72   3HD1  ILE   9          1HD1      ILE   9  -3.763   8.710   8.710
   73    H    ILE  10           H        ILE  10  -0.389  11.978  11.978
   74    HA   ILE  10           HA       ILE  10  -1.663  14.672  14.672
   75    HB   ILE  10           HB       ILE  10  -0.249  15.388  15.388
   76   1HG1  ILE  10          2HG1      ILE  10   1.777  13.533  13.533
   77   2HG1  ILE  10          1HG1      ILE  10   0.361  12.495  12.495
   78   1HG2  ILE  10          2HG2      ILE  10   1.303  14.095  14.095
   79   2HG2  ILE  10          1HG2      ILE  10   1.917  15.361  15.361
   80   3HG2  ILE  10          3HG2      ILE  10   0.576  15.701  15.701
   81   1HD1  ILE  10          1HD1      ILE  10  -0.713  14.048  14.048
   82   2HD1  ILE  10          3HD1      ILE  10   0.938  14.583  14.583
   83   3HD1  ILE  10          2HD1      ILE  10   0.501  12.889  12.889
   84    H    ARG  11           H        ARG  11  -1.592  11.600  11.600
   85    HA   ARG  11           HA       ARG  11  -4.075  12.371  12.371
   86   1HB   ARG  11          2HB       ARG  11  -1.460  11.946  11.946
   87   2HB   ARG  11          1HB       ARG  11  -2.821  11.098  11.098
   88   1HG   ARG  11          2HG       ARG  11  -3.948  13.535  13.535
   89   2HG   ARG  11          1HG       ARG  11  -2.270  14.008  14.008
   90   1HD   ARG  11          2HD       ARG  11  -2.447  12.335  12.335
   91   2HD   ARG  11          1HD       ARG  11  -4.175  12.645  12.645
   92    HE   ARG  11           HE       ARG  11  -2.653  15.110  15.110
   93   1HH1  ARG  11          1HH2      ARG  11  -2.443  12.763  12.763
   94   2HH1  ARG  11          2HH2      ARG  11  -3.249  13.631  13.631
   95   1HH2  ARG  11          2HH1      ARG  11  -4.358  16.167  16.167
   96   2HH2  ARG  11          1HH1      ARG  11  -4.334  15.558  15.558
   97    H    SER  12           H        SER  12  -4.833  10.347  10.347
   98    HA   SER  12           HA       SER  12  -4.045   7.704   7.704
   99   1HB   SER  12          2HB       SER  12  -4.611   8.033   8.033
  100   2HB   SER  12          1HB       SER  12  -6.073   8.924   8.924
  101    HG   SER  12           HG       SER  12  -6.761   6.904   6.904
  102    H    GLU  13           H        GLU  13  -5.913   6.138   6.138
  103    HA   GLU  13           HA       GLU  13  -8.166   7.371   7.371
  104   1HB   GLU  13          2HB       GLU  13  -7.515   6.396   6.396
  105   2HB   GLU  13          1HB       GLU  13  -6.398   7.644   7.644
  106   1HG   GLU  13          2HG       GLU  13  -5.386   5.275   5.275
  107   2HG   GLU  13          1HG       GLU  13  -5.897   4.820   4.820
  108    H    ASN  14           H        ASN  14  -7.623   5.271   5.271
  109    HA   ASN  14           HA       ASN  14  -9.543   3.290   3.290
  110   1HB   ASN  14          2HB       ASN  14  -6.673   2.613   2.613
  111   2HB   ASN  14          1HB       ASN  14  -7.936   1.396   1.396
  112   1HD2  ASN  14          2HD2      ASN  14  -6.373   2.142   2.142
  113   2HD2  ASN  14          1HD2      ASN  14  -5.616   2.415   2.415
  114    H    PHE  15           H        PHE  15  -9.148   5.252   5.252
  115    HA   PHE  15           HA       PHE  15  -8.621   3.795   3.795
  116   1HB   PHE  15          2HB       PHE  15  -8.789   6.333   6.333
  117   2HB   PHE  15          1HB       PHE  15 -10.530   6.127   6.127
  118    HD1  PHE  15           HD2      PHE  15  -9.786   3.591   3.591
  119    HD2  PHE  15           HD1      PHE  15  -9.473   7.866   7.866
  120    HE1  PHE  15           HE2      PHE  15  -9.862   3.677   3.677
  121    HE2  PHE  15           HE1      PHE  15  -9.539   7.938   7.938
  122    HZ   PHE  15           HZ       PHE  15  -9.733   5.824   5.824
  123    H    GLU  16           H        GLU  16 -11.826   4.906   4.906
  124    HA   GLU  16           HA       GLU  16 -13.363   3.242   3.242
  125   1HB   GLU  16          2HB       GLU  16 -14.113   4.068   4.068
  126   2HB   GLU  16          1HB       GLU  16 -15.214   3.662   3.662
  127   1HG   GLU  16          2HG       GLU  16 -13.878   5.613   5.613
  128   2HG   GLU  16          1HG       GLU  16 -13.600   6.140   6.140
  129    H    GLU  17           H        GLU  17 -11.787   2.558   2.558
  130    HA   GLU  17           HA       GLU  17 -13.101   0.142   0.142
  131   1HB   GLU  17          2HB       GLU  17 -10.283   1.090   1.090
  132   2HB   GLU  17          1HB       GLU  17 -11.020  -0.313  -0.313
  133   1HG   GLU  17          2HG       GLU  17 -12.971   1.483   1.483
  134   2HG   GLU  17          1HG       GLU  17 -11.588   2.576   2.576
  135    H    LEU  18           H        LEU  18 -10.303   0.771   0.771
  136    HA   LEU  18           HA       LEU  18  -9.820  -2.038  -2.038
  137   1HB   LEU  18          2HB       LEU  18  -8.095  -0.120  -0.120
  138   2HB   LEU  18          1HB       LEU  18  -8.791   0.260   0.260
  139    HG   LEU  18           HG       LEU  18  -8.361  -2.088  -2.088
  140   1HD1  LEU  18          1HD1      LEU  18  -7.574  -2.290  -2.290
  141   2HD1  LEU  18          3HD1      LEU  18  -6.440  -3.038  -3.038
  142   3HD1  LEU  18          2HD1      LEU  18  -8.128  -3.543  -3.543
  143   1HD2  LEU  18          3HD2      LEU  18  -6.607   0.021   0.021
  144   2HD2  LEU  18          2HD2      LEU  18  -6.281  -1.500  -1.500
  145   3HD2  LEU  18          1HD2      LEU  18  -5.679  -1.241  -1.241
  146    H    LEU  19           H        LEU  19 -11.949   0.347   0.347
  147    HA   LEU  19           HA       LEU  19 -12.181  -1.094  -1.094
  148   1HB   LEU  19          2HB       LEU  19 -13.940   1.190   1.190
  149   2HB   LEU  19          1HB       LEU  19 -13.607   0.676   0.676
  150    HG   LEU  19           HG       LEU  19 -11.867   2.254   2.254
  151   1HD1  LEU  19          2HD1      LEU  19 -13.433   2.882   2.882
  152   2HD1  LEU  19          1HD1      LEU  19 -11.802   2.833   2.833
  153   3HD1  LEU  19          3HD1      LEU  19 -12.164   3.888   3.888
  154   1HD2  LEU  19          1HD2      LEU  19 -10.917   0.203   0.203
  155   2HD2  LEU  19          3HD2      LEU  19 -10.053   0.993   0.993
  156   3HD2  LEU  19          2HD2      LEU  19 -10.199   1.787   1.787
  157    H    LYS  20           H        LYS  20 -13.637  -1.072  -1.072
  158    HA   LYS  20           HA       LYS  20 -16.163  -2.294  -2.294
  159   1HB   LYS  20          2HB       LYS  20 -15.150  -2.450  -2.450
  160   2HB   LYS  20          1HB       LYS  20 -16.811  -2.362  -2.362
  161   1HG   LYS  20          2HG       LYS  20 -15.651   0.008   0.008
  162   2HG   LYS  20          1HG       LYS  20 -14.971  -0.212  -0.212
  163   1HD   LYS  20          2HD       LYS  20 -17.923  -0.298  -0.298
  164   2HD   LYS  20          1HD       LYS  20 -17.088   1.077   1.077
  165   1HE   LYS  20          2HE       LYS  20 -17.012  -1.665  -1.665
  166   2HE   LYS  20          1HE       LYS  20 -18.290  -0.505  -0.505
  167   1HZ   LYS  20          1HZ       LYS  20 -15.410   0.152   0.152
  168   2HZ   LYS  20          3HZ       LYS  20 -16.314  -0.466  -0.466
  169   3HZ   LYS  20          2HZ       LYS  20 -16.731   1.030   1.030
  170    H    VAL  21           H        VAL  21 -13.018  -3.236  -3.236
  171    HA   VAL  21           HA       VAL  21 -13.688  -6.032  -6.032
  172    HB   VAL  21           HB       VAL  21 -11.859  -4.803  -4.803
  173   1HG1  VAL  21          1HG1      VAL  21 -11.070  -3.477  -3.477
  174   2HG1  VAL  21          3HG1      VAL  21 -10.412  -4.933  -4.933
  175   3HG1  VAL  21          2HG1      VAL  21  -9.762  -4.341  -4.341
  176   1HG2  VAL  21          2HG2      VAL  21 -11.498  -7.347  -7.347
  177   2HG2  VAL  21          1HG2      VAL  21 -11.468  -7.058  -7.058
  178   3HG2  VAL  21          3HG2      VAL  21 -10.057  -6.669  -6.669
  179    H    LEU  22           H        LEU  22 -12.132  -4.095  -4.095
  180    HA   LEU  22           HA       LEU  22 -11.359  -6.221  -6.221
  181   1HB   LEU  22          2HB       LEU  22 -11.590  -3.270  -3.270
  182   2HB   LEU  22          1HB       LEU  22 -11.768  -4.025  -4.025
  183    HG   LEU  22           HG       LEU  22  -9.602  -5.074  -5.074
  184   1HD1  LEU  22          1HD1      LEU  22  -9.765  -5.555  -5.555
  185   2HD1  LEU  22          3HD1      LEU  22  -9.376  -3.865  -3.865
  186   3HD1  LEU  22          2HD1      LEU  22  -8.205  -4.906  -4.906
  187   1HD2  LEU  22          1HD2      LEU  22  -9.919  -2.504  -2.504
  188   2HD2  LEU  22          3HD2      LEU  22  -8.292  -3.141  -3.141
  189   3HD2  LEU  22          2HD2      LEU  22  -9.128  -2.326  -2.326
  190    H    GLY  23           H        GLY  23 -14.125  -4.037  -4.037
  191   1HA   GLY  23          2HA       GLY  23 -15.486  -5.644  -5.644
  192   2HA   GLY  23          1HA       GLY  23 -15.944  -4.015  -4.015
  193    H    VAL  24           H        VAL  24 -18.098  -4.635  -4.635
  194    HA   VAL  24           HA       VAL  24 -18.644  -5.816  -5.816
  195    HB   VAL  24           HB       VAL  24 -20.327  -7.410  -7.410
  196   1HG1  VAL  24          2HG1      VAL  24 -17.905  -8.000  -8.000
  197   2HG1  VAL  24          1HG1      VAL  24 -17.569  -7.951  -7.951
  198   3HG1  VAL  24          3HG1      VAL  24 -18.731  -9.113  -9.113
  199   1HG2  VAL  24          1HG2      VAL  24 -19.026  -6.465  -6.465
  200   2HG2  VAL  24          3HG2      VAL  24 -20.742  -6.466  -6.466
  201   3HG2  VAL  24          2HG2      VAL  24 -19.906  -7.989  -7.989
  202    H    ASN  25           H        ASN  25 -19.973  -4.482  -4.482
  203    HA   ASN  25           HA       ASN  25 -22.532  -3.725  -3.725
  204   1HB   ASN  25          2HB       ASN  25 -21.313  -3.642  -3.642
  205   2HB   ASN  25          1HB       ASN  25 -21.179  -1.952  -1.952
  206   1HD2  ASN  25          2HD2      ASN  25 -24.533  -1.280  -1.280
  207   2HD2  ASN  25          1HD2      ASN  25 -22.972  -0.681  -0.681
  208    H    VAL  26           H        VAL  26 -22.617  -0.916  -0.916
  209    HA   VAL  26           HA       VAL  26 -20.955   0.147   0.147
  210    HB   VAL  26           HB       VAL  26 -22.949   1.766   1.766
  211   1HG1  VAL  26          2HG1      VAL  26 -22.240  -0.063  -0.063
  212   2HG1  VAL  26          1HG1      VAL  26 -23.340  -1.151  -1.151
  213   3HG1  VAL  26          3HG1      VAL  26 -23.976   0.243   0.243
  214   1HG2  VAL  26          1HG2      VAL  26 -24.266  -0.473  -0.473
  215   2HG2  VAL  26          3HG2      VAL  26 -24.266   1.246   1.246
  216   3HG2  VAL  26          2HG2      VAL  26 -25.155   0.662   0.662
  217    H    MET  27           H        MET  27 -22.789   1.031   1.031
  218    HA   MET  27           HA       MET  27 -21.595   3.649   3.649
  219   1HB   MET  27          2HB       MET  27 -23.688   2.445   2.445
  220   2HB   MET  27          1HB       MET  27 -22.459   2.202   2.202
  221   1HG   MET  27          2HG       MET  27 -22.209   4.468   4.468
  222   2HG   MET  27          1HG       MET  27 -22.691   4.913   4.913
  223   1HE   MET  27          2HE       MET  27 -23.407   6.361   6.361
  224   2HE   MET  27          1HE       MET  27 -24.422   6.910   6.910
  225   3HE   MET  27          3HE       MET  27 -25.146   6.513   6.513
  226    H    LEU  28           H        LEU  28 -20.681   0.419   0.419
  227    HA   LEU  28           HA       LEU  28 -18.717   0.949   0.949
  228   1HB   LEU  28          2HB       LEU  28 -19.478  -1.226  -1.226
  229   2HB   LEU  28          1HB       LEU  28 -17.764  -1.224  -1.224
  230    HG   LEU  28           HG       LEU  28 -19.035  -2.581  -2.581
  231   1HD1  LEU  28          1HD1      LEU  28 -17.422  -0.252  -0.252
  232   2HD1  LEU  28          3HD1      LEU  28 -18.518  -0.716  -0.716
  233   3HD1  LEU  28          2HD1      LEU  28 -17.375  -1.889  -1.889
  234   1HD2  LEU  28          1HD2      LEU  28 -20.502   0.016   0.016
  235   2HD2  LEU  28          3HD2      LEU  28 -21.191  -1.425  -1.425
  236   3HD2  LEU  28          2HD2      LEU  28 -20.674  -1.467  -1.467
  237    H    ARG  29           H        ARG  29 -18.548   1.182   1.182
  238    HA   ARG  29           HA       ARG  29 -15.640   1.528   1.528
  239   1HB   ARG  29          2HB       ARG  29 -17.615   2.060   2.060
  240   2HB   ARG  29          1HB       ARG  29 -15.872   1.849   1.849
  241   1HG   ARG  29          2HG       ARG  29 -16.157  -0.374  -0.374
  242   2HG   ARG  29          1HG       ARG  29 -16.875  -0.424  -0.424
  243   1HD   ARG  29          2HD       ARG  29 -18.425  -1.346  -1.346
  244   2HD   ARG  29          1HD       ARG  29 -19.077   0.131   0.131
  245    HE   ARG  29           HE       ARG  29 -17.570   0.701   0.701
  246   1HH1  ARG  29          1HH2      ARG  29 -19.909   2.276   2.276
  247   2HH1  ARG  29          2HH2      ARG  29 -21.112   1.525   1.525
  248   1HH2  ARG  29          2HH1      ARG  29 -19.399  -1.480  -1.480
  249   2HH2  ARG  29          1HH1      ARG  29 -20.819  -0.600  -0.600
  250    H    LYS  30           H        LYS  30 -18.486   3.613   3.613
  251    HA   LYS  30           HA       LYS  30 -17.053   6.009   6.009
  252   1HB   LYS  30          2HB       LYS  30 -19.563   5.567   5.567
  253   2HB   LYS  30          1HB       LYS  30 -19.709   5.909   5.909
  254   1HG   LYS  30          2HG       LYS  30 -20.000   8.050   8.050
  255   2HG   LYS  30          1HG       LYS  30 -18.237   8.041   8.041
  256   1HD   LYS  30          2HD       LYS  30 -18.079   7.539   7.539
  257   2HD   LYS  30          1HD       LYS  30 -19.810   7.216   7.216
  258   1HE   LYS  30          2HE       LYS  30 -19.866   9.743   9.743
  259   2HE   LYS  30          1HE       LYS  30 -18.370   9.809   9.809
  260   1HZ   LYS  30          1HZ       LYS  30 -20.855   8.690   8.690
  261   2HZ   LYS  30          3HZ       LYS  30 -20.529  10.354  10.354
  262   3HZ   LYS  30          2HZ       LYS  30 -19.475   9.257   9.257
  263    H    ILE  31           H        ILE  31 -17.591   4.319   4.319
  264    HA   ILE  31           HA       ILE  31 -17.059   6.663   6.663
  265    HB   ILE  31           HB       ILE  31 -17.048   3.703   3.703
  266   1HG1  ILE  31          2HG1      ILE  31 -19.188   5.654   5.654
  267   2HG1  ILE  31          1HG1      ILE  31 -19.205   4.995   4.995
  268   1HG2  ILE  31          1HG2      ILE  31 -15.753   5.096   5.096
  269   2HG2  ILE  31          3HG2      ILE  31 -17.135   6.176   6.176
  270   3HG2  ILE  31          2HG2      ILE  31 -17.239   4.508   4.508
  271   1HD1  ILE  31          2HD1      ILE  31 -19.098   2.694   2.694
  272   2HD1  ILE  31          1HD1      ILE  31 -19.223   3.405   3.405
  273   3HD1  ILE  31          3HD1      ILE  31 -20.557   3.568   3.568
  274    H    ALA  32           H        ALA  32 -15.213   4.111   4.111
  275    HA   ALA  32           HA       ALA  32 -12.774   4.670   4.670
  276   1HB   ALA  32          2HB       ALA  32 -13.412   2.926   2.926
  277   2HB   ALA  32          1HB       ALA  32 -11.766   3.134   3.134
  278   3HB   ALA  32          3HB       ALA  32 -12.997   2.416   2.416
  279    H    VAL  33           H        VAL  33 -14.287   5.709   5.709
  280    HA   VAL  33           HA       VAL  33 -11.915   6.895   6.895
  281    HB   VAL  33           HB       VAL  33 -14.794   7.580   7.580
  282   1HG1  VAL  33          1HG1      VAL  33 -12.142   7.772   7.772
  283   2HG1  VAL  33          3HG1      VAL  33 -13.627   7.660   7.660
  284   3HG1  VAL  33          2HG1      VAL  33 -13.397   8.998   8.998
  285   1HG2  VAL  33          1HG2      VAL  33 -13.783   4.978   4.978
  286   2HG2  VAL  33          3HG2      VAL  33 -15.169   5.557   5.557
  287   3HG2  VAL  33          2HG2      VAL  33 -13.571   5.524   5.524
  288    H    ALA  34           H        ALA  34 -14.688   7.954   7.954
  289    HA   ALA  34           HA       ALA  34 -13.919  10.754  10.754
  290   1HB   ALA  34          1HB       ALA  34 -15.848   9.191   9.191
  291   2HB   ALA  34          3HB       ALA  34 -15.674  10.946  10.946
  292   3HB   ALA  34          2HB       ALA  34 -16.267  10.145  10.145
  293    H    ALA  35           H        ALA  35 -13.425   7.949   7.949
  294    HA   ALA  35           HA       ALA  35 -12.341   9.291   9.291
  295   1HB   ALA  35          3HB       ALA  35 -12.065   6.491   6.491
  296   2HB   ALA  35          2HB       ALA  35 -11.208   6.996   6.996
  297   3HB   ALA  35          1HB       ALA  35 -12.971   7.020   7.020
  298    H    ALA  36           H        ALA  36 -10.875   7.977   7.977
  299    HA   ALA  36           HA       ALA  36  -8.164   8.456   8.456
  300   1HB   ALA  36          2HB       ALA  36  -9.640   7.678   7.678
  301   2HB   ALA  36          1HB       ALA  36  -8.312   8.762   8.762
  302   3HB   ALA  36          3HB       ALA  36  -7.993   7.263   7.263
  303    H    SER  37           H        SER  37 -10.071  10.320  10.320
  304    HA   SER  37           HA       SER  37  -9.911  12.588  12.588
  305   1HB   SER  37          2HB       SER  37  -9.829  12.547  12.547
  306   2HB   SER  37          1HB       SER  37  -9.458  14.067  14.067
  307    HG   SER  37           HG       SER  37 -11.452  14.117  14.117
  308    H    LYS  38           H        LYS  38  -7.685  11.363  11.363
  309    HA   LYS  38           HA       LYS  38  -5.428  11.724  11.724
  310   1HB   LYS  38          2HB       LYS  38  -5.607  14.327  14.327
  311   2HB   LYS  38          1HB       LYS  38  -4.477  13.913  13.913
  312   1HG   LYS  38          2HG       LYS  38  -6.819  13.543  13.543
  313   2HG   LYS  38          1HG       LYS  38  -7.302  14.808  14.808
  314   1HD   LYS  38          2HD       LYS  38  -5.266  16.115  16.115
  315   2HD   LYS  38          1HD       LYS  38  -5.018  14.907  14.907
  316   1HE   LYS  38          2HE       LYS  38  -7.726  16.154  16.154
  317   2HE   LYS  38          1HE       LYS  38  -6.433  17.105  17.105
  318   1HZ   LYS  38          2HZ       LYS  38  -7.120  14.346  14.346
  319   2HZ   LYS  38          1HZ       LYS  38  -7.744  15.740  15.740
  320   3HZ   LYS  38          3HZ       LYS  38  -6.076  15.436  15.436
  321    HA   PRO  39           HA       PRO  39  -4.703  10.310  10.310
  322   1HB   PRO  39          2HB       PRO  39  -3.838   7.790   7.790
  323   2HB   PRO  39          1HB       PRO  39  -5.517   8.202   8.202
  324   1HG   PRO  39          2HG       PRO  39  -4.249   7.700   7.700
  325   2HG   PRO  39          1HG       PRO  39  -5.932   7.468   7.468
  326   1HD   PRO  39          2HD       PRO  39  -4.986   9.623   9.623
  327   2HD   PRO  39          1HD       PRO  39  -6.532   9.579   9.579
  328    H    ALA  40           H        ALA  40  -2.629   9.985   9.985
  329    HA   ALA  40           HA       ALA  40  -0.346  10.740  10.740
  330   1HB   ALA  40          2HB       ALA  40  -0.740  10.959  10.959
  331   2HB   ALA  40          1HB       ALA  40   0.747  11.398  11.398
  332   3HB   ALA  40          3HB       ALA  40  -0.743  12.284  12.284
  333    H    VAL  41           H        VAL  41   1.816   9.846   9.846
  334    HA   VAL  41           HA       VAL  41   1.657   7.177   7.177
  335    HB   VAL  41           HB       VAL  41   2.477   7.668   7.668
  336   1HG1  VAL  41          2HG1      VAL  41   2.991   5.253   5.253
  337   2HG1  VAL  41          1HG1      VAL  41   3.126   5.238   5.238
  338   3HG1  VAL  41          3HG1      VAL  41   4.199   6.258   6.258
  339   1HG2  VAL  41          3HG2      VAL  41   0.459   5.876   5.876
  340   2HG2  VAL  41          2HG2      VAL  41   0.129   7.214   7.214
  341   3HG2  VAL  41          1HG2      VAL  41   0.888   5.741   5.741
  342    H    GLU  42           H        GLU  42   3.911   6.338   6.338
  343    HA   GLU  42           HA       GLU  42   6.081   8.335   8.335
  344   1HB   GLU  42          2HB       GLU  42   5.029   8.904   8.904
  345   2HB   GLU  42          1HB       GLU  42   5.216   7.237   7.237
  346   1HG   GLU  42          2HG       GLU  42   7.641   8.707   8.707
  347   2HG   GLU  42          1HG       GLU  42   7.014   9.089   9.089
  348    H    ILE  43           H        ILE  43   7.532   7.065   7.065
  349    HA   ILE  43           HA       ILE  43   7.741   4.204   4.204
  350    HB   ILE  43           HB       ILE  43   8.758   5.806   5.806
  351   1HG1  ILE  43          2HG1      ILE  43   7.105   3.471   3.471
  352   2HG1  ILE  43          1HG1      ILE  43   6.287   4.558   4.558
  353   1HG2  ILE  43          3HG2      ILE  43   9.245   2.913   2.913
  354   2HG2  ILE  43          2HG2      ILE  43   9.378   3.505   3.505
  355   3HG2  ILE  43          1HG2      ILE  43  10.440   4.147   4.147
  356   1HD1  ILE  43          2HD1      ILE  43   7.585   6.014   6.014
  357   2HD1  ILE  43          1HD1      ILE  43   6.409   4.844   4.844
  358   3HD1  ILE  43          3HD1      ILE  43   5.913   6.083   6.083
  359    H    LYS  44           H        LYS  44   9.562   3.323   3.323
  360    HA   LYS  44           HA       LYS  44  11.845   5.163   5.163
  361   1HB   LYS  44          2HB       LYS  44  11.727   2.792   2.792
  362   2HB   LYS  44          1HB       LYS  44  11.882   4.483   4.483
  363   1HG   LYS  44          2HG       LYS  44   9.494   4.792   4.792
  364   2HG   LYS  44          1HG       LYS  44   9.230   3.249   3.249
  365   1HD   LYS  44          2HD       LYS  44   9.648   2.019   2.019
  366   2HD   LYS  44          1HD       LYS  44  10.701   3.256   3.256
  367   1HE   LYS  44          2HE       LYS  44   7.717   3.631   3.631
  368   2HE   LYS  44          1HE       LYS  44   8.447   3.028   3.028
  369   1HZ   LYS  44          1HZ       LYS  44   9.924   5.123   5.123
  370   2HZ   LYS  44          3HZ       LYS  44   8.665   5.691   5.691
  371   3HZ   LYS  44          2HZ       LYS  44   8.354   5.273   5.273
  372    H    GLN  45           H        GLN  45  13.585   4.571   4.571
  373    HA   GLN  45           HA       GLN  45  13.677   1.774   1.774
  374   1HB   GLN  45          2HB       GLN  45  13.860   3.561   3.561
  375   2HB   GLN  45          1HB       GLN  45  15.274   4.213   4.213
  376   1HG   GLN  45          2HG       GLN  45  16.547   2.204   2.204
  377   2HG   GLN  45          1HG       GLN  45  15.123   1.385   1.385
  378   1HE2  GLN  45          2HE2      GLN  45  16.315   2.413   2.413
  379   2HE2  GLN  45          1HE2      GLN  45  16.076   1.101   1.101
  380    H    GLU  46           H        GLU  46  14.879   0.361   0.361
  381    HA   GLU  46           HA       GLU  46  17.396   1.344   1.344
  382   1HB   GLU  46          2HB       GLU  46  15.390  -0.745  -0.745
  383   2HB   GLU  46          1HB       GLU  46  17.058  -0.822  -0.822
  384   1HG   GLU  46          2HG       GLU  46  16.899   1.246   1.246
  385   2HG   GLU  46          1HG       GLU  46  15.460   1.725   1.725
  386    H    GLY  47           H        GLY  47  17.513   0.757   0.757
  387   1HA   GLY  47          2HA       GLY  47  19.115  -0.478  -0.478
  388   2HA   GLY  47          1HA       GLY  47  19.143  -1.719  -1.719
  389    H    ASP  48           H        ASP  48  18.303  -3.594  -3.594
  390    HA   ASP  48           HA       ASP  48  16.384  -3.611  -3.611
  391   1HB   ASP  48          2HB       ASP  48  16.257  -6.104  -6.104
  392   2HB   ASP  48          1HB       ASP  48  17.813  -5.512  -5.512
  393    H    THR  49           H        THR  49  15.974  -2.941  -2.941
  394    HA   THR  49           HA       THR  49  13.389  -4.349  -4.349
  395    HB   THR  49           HB       THR  49  15.163  -2.854  -2.854
  396    HG1  THR  49           HG1      THR  49  15.550  -5.050  -5.050
  397   1HG2  THR  49          3HG2      THR  49  12.274  -3.656  -3.656
  398   2HG2  THR  49          2HG2      THR  49  13.379  -3.456  -3.456
  399   3HG2  THR  49          1HG2      THR  49  13.018  -2.087  -2.087
  400    H    PHE  50           H        PHE  50  11.454  -3.236  -3.236
  401    HA   PHE  50           HA       PHE  50  11.579  -0.276  -0.276
  402   1HB   PHE  50          2HB       PHE  50  10.108  -2.163  -2.163
  403   2HB   PHE  50          1HB       PHE  50   9.892  -0.408  -0.408
  404    HD1  PHE  50           HD2      PHE  50  11.921   1.077   1.077
  405    HD2  PHE  50           HD1      PHE  50  11.978  -3.150  -3.150
  406    HE1  PHE  50           HE2      PHE  50  13.985   1.330   1.330
  407    HE2  PHE  50           HE1      PHE  50  14.039  -2.901  -2.901
  408    HZ   PHE  50           HZ       PHE  50  15.056  -0.666  -0.666
  409    H    TYR  51           H        TYR  51  10.377   0.489   0.489
  410    HA   TYR  51           HA       TYR  51   8.039  -1.051  -1.051
  411   1HB   TYR  51          2HB       TYR  51   9.829  -0.358  -0.358
  412   2HB   TYR  51          1HB       TYR  51   9.513   1.321   1.321
  413    HD1  TYR  51           HD1      TYR  51   7.033   2.102   2.102
  414    HD2  TYR  51           HD2      TYR  51   8.656  -1.348  -1.348
  415    HE1  TYR  51           HE1      TYR  51   5.218   2.184   2.184
  416    HE2  TYR  51           HE2      TYR  51   6.837  -1.258  -1.258
  417    HH   TYR  51           HH       TYR  51   5.274   0.377   0.377
  418    H    ILE  52           H        ILE  52   5.961   0.038   0.038
  419    HA   ILE  52           HA       ILE  52   5.873   2.714   2.714
  420    HB   ILE  52           HB       ILE  52   3.923   0.660   0.660
  421   1HG1  ILE  52          2HG1      ILE  52   6.815   0.910   0.910
  422   2HG1  ILE  52          1HG1      ILE  52   6.034  -0.526  -0.526
  423   1HG2  ILE  52          1HG2      ILE  52   4.149   3.270   3.270
  424   2HG2  ILE  52          3HG2      ILE  52   5.326   2.708   2.708
  425   3HG2  ILE  52          2HG2      ILE  52   3.656   2.148   2.148
  426   1HD1  ILE  52          1HD1      ILE  52   4.460   0.266   0.266
  427   2HD1  ILE  52          3HD1      ILE  52   6.137   0.403   0.403
  428   3HD1  ILE  52          2HD1      ILE  52   5.533  -1.130  -1.130
  429    H    LYS  53           H        LYS  53   4.878   3.866   3.866
  430    HA   LYS  53           HA       LYS  53   2.506   2.703   2.703
  431   1HB   LYS  53          2HB       LYS  53   4.338   3.773   3.773
  432   2HB   LYS  53          1HB       LYS  53   3.963   5.300   5.300
  433   1HG   LYS  53          2HG       LYS  53   1.539   4.052   4.052
  434   2HG   LYS  53          1HG       LYS  53   2.730   4.215   4.215
  435   1HD   LYS  53          2HD       LYS  53   2.329   6.554   6.554
  436   2HD   LYS  53          1HD       LYS  53   1.072   6.213   6.213
  437   1HE   LYS  53          2HE       LYS  53   2.541   6.494   6.494
  438   2HE   LYS  53          1HE       LYS  53   3.973   6.288   6.288
  439   1HZ   LYS  53          3HZ       LYS  53   3.064   8.388   8.388
  440   2HZ   LYS  53          2HZ       LYS  53   2.211   8.626   8.626
  441   3HZ   LYS  53          1HZ       LYS  53   3.909   8.551   8.551
  442    H    THR  54           H        THR  54   0.616   3.172   3.172
  443    HA   THR  54           HA       THR  54   0.398   5.808   5.808
  444    HB   THR  54           HB       THR  54  -1.457   3.412   3.412
  445    HG1  THR  54           HG1      THR  54  -0.204   2.669   2.669
  446   1HG2  THR  54          1HG2      THR  54  -1.742   6.096   6.096
  447   2HG2  THR  54          3HG2      THR  54  -1.385   5.166   5.166
  448   3HG2  THR  54          2HG2      THR  54  -2.758   4.725   4.725
  449    H    SER  55           H        SER  55  -1.188   7.283   7.283
  450    HA   SER  55           HA       SER  55  -2.986   6.406   6.406
  451   1HB   SER  55          2HB       SER  55  -2.378   8.890   8.890
  452   2HB   SER  55          1HB       SER  55  -1.518   7.448   7.448
  453    HG   SER  55           HG       SER  55  -0.595   9.550   9.550
  454    H    THR  56           H        THR  56  -4.976   7.384   7.384
  455    HA   THR  56           HA       THR  56  -5.532   9.265   9.265
  456    HB   THR  56           HB       THR  56  -7.982   8.387   8.387
  457    HG1  THR  56           HG1      THR  56  -7.960   6.626   6.626
  458   1HG2  THR  56          2HG2      THR  56  -6.704   8.141   8.141
  459   2HG2  THR  56          1HG2      THR  56  -6.043   6.638   6.638
  460   3HG2  THR  56          3HG2      THR  56  -7.780   6.797   6.797
  461    H    THR  57           H        THR  57  -7.005   8.445   8.445
  462    HA   THR  57           HA       THR  57  -6.613  10.927  10.927
  463    HB   THR  57           HB       THR  57  -8.042  11.948  11.948
  464    HG1  THR  57           HG1      THR  57  -9.066  12.924  12.924
  465   1HG2  THR  57          2HG2      THR  57  -9.062   9.787   9.787
  466   2HG2  THR  57          1HG2      THR  57 -10.106   9.837   9.837
  467   3HG2  THR  57          3HG2      THR  57 -10.229  11.095  11.095
  468    H    VAL  58           H        VAL  58  -8.861   8.305   8.305
  469    HA   VAL  58           HA       VAL  58  -9.167   7.871   7.871
  470    HB   VAL  58           HB       VAL  58 -11.012   6.956   6.956
  471   1HG1  VAL  58          1HG1      VAL  58 -11.077   6.795   6.795
  472   2HG1  VAL  58          3HG1      VAL  58 -12.546   6.657   6.657
  473   3HG1  VAL  58          2HG1      VAL  58 -11.245   5.483   5.483
  474   1HG2  VAL  58          2HG2      VAL  58 -10.836   9.472   9.472
  475   2HG2  VAL  58          1HG2      VAL  58 -11.622   9.156   9.156
  476   3HG2  VAL  58          3HG2      VAL  58 -12.440   8.741   8.741
  477    H    ARG  59           H        ARG  59  -7.787   6.653   6.653
  478    HA   ARG  59           HA       ARG  59  -7.453   3.973   3.973
  479   1HB   ARG  59          2HB       ARG  59  -8.860   3.908   3.908
  480   2HB   ARG  59          1HB       ARG  59  -7.508   4.600   4.600
  481   1HG   ARG  59          2HG       ARG  59  -6.185   2.687   2.687
  482   2HG   ARG  59          1HG       ARG  59  -7.087   2.129   2.129
  483   1HD   ARG  59          2HD       ARG  59  -7.611   0.764   0.764
  484   2HD   ARG  59          1HD       ARG  59  -9.034   1.631   1.631
  485    HE   ARG  59           HE       ARG  59  -7.670   3.197   3.197
  486   1HH1  ARG  59          1HH2      ARG  59  -8.461   0.010   0.010
  487   2HH1  ARG  59          2HH2      ARG  59  -9.691   0.247   0.247
  488   1HH2  ARG  59          2HH1      ARG  59  -9.772   3.693   3.693
  489   2HH2  ARG  59          1HH1      ARG  59 -10.433   2.332   2.332
  490    H    THR  60           H        THR  60  -5.358   2.925   2.925
  491    HA   THR  60           HA       THR  60  -3.251   4.606   4.606
  492    HB   THR  60           HB       THR  60  -3.051   3.795   3.795
  493    HG1  THR  60           HG1      THR  60  -3.883   5.656   5.656
  494   1HG2  THR  60          2HG2      THR  60  -1.302   5.194   5.194
  495   2HG2  THR  60          1HG2      THR  60  -1.217   5.696   5.696
  496   3HG2  THR  60          3HG2      THR  60  -0.865   4.025   4.025
  497    H    THR  61           H        THR  61  -2.702   2.893   2.893
  498    HA   THR  61           HA       THR  61  -2.339   0.186   0.186
  499    HB   THR  61           HB       THR  61  -1.432  -0.078  -0.078
  500    HG1  THR  61           HG1      THR  61  -2.252   1.418   1.418
  501   1HG2  THR  61          3HG2      THR  61  -4.327   0.187   0.187
  502   2HG2  THR  61          2HG2      THR  61  -3.785  -0.594  -0.594
  503   3HG2  THR  61          1HG2      THR  61  -3.341  -1.273  -1.273
  504    H    GLU  62           H        GLU  62  -0.256  -0.989  -0.989
  505    HA   GLU  62           HA       GLU  62   2.171   0.627   0.627
  506   1HB   GLU  62          2HB       GLU  62   1.262  -0.407  -0.407
  507   2HB   GLU  62          1HB       GLU  62   2.984  -0.414  -0.414
  508   1HG   GLU  62          2HG       GLU  62   3.012   1.751   1.751
  509   2HG   GLU  62          1HG       GLU  62   2.139   2.110   2.110
  510    H    ILE  63           H        ILE  63   3.524  -0.672  -0.672
  511    HA   ILE  63           HA       ILE  63   3.359  -3.630  -3.630
  512    HB   ILE  63           HB       ILE  63   3.916  -3.911  -3.911
  513   1HG1  ILE  63          2HG1      ILE  63   3.389  -0.927  -0.927
  514   2HG1  ILE  63          1HG1      ILE  63   4.997  -1.650  -1.650
  515   1HG2  ILE  63          3HG2      ILE  63   1.506  -3.598  -3.598
  516   2HG2  ILE  63          2HG2      ILE  63   1.501  -2.140  -2.140
  517   3HG2  ILE  63          1HG2      ILE  63   1.706  -3.720  -3.720
  518   1HD1  ILE  63          3HD1      ILE  63   2.975  -2.800  -2.800
  519   2HD1  ILE  63          2HD1      ILE  63   3.515  -1.161  -1.161
  520   3HD1  ILE  63          1HD1      ILE  63   4.688  -2.474  -2.474
  521    H    ASN  64           H        ASN  64   5.475  -4.737  -4.737
  522    HA   ASN  64           HA       ASN  64   7.871  -3.073  -3.073
  523   1HB   ASN  64          2HB       ASN  64   8.873  -3.992  -3.992
  524   2HB   ASN  64          1HB       ASN  64   7.512  -2.915  -2.915
  525   1HD2  ASN  64          2HD2      ASN  64   5.301  -5.553  -5.553
  526   2HD2  ASN  64          1HD2      ASN  64   5.314  -4.084  -4.084
  527    H    PHE  65           H        PHE  65   9.371  -4.288  -4.288
  528    HA   PHE  65           HA       PHE  65   9.563  -7.189  -7.189
  529   1HB   PHE  65          2HB       PHE  65   8.888  -7.847  -7.847
  530   2HB   PHE  65          1HB       PHE  65   7.567  -7.005  -7.005
  531    HD1  PHE  65           HD2      PHE  65   7.076  -4.605  -4.605
  532    HD2  PHE  65           HD1      PHE  65   9.969  -6.945  -6.945
  533    HE1  PHE  65           HE2      PHE  65   7.062  -2.937  -2.937
  534    HE2  PHE  65           HE1      PHE  65   9.961  -5.283  -5.283
  535    HZ   PHE  65           HZ       PHE  65   8.509  -3.278  -3.278
  536    H    LYS  66           H        LYS  66  10.834  -8.095  -8.095
  537    HA   LYS  66           HA       LYS  66  13.102  -6.248  -6.248
  538   1HB   LYS  66          2HB       LYS  66  14.566  -8.346  -8.346
  539   2HB   LYS  66          1HB       LYS  66  14.015  -7.745  -7.745
  540   1HG   LYS  66          2HG       LYS  66  12.084  -9.377  -9.377
  541   2HG   LYS  66          1HG       LYS  66  12.873 -10.063 -10.063
  542   1HD   LYS  66          2HD       LYS  66  13.976 -11.401 -11.401
  543   2HD   LYS  66          1HD       LYS  66  14.937  -9.976  -9.976
  544   1HE   LYS  66          2HE       LYS  66  12.404  -9.960  -9.960
  545   2HE   LYS  66          1HE       LYS  66  13.332 -11.421 -11.421
  546   1HZ   LYS  66          3HZ       LYS  66  14.584  -8.746  -8.746
  547   2HZ   LYS  66          2HZ       LYS  66  13.801  -9.387  -9.387
  548   3HZ   LYS  66          1HZ       LYS  66  15.143 -10.188 -10.188
  549    H    VAL  67           H        VAL  67  14.091  -6.730  -6.730
  550    HA   VAL  67           HA       VAL  67  12.069  -7.796  -7.796
  551    HB   VAL  67           HB       VAL  67  14.728  -7.167  -7.167
  552   1HG1  VAL  67          1HG1      VAL  67  11.828  -6.541  -6.541
  553   2HG1  VAL  67          3HG1      VAL  67  13.107  -5.693  -5.693
  554   3HG1  VAL  67          2HG1      VAL  67  12.962  -7.446  -7.446
  555   1HG2  VAL  67          1HG2      VAL  67  13.172  -5.146  -5.146
  556   2HG2  VAL  67          3HG2      VAL  67  14.917  -5.386  -5.386
  557   3HG2  VAL  67          2HG2      VAL  67  14.065  -4.649  -4.649
  558    H    GLY  68           H        GLY  68  11.983 -10.043 -10.043
  559   1HA   GLY  68          2HA       GLY  68  13.322 -11.846 -11.846
  560   2HA   GLY  68          1HA       GLY  68  14.518 -11.573 -11.573
  561    H    GLU  69           H        GLU  69  12.529 -11.212 -11.212
  562    HA   GLU  69           HA       GLU  69  11.660 -14.070 -14.070
  563   1HB   GLU  69          2HB       GLU  69  12.283 -12.091 -12.091
  564   2HB   GLU  69          1HB       GLU  69  11.873 -13.793 -13.793
  565   1HG   GLU  69          2HG       GLU  69  13.914 -14.100 -14.100
  566   2HG   GLU  69          1HG       GLU  69  14.406 -12.565 -12.565
  567    H    GLU  70           H        GLU  70   9.613 -14.461 -14.461
  568    HA   GLU  70           HA       GLU  70   7.605 -12.413 -12.413
  569   1HB   GLU  70          2HB       GLU  70   7.178 -15.120 -15.120
  570   2HB   GLU  70          1HB       GLU  70   5.968 -14.123 -14.123
  571   1HG   GLU  70          2HG       GLU  70   6.941 -14.488 -14.488
  572   2HG   GLU  70          1HG       GLU  70   8.425 -15.135 -15.135
  573    H    PHE  71           H        PHE  71   5.839 -12.024 -12.024
  574    HA   PHE  71           HA       PHE  71   6.662 -12.209 -12.209
  575   1HB   PHE  71          2HB       PHE  71   6.683  -9.727  -9.727
  576   2HB   PHE  71          1HB       PHE  71   8.018 -10.299 -10.299
  577    HD1  PHE  71           HD2      PHE  71   7.727 -10.226 -10.226
  578    HD2  PHE  71           HD1      PHE  71   5.159  -8.130  -8.130
  579    HE1  PHE  71           HE2      PHE  71   6.965  -8.751  -8.751
  580    HE2  PHE  71           HE1      PHE  71   4.398  -6.657  -6.657
  581    HZ   PHE  71           HZ       PHE  71   5.299  -6.963  -6.963
  582    H    GLU  72           H        GLU  72   5.048 -10.860 -10.860
  583    HA   GLU  72           HA       GLU  72   2.356 -11.173 -11.173
  584   1HB   GLU  72          2HB       GLU  72   2.764 -10.642 -10.642
  585   2HB   GLU  72          1HB       GLU  72   1.433 -11.463 -11.463
  586   1HG   GLU  72          2HG       GLU  72   2.970 -13.338 -13.338
  587   2HG   GLU  72          1HG       GLU  72   4.246 -12.540 -12.540
  588    H    GLU  73           H        GLU  73   0.944  -9.394  -9.394
  589    HA   GLU  73           HA       GLU  73   1.663  -6.853  -6.853
  590   1HB   GLU  73          2HB       GLU  73   1.796  -5.616  -5.616
  591   2HB   GLU  73          1HB       GLU  73   3.147  -6.722  -6.722
  592   1HG   GLU  73          2HG       GLU  73   2.454  -8.168  -8.168
  593   2HG   GLU  73          1HG       GLU  73   0.746  -7.819  -7.819
  594    H    GLN  74           H        GLN  74   0.110  -5.102  -5.102
  595    HA   GLN  74           HA       GLN  74  -2.600  -6.369  -6.369
  596   1HB   GLN  74          2HB       GLN  74  -1.550  -3.601  -3.601
  597   2HB   GLN  74          1HB       GLN  74  -3.243  -3.810  -3.810
  598   1HG   GLN  74          2HG       GLN  74  -2.037  -5.531  -5.531
  599   2HG   GLN  74          1HG       GLN  74  -2.584  -3.897  -3.897
  600   1HE2  GLN  74          2HE2      GLN  74  -5.997  -4.772  -4.772
  601   2HE2  GLN  74          1HE2      GLN  74  -4.828  -3.580  -3.580
  602    H    THR  75           H        THR  75  -4.201  -5.660  -5.660
  603    HA   THR  75           HA       THR  75  -2.902  -5.204  -5.204
  604    HB   THR  75           HB       THR  75  -4.502  -7.133  -7.133
  605    HG1  THR  75           HG1      THR  75  -5.211  -6.985  -6.985
  606   1HG2  THR  75          3HG2      THR  75  -6.178  -5.047  -5.047
  607   2HG2  THR  75          2HG2      THR  75  -6.910  -5.673  -5.673
  608   3HG2  THR  75          1HG2      THR  75  -6.559  -6.763  -6.763
  609    H    VAL  76           H        VAL  76  -5.669  -4.116  -4.116
  610    HA   VAL  76           HA       VAL  76  -5.144  -1.332  -1.332
  611    HB   VAL  76           HB       VAL  76  -6.526  -2.251  -2.251
  612   1HG1  VAL  76          3HG1      VAL  76  -5.684   0.404   0.404
  613   2HG1  VAL  76          2HG1      VAL  76  -5.770   0.177   0.177
  614   3HG1  VAL  76          1HG1      VAL  76  -7.213  -0.044  -0.044
  615   1HG2  VAL  76          3HG2      VAL  76  -3.664  -1.373  -1.373
  616   2HG2  VAL  76          2HG2      VAL  76  -4.193  -2.975  -2.975
  617   3HG2  VAL  76          1HG2      VAL  76  -4.387  -1.595  -1.595
  618    H    ASP  77           H        ASP  77  -7.588  -3.813  -3.813
  619    HA   ASP  77           HA       ASP  77  -9.764  -1.911  -1.911
  620   1HB   ASP  77          2HB       ASP  77 -11.131  -4.024  -4.024
  621   2HB   ASP  77          1HB       ASP  77 -10.376  -3.793  -3.793
  622    H    GLY  78           H        GLY  78  -7.935  -4.391  -4.391
  623   1HA   GLY  78          2HA       GLY  78  -7.512  -3.571  -3.571
  624   2HA   GLY  78          1HA       GLY  78  -9.272  -3.589  -3.589
  625    H    ARG  79           H        ARG  79  -7.063  -5.887  -5.887
  626    HA   ARG  79           HA       ARG  79  -7.991  -7.995  -7.995
  627   1HB   ARG  79          2HB       ARG  79  -8.110  -7.889  -7.889
  628   2HB   ARG  79          1HB       ARG  79  -7.783  -9.436  -9.436
  629   1HG   ARG  79          2HG       ARG  79  -9.980  -7.967  -7.967
  630   2HG   ARG  79          1HG       ARG  79 -10.299  -8.348  -8.348
  631   1HD   ARG  79          2HD       ARG  79  -9.123 -10.552 -10.552
  632   2HD   ARG  79          1HD       ARG  79 -10.762 -10.084 -10.084
  633    HE   ARG  79           HE       ARG  79 -10.081 -10.749 -10.749
  634   1HH1  ARG  79          1HH2      ARG  79 -12.592 -10.499 -10.499
  635   2HH1  ARG  79          2HH2      ARG  79 -13.511 -11.757 -11.757
  636   1HH2  ARG  79          2HH1      ARG  79 -10.989 -12.632 -12.632
  637   2HH2  ARG  79          1HH1      ARG  79 -12.603 -12.964 -12.964
  638    HA   PRO  80           HA       PRO  80  -3.652  -8.884  -8.884
  639   1HB   PRO  80          2HB       PRO  80  -3.727 -11.492 -11.492
  640   2HB   PRO  80          1HB       PRO  80  -4.022 -10.094 -10.094
  641   1HG   PRO  80          2HG       PRO  80  -5.973 -12.055 -12.055
  642   2HG   PRO  80          1HG       PRO  80  -6.082 -11.072 -11.072
  643   1HD   PRO  80          2HD       PRO  80  -7.386 -10.539 -10.539
  644   2HD   PRO  80          1HD       PRO  80  -7.226  -9.414  -9.414
  645    H    CYS  81           H        CYS  81  -2.099  -9.748  -9.748
  646    HA   CYS  81           HA       CYS  81  -2.597 -12.088 -12.088
  647   1HB   CYS  81          2HB       CYS  81  -2.247 -10.842 -10.842
  648   2HB   CYS  81          1HB       CYS  81  -3.790 -10.496 -10.496
  649    HG   CYS  81           HG       CYS  81  -1.588  -8.472  -8.472
  650    H    LYS  82           H        LYS  82  -0.659 -12.951 -12.951
  651    HA   LYS  82           HA       LYS  82   1.801 -11.692 -11.692
  652   1HB   LYS  82          2HB       LYS  82   1.436 -14.102 -14.102
  653   2HB   LYS  82          1HB       LYS  82   1.319 -14.347 -14.347
  654   1HG   LYS  82          2HG       LYS  82   3.682 -13.224 -13.224
  655   2HG   LYS  82          1HG       LYS  82   3.723 -13.681 -13.681
  656   1HD   LYS  82          2HD       LYS  82   2.893 -15.723 -15.723
  657   2HD   LYS  82          1HD       LYS  82   4.608 -15.363 -15.363
  658   1HE   LYS  82          2HE       LYS  82   3.056 -15.780 -15.780
  659   2HE   LYS  82          1HE       LYS  82   3.311 -17.206 -17.206
  660   1HZ   LYS  82          3HZ       LYS  82   5.444 -15.366 -15.366
  661   2HZ   LYS  82          2HZ       LYS  82   5.102 -16.893 -16.893
  662   3HZ   LYS  82          1HZ       LYS  82   5.674 -16.764 -16.764
  663    H    SER  83           H        SER  83   2.801 -10.261 -10.261
  664    HA   SER  83           HA       SER  83   2.366 -10.401 -10.401
  665   1HB   SER  83          2HB       SER  83   1.913  -8.229  -8.229
  666   2HB   SER  83          1HB       SER  83   3.228  -8.262  -8.262
  667    HG   SER  83           HG       SER  83   3.518  -7.007  -7.007
  668    H    LEU  84           H        LEU  84   4.310  -9.869  -9.869
  669    HA   LEU  84           HA       LEU  84   6.933 -10.582 -10.582
  670   1HB   LEU  84          2HB       LEU  84   6.055 -12.757 -12.757
  671   2HB   LEU  84          1HB       LEU  84   5.687 -12.075 -12.075
  672    HG   LEU  84           HG       LEU  84   8.081 -11.664 -11.664
  673   1HD1  LEU  84          2HD1      LEU  84   8.667 -11.368 -11.368
  674   2HD1  LEU  84          1HD1      LEU  84   8.572 -13.115 -13.115
  675   3HD1  LEU  84          3HD1      LEU  84   9.778 -12.397 -12.397
  676   1HD2  LEU  84          1HD2      LEU  84   7.066 -14.385 -14.385
  677   2HD2  LEU  84          3HD2      LEU  84   7.562 -13.740 -13.740
  678   3HD2  LEU  84          2HD2      LEU  84   8.780 -14.212 -14.212
  679    H    VAL  85           H        VAL  85   8.702  -9.807  -9.807
  680    HA   VAL  85           HA       VAL  85   7.773  -8.213  -8.213
  681    HB   VAL  85           HB       VAL  85   9.478  -6.987  -6.987
  682   1HG1  VAL  85          3HG1      VAL  85   9.559  -6.156  -6.156
  683   2HG1  VAL  85          2HG1      VAL  85   7.892  -5.633  -5.633
  684   3HG1  VAL  85          1HG1      VAL  85   9.182  -4.950  -4.950
  685   1HG2  VAL  85          1HG2      VAL  85   6.500  -6.916  -6.916
  686   2HG2  VAL  85          3HG2      VAL  85   7.360  -7.261  -7.261
  687   3HG2  VAL  85          2HG2      VAL  85   7.326  -5.619  -5.619
  688    H    LYS  86           H        LYS  86   9.119  -8.505  -8.505
  689    HA   LYS  86           HA       LYS  86  11.993  -9.102  -9.102
  690   1HB   LYS  86          2HB       LYS  86  11.759 -10.027 -10.027
  691   2HB   LYS  86          1HB       LYS  86  11.465 -11.056 -11.056
  692   1HG   LYS  86          2HG       LYS  86   9.016 -10.437 -10.437
  693   2HG   LYS  86          1HG       LYS  86   9.401  -9.629  -9.629
  694   1HD   LYS  86          2HD       LYS  86   9.750 -11.602 -11.602
  695   2HD   LYS  86          1HD       LYS  86  10.381 -12.423 -12.423
  696   1HE   LYS  86          2HE       LYS  86   7.969 -12.285 -12.285
  697   2HE   LYS  86          1HE       LYS  86   7.501 -11.913 -11.913
  698   1HZ   LYS  86          2HZ       LYS  86   9.157 -14.268 -14.268
  699   2HZ   LYS  86          1HZ       LYS  86   7.459 -14.330 -14.330
  700   3HZ   LYS  86          3HZ       LYS  86   8.317 -13.962 -13.962
  701    H    TRP  87           H        TRP  87  13.461  -8.100  -8.100
  702    HA   TRP  87           HA       TRP  87  12.515  -5.429  -5.429
  703   1HB   TRP  87          2HB       TRP  87  15.130  -6.910  -6.910
  704   2HB   TRP  87          1HB       TRP  87  14.879  -5.340  -5.340
  705    HD1  TRP  87           HD1      TRP  87  15.816  -6.970  -6.970
  706    HE1  TRP  87           HE1      TRP  87  16.030  -5.239  -5.239
  707    HE3  TRP  87           HE3      TRP  87  13.645  -2.960  -2.960
  708    HZ2  TRP  87           HZ2      TRP  87  15.363  -2.498  -2.498
  709    HZ3  TRP  87           HZ3      TRP  87  13.427  -0.801  -0.801
  710    HH2  TRP  87           HH2      TRP  87  14.278  -0.574  -0.574
  711    H    GLU  88           H        GLU  88  13.204  -4.650  -4.650
  712    HA   GLU  88           HA       GLU  88  12.594  -6.640  -6.640
  713   1HB   GLU  88          2HB       GLU  88  10.575  -5.183  -5.183
  714   2HB   GLU  88          1HB       GLU  88  11.417  -3.869  -3.869
  715   1HG   GLU  88          2HG       GLU  88  10.052  -4.701  -4.701
  716   2HG   GLU  88          1HG       GLU  88  11.588  -5.513  -5.513
  717    H    SER  89           H        SER  89  13.535  -3.341  -3.341
  718    HA   SER  89           HA       SER  89  15.659  -3.432  -3.432
  719   1HB   SER  89          2HB       SER  89  15.178  -1.150  -1.150
  720   2HB   SER  89          1HB       SER  89  13.639  -2.006  -2.006
  721    HG   SER  89           HG       SER  89  14.113   0.143   0.143
  722    H    GLU  90           H        GLU  90  16.538  -0.732  -0.732
  723    HA   GLU  90           HA       GLU  90  18.051  -1.596  -1.596
  724   1HB   GLU  90          2HB       GLU  90  17.930   1.185   1.185
  725   2HB   GLU  90          1HB       GLU  90  19.204   0.523   0.523
  726   1HG   GLU  90          2HG       GLU  90  18.654  -1.082  -1.082
  727   2HG   GLU  90          1HG       GLU  90  19.254   0.540   0.540
  728    H    ASN  91           H        ASN  91  15.210   0.378   0.378
  729    HA   ASN  91           HA       ASN  91  14.901   0.619   0.619
  730   1HB   ASN  91          2HB       ASN  91  14.359   2.934   2.934
  731   2HB   ASN  91          1HB       ASN  91  14.348   2.943   2.943
  732   1HD2  ASN  91          2HD2      ASN  91  17.705   3.999   3.999
  733   2HD2  ASN  91          1HD2      ASN  91  16.135   4.208   4.208
  734    H    LYS  92           H        LYS  92  13.539  -1.044  -1.044
  735    HA   LYS  92           HA       LYS  92  10.775  -0.094  -0.094
  736   1HB   LYS  92          2HB       LYS  92  11.297   0.471   0.471
  737   2HB   LYS  92          1HB       LYS  92  11.763  -1.200  -1.200
  738   1HG   LYS  92          2HG       LYS  92   9.370  -1.786  -1.786
  739   2HG   LYS  92          1HG       LYS  92   9.021  -0.083  -0.083
  740   1HD   LYS  92          2HD       LYS  92   9.889  -0.366  -0.366
  741   2HD   LYS  92          1HD       LYS  92  10.043  -2.094  -2.094
  742   1HE   LYS  92          2HE       LYS  92   7.491  -1.728  -1.728
  743   2HE   LYS  92          1HE       LYS  92   7.598  -0.458  -0.458
  744   1HZ   LYS  92          3HZ       LYS  92   8.529  -2.183  -2.183
  745   2HZ   LYS  92          2HZ       LYS  92   8.123  -3.354  -3.354
  746   3HZ   LYS  92          1HZ       LYS  92   6.906  -2.422  -2.422
  747    H    MET  93           H        MET  93  10.023  -1.673  -1.673
  748    HA   MET  93           HA       MET  93  10.727  -4.502  -4.502
  749   1HB   MET  93          2HB       MET  93  10.516  -5.038  -5.038
  750   2HB   MET  93          1HB       MET  93  11.750  -3.817  -3.817
  751   1HG   MET  93          2HG       MET  93   9.312  -2.426  -2.426
  752   2HG   MET  93          1HG       MET  93   9.356  -3.657  -3.657
  753   1HE   MET  93          1HE       MET  93  11.405  -4.332  -4.332
  754   2HE   MET  93          3HE       MET  93  12.733  -3.302  -3.302
  755   3HE   MET  93          2HE       MET  93  11.170  -3.237  -3.237
  756    H    VAL  94           H        VAL  94   9.101  -6.074  -6.074
  757    HA   VAL  94           HA       VAL  94   6.332  -5.020  -5.020
  758    HB   VAL  94           HB       VAL  94   7.148  -7.863  -7.863
  759   1HG1  VAL  94          3HG1      VAL  94   4.921  -6.015  -6.015
  760   2HG1  VAL  94          2HG1      VAL  94   5.321  -7.327  -7.327
  761   3HG1  VAL  94          1HG1      VAL  94   4.848  -7.683  -7.683
  762   1HG2  VAL  94          1HG2      VAL  94   8.723  -6.444  -6.444
  763   2HG2  VAL  94          3HG2      VAL  94   7.579  -7.254  -7.254
  764   3HG2  VAL  94          2HG2      VAL  94   7.360  -5.550  -5.550
  765    H    CYS  95           H        CYS  95   4.647  -6.647  -6.647
  766    HA   CYS  95           HA       CYS  95   5.699  -7.957  -7.957
  767   1HB   CYS  95          2HB       CYS  95   5.176  -5.620  -5.620
  768   2HB   CYS  95          1HB       CYS  95   3.529  -5.837  -5.837
  769    HG   CYS  95           HG       CYS  95   4.462  -6.666  -6.666
  770    H    GLU  96           H        GLU  96   4.489  -9.656  -9.656
  771    HA   GLU  96           HA       GLU  96   1.972 -10.250 -10.250
  772   1HB   GLU  96          2HB       GLU  96   3.751 -12.190 -12.190
  773   2HB   GLU  96          1HB       GLU  96   2.400 -12.597 -12.597
  774   1HG   GLU  96          2HG       GLU  96   4.492 -10.928 -10.928
  775   2HG   GLU  96          1HG       GLU  96   5.015 -12.550 -12.550
  776    H    GLN  97           H        GLN  97   0.280 -11.359 -11.359
  777    HA   GLN  97           HA       GLN  97   0.655 -10.986 -10.986
  778   1HB   GLN  97          2HB       GLN  97   0.001  -8.732  -8.732
  779   2HB   GLN  97          1HB       GLN  97  -1.614  -9.412  -9.412
  780   1HG   GLN  97          2HG       GLN  97  -0.898  -9.848  -9.848
  781   2HG   GLN  97          1HG       GLN  97   0.334  -8.630  -8.630
  782   1HE2  GLN  97          2HE2      GLN  97  -1.946  -5.928  -5.928
  783   2HE2  GLN  97          1HE2      GLN  97  -0.341  -6.425  -6.425
  784    H    LYS  98           H        LYS  98  -0.637 -12.308 -12.308
  785    HA   LYS  98           HA       LYS  98  -3.180 -13.291 -13.291
  786   1HB   LYS  98          2HB       LYS  98  -2.569 -15.641 -15.641
  787   2HB   LYS  98          1HB       LYS  98  -1.527 -14.975 -14.975
  788   1HG   LYS  98          2HG       LYS  98  -0.070 -14.247 -14.247
  789   2HG   LYS  98          1HG       LYS  98  -0.882 -15.638 -15.638
  790   1HD   LYS  98          2HD       LYS  98   0.230 -16.015 -16.015
  791   2HD   LYS  98          1HD       LYS  98   1.398 -15.872 -15.872
  792   1HE   LYS  98          2HE       LYS  98   0.478 -17.740 -17.740
  793   2HE   LYS  98          1HE       LYS  98  -0.974 -17.739 -17.739
  794   1HZ   LYS  98          3HZ       LYS  98   0.669 -18.118 -18.118
  795   2HZ   LYS  98          2HZ       LYS  98   1.758 -18.596 -18.596
  796   3HZ   LYS  98          1HZ       LYS  98   0.290 -19.427 -19.427
  797    H    LEU  99           H        LEU  99  -4.665 -13.995 -13.995
  798    HA   LEU  99           HA       LEU  99  -4.445 -12.569 -12.569
  799   1HB   LEU  99          2HB       LEU  99  -6.089 -14.986 -14.986
  800   2HB   LEU  99          1HB       LEU  99  -6.266 -14.136 -14.136
  801    HG   LEU  99           HG       LEU  99  -6.318 -12.471 -12.471
  802   1HD1  LEU  99          3HD1      LEU  99  -8.339 -14.570 -14.570
  803   2HD1  LEU  99          2HD1      LEU  99  -8.897 -13.041 -13.041
  804   3HD1  LEU  99          1HD1      LEU  99  -7.780 -14.058 -14.058
  805   1HD2  LEU  99          2HD2      LEU  99  -7.668 -12.557 -12.557
  806   2HD2  LEU  99          1HD2      LEU  99  -6.613 -11.306 -11.306
  807   3HD2  LEU  99          3HD2      LEU  99  -8.253 -11.493 -11.493
  808    H    LEU 100           H        LEU 100  -4.527 -13.631 -13.631
  809    HA   LEU 100           HA       LEU 100  -2.344 -15.622 -15.622
  810   1HB   LEU 100          2HB       LEU 100  -3.583 -13.657 -13.657
  811   2HB   LEU 100          1HB       LEU 100  -2.521 -14.957 -14.957
  812    HG   LEU 100           HG       LEU 100  -1.698 -13.070 -13.070
  813   1HD1  LEU 100          3HD1      LEU 100  -1.774 -12.639 -12.639
  814   2HD1  LEU 100          2HD1      LEU 100  -0.321 -12.118 -12.118
  815   3HD1  LEU 100          1HD1      LEU 100  -1.893 -11.464 -11.464
  816   1HD2  LEU 100          1HD2      LEU 100  -0.296 -14.968 -14.968
  817   2HD2  LEU 100          3HD2      LEU 100  -0.321 -15.018 -15.018
  818   3HD2  LEU 100          2HD2      LEU 100   0.578 -13.750 -13.750
  819    H    LYS 101           H        LYS 101  -5.724 -15.490 -15.490
  820    HA   LYS 101           HA       LYS 101  -5.903 -18.192 -18.192
  821   1HB   LYS 101          2HB       LYS 101  -6.813 -15.794 -15.794
  822   2HB   LYS 101          1HB       LYS 101  -8.118 -16.951 -16.951
  823   1HG   LYS 101          2HG       LYS 101  -5.433 -17.841 -17.841
  824   2HG   LYS 101          1HG       LYS 101  -6.678 -17.220 -17.220
  825   1HD   LYS 101          2HD       LYS 101  -8.240 -18.934 -18.934
  826   2HD   LYS 101          1HD       LYS 101  -7.105 -19.500 -19.500
  827   1HE   LYS 101          2HE       LYS 101  -6.552 -21.003 -21.003
  828   2HE   LYS 101          1HE       LYS 101  -5.521 -19.677 -19.677
  829   1HZ   LYS 101          2HZ       LYS 101  -8.320 -19.930 -19.930
  830   2HZ   LYS 101          1HZ       LYS 101  -7.054 -20.738 -20.738
  831   3HZ   LYS 101          3HZ       LYS 101  -7.053 -19.044 -19.044
  832    H    GLY 102           H        GLY 102  -7.390 -19.363 -19.363
  833   1HA   GLY 102          2HA       GLY 102  -9.045 -19.839 -19.839
  834   2HA   GLY 102          1HA       GLY 102  -9.780 -18.293 -18.293
  835    H    GLU 103           H        GLU 103 -10.199 -17.969 -17.969
  836    HA   GLU 103           HA       GLU 103  -8.225 -16.342 -16.342
  837   1HB   GLU 103          2HB       GLU 103  -7.163 -18.579 -18.579
  838   2HB   GLU 103          1HB       GLU 103  -8.594 -19.062 -19.062
  839   1HG   GLU 103          2HG       GLU 103  -8.183 -17.505 -17.505
  840   2HG   GLU 103          1HG       GLU 103  -7.098 -16.550 -16.550
  841    H    GLY 104           H        GLY 104  -9.163 -15.155 -15.155
  842   1HA   GLY 104          2HA       GLY 104 -11.677 -16.084 -16.084
  843   2HA   GLY 104          1HA       GLY 104 -11.721 -14.553 -14.553
  844    HA   PRO 105           HA       PRO 105 -10.092 -12.731 -12.731
  845   1HB   PRO 105          2HB       PRO 105  -9.256 -10.327 -10.327
  846   2HB   PRO 105          1HB       PRO 105 -10.961 -10.720 -10.720
  847   1HG   PRO 105          2HG       PRO 105  -9.489 -10.519 -10.519
  848   2HG   PRO 105          1HG       PRO 105 -11.227 -10.379 -10.379
  849   1HD   PRO 105          2HD       PRO 105  -9.850 -12.662 -12.662
  850   2HD   PRO 105          1HD       PRO 105 -11.560 -12.572 -12.572
  851    H    LYS 106           H        LYS 106  -7.927 -11.332 -11.332
  852    HA   LYS 106           HA       LYS 106  -5.633 -12.536 -12.536
  853   1HB   LYS 106          2HB       LYS 106  -6.007 -13.748 -13.748
  854   2HB   LYS 106          1HB       LYS 106  -5.925 -12.219 -12.219
  855   1HG   LYS 106          2HG       LYS 106  -3.648 -11.966 -11.966
  856   2HG   LYS 106          1HG       LYS 106  -3.670 -12.997 -12.997
  857   1HD   LYS 106          2HD       LYS 106  -3.735 -14.975 -14.975
  858   2HD   LYS 106          1HD       LYS 106  -4.314 -14.139 -14.139
  859   1HE   LYS 106          2HE       LYS 106  -1.551 -13.872 -13.872
  860   2HE   LYS 106          1HE       LYS 106  -1.947 -14.734 -14.734
  861   1HZ   LYS 106          2HZ       LYS 106  -2.976 -12.456 -12.456
  862   2HZ   LYS 106          1HZ       LYS 106  -1.915 -11.844 -11.844
  863   3HZ   LYS 106          3HZ       LYS 106  -1.302 -12.706 -12.706
  864    H    THR 107           H        THR 107  -4.001 -11.024 -11.024
  865    HA   THR 107           HA       THR 107  -4.362  -8.333  -8.333
  866    HB   THR 107           HB       THR 107  -3.034  -7.791  -7.791
  867    HG1  THR 107           HG1      THR 107  -3.485 -10.047 -10.047
  868   1HG2  THR 107          2HG2      THR 107  -4.985  -6.611  -6.611
  869   2HG2  THR 107          1HG2      THR 107  -6.034  -7.906  -7.906
  870   3HG2  THR 107          3HG2      THR 107  -5.170  -6.889  -6.889
  871    H    SER 108           H        SER 108  -2.582  -7.236  -7.236
  872    HA   SER 108           HA       SER 108   0.142  -8.097  -8.097
  873   1HB   SER 108          2HB       SER 108  -1.030  -8.501  -8.501
  874   2HB   SER 108          1HB       SER 108   0.691  -8.559  -8.559
  875    HG   SER 108           HG       SER 108   0.023 -10.631 -10.631
  876    H    TRP 109           H        TRP 109   1.491  -6.269  -6.269
  877    HA   TRP 109           HA       TRP 109   0.433  -4.118  -4.118
  878   1HB   TRP 109          2HB       TRP 109   0.961  -2.406  -2.406
  879   2HB   TRP 109          1HB       TRP 109  -0.443  -3.415  -3.415
  880    HD1  TRP 109           HD1      TRP 109  -0.355  -5.022  -5.022
  881    HE1  TRP 109           HE1      TRP 109   1.330  -5.358  -5.358
  882    HE3  TRP 109           HE3      TRP 109   3.595  -2.331  -2.331
  883    HZ2  TRP 109           HZ2      TRP 109   3.993  -4.589  -4.589
  884    HZ3  TRP 109           HZ3      TRP 109   5.687  -2.153  -2.153
  885    HH2  TRP 109           HH2      TRP 109   5.897  -3.275  -3.275
  886    H    THR 110           H        THR 110   2.120  -2.253  -2.253
  887    HA   THR 110           HA       THR 110   4.886  -3.352  -3.352
  888    HB   THR 110           HB       THR 110   5.425  -2.734  -2.734
  889    HG1  THR 110           HG1      THR 110   4.104  -1.456  -1.456
  890   1HG2  THR 110          1HG2      THR 110   3.563  -4.657  -4.657
  891   2HG2  THR 110          3HG2      THR 110   2.677  -3.617  -3.617
  892   3HG2  THR 110          2HG2      THR 110   4.229  -4.303  -4.303
  893    H    MET 111           H        MET 111   6.504  -1.533  -1.533
  894    HA   MET 111           HA       MET 111   5.564   1.196   1.196
  895   1HB   MET 111          2HB       MET 111   7.046   1.422   1.422
  896   2HB   MET 111          1HB       MET 111   5.705   0.310   0.310
  897   1HG   MET 111          2HG       MET 111   7.084  -1.582  -1.582
  898   2HG   MET 111          1HG       MET 111   8.350  -0.719  -0.719
  899   1HE   MET 111          1HE       MET 111   6.078  -0.349  -0.349
  900   2HE   MET 111          3HE       MET 111   7.032  -0.628  -0.628
  901   3HE   MET 111          2HE       MET 111   6.847   1.003   1.003
  902    H    GLU 112           H        GLU 112   6.979   2.660   2.660
  903    HA   GLU 112           HA       GLU 112   9.643   1.637   1.637
  904   1HB   GLU 112          2HB       GLU 112   8.007   1.599   1.599
  905   2HB   GLU 112          1HB       GLU 112   7.761   3.331   3.331
  906   1HG   GLU 112          2HG       GLU 112   9.916   3.866   3.866
  907   2HG   GLU 112          1HG       GLU 112  10.545   2.261   2.261
  908    H    LEU 113           H        LEU 113  11.269   3.249   3.249
  909    HA   LEU 113           HA       LEU 113  10.545   5.819   5.819
  910   1HB   LEU 113          2HB       LEU 113  12.401   3.896   3.896
  911   2HB   LEU 113          1HB       LEU 113  13.392   5.032   5.032
  912    HG   LEU 113           HG       LEU 113  13.263   5.434   5.434
  913   1HD1  LEU 113          1HD1      LEU 113  13.947   7.192   7.192
  914   2HD1  LEU 113          3HD1      LEU 113  12.263   7.660   7.660
  915   3HD1  LEU 113          2HD1      LEU 113  13.036   7.864   7.864
  916   1HD2  LEU 113          3HD2      LEU 113  10.492   5.201   5.201
  917   2HD2  LEU 113          2HD2      LEU 113  11.287   5.640   5.640
  918   3HD2  LEU 113          1HD2      LEU 113  10.766   6.897   6.897
  919    H    THR 114           H        THR 114  11.204   7.735   7.735
  920    HA   THR 114           HA       THR 114  11.994   7.348   7.348
  921    HB   THR 114           HB       THR 114  11.362   9.629   9.629
  922    HG1  THR 114           HG1      THR 114  11.063  11.038  11.038
  923   1HG2  THR 114          2HG2      THR 114   9.525   7.937   7.937
  924   2HG2  THR 114          1HG2      THR 114   9.443   8.620   8.620
  925   3HG2  THR 114          3HG2      THR 114   9.077   9.628   9.628
  926    H    ASN 115           H        ASN 115  13.728   8.713   8.713
  927    HA   ASN 115           HA       ASN 115  16.193   8.421   8.421
  928   1HB   ASN 115          2HB       ASN 115  15.509  10.276  10.276
  929   2HB   ASN 115          1HB       ASN 115  17.141   9.829   9.829
  930   1HD2  ASN 115          2HD2      ASN 115  16.829   7.244   7.244
  931   2HD2  ASN 115          1HD2      ASN 115  17.558   8.733   8.733
  932    H    ASP 116           H        ASP 116  13.803  10.949  10.949
  933    HA   ASP 116           HA       ASP 116  15.652  12.932  12.932
  934   1HB   ASP 116          2HB       ASP 116  12.630  12.899  12.899
  935   2HB   ASP 116          1HB       ASP 116  13.565  14.269  14.269
  936    H    GLY 117           H        GLY 117  13.377  10.509  10.509
  937   1HA   GLY 117          2HA       GLY 117  14.017   9.684   9.684
  938   2HA   GLY 117          1HA       GLY 117  13.913  11.377  11.377
  939    H    GLU 118           H        GLU 118  11.515  11.280  11.280
  940    HA   GLU 118           HA       GLU 118   9.388  11.352  11.352
  941   1HB   GLU 118          2HB       GLU 118   9.267  10.627  10.627
  942   2HB   GLU 118          1HB       GLU 118   7.906  11.161  11.161
  943   1HG   GLU 118          2HG       GLU 118   9.213  13.277  13.277
  944   2HG   GLU 118          1HG       GLU 118  10.372  12.755  12.755
  945    H    LEU 119           H        LEU 119   7.455   9.729   9.729
  946    HA   LEU 119           HA       LEU 119   8.404   6.930   6.930
  947   1HB   LEU 119          2HB       LEU 119   8.819   7.657   7.657
  948   2HB   LEU 119          1HB       LEU 119   7.090   7.929   7.929
  949    HG   LEU 119           HG       LEU 119   8.222   5.257   5.257
  950   1HD1  LEU 119          2HD1      LEU 119   7.982   6.509   6.509
  951   2HD1  LEU 119          1HD1      LEU 119   7.705   4.776   4.776
  952   3HD1  LEU 119          3HD1      LEU 119   9.256   5.473   5.473
  953   1HD2  LEU 119          3HD2      LEU 119   5.580   6.336   6.336
  954   2HD2  LEU 119          2HD2      LEU 119   5.912   5.183   5.183
  955   3HD2  LEU 119          1HD2      LEU 119   5.999   4.668   4.668
  956    H    ILE 120           H        ILE 120   6.941   6.219   6.219
  957    HA   ILE 120           HA       ILE 120   4.066   6.955   6.955
  958    HB   ILE 120           HB       ILE 120   4.904   7.447   7.447
  959   1HG1  ILE 120          2HG1      ILE 120   3.233   4.917   4.917
  960   2HG1  ILE 120          1HG1      ILE 120   2.580   6.506   6.506
  961   1HG2  ILE 120          1HG2      ILE 120   6.036   4.711   4.711
  962   2HG2  ILE 120          3HG2      ILE 120   5.465   5.159   5.159
  963   3HG2  ILE 120          2HG2      ILE 120   6.707   6.126   6.126
  964   1HD1  ILE 120          1HD1      ILE 120   4.052   5.840   5.840
  965   2HD1  ILE 120          3HD1      ILE 120   2.300   5.964   5.964
  966   3HD1  ILE 120          2HD1      ILE 120   3.310   7.388   7.388
  967    H    LEU 121           H        LEU 121   2.491   5.187   5.187
  968    HA   LEU 121           HA       LEU 121   3.716   2.501   2.501
  969   1HB   LEU 121          2HB       LEU 121   3.332   3.607   3.607
  970   2HB   LEU 121          1HB       LEU 121   1.631   3.797   3.797
  971    HG   LEU 121           HG       LEU 121   2.336   1.045   1.045
  972   1HD1  LEU 121          3HD1      LEU 121   4.161   1.839   1.839
  973   2HD1  LEU 121          2HD1      LEU 121   2.826   1.808   1.808
  974   3HD1  LEU 121          1HD1      LEU 121   3.287   0.336   0.336
  975   1HD2  LEU 121          3HD2      LEU 121   0.641   2.455   2.455
  976   2HD2  LEU 121          2HD2      LEU 121   0.094   1.825   1.825
  977   3HD2  LEU 121          1HD2      LEU 121   0.622   0.715   0.715
  978    H    THR 122           H        THR 122   2.521   0.855   0.855
  979    HA   THR 122           HA       THR 122  -0.167   1.579   1.579
  980    HB   THR 122           HB       THR 122   0.798  -0.788  -0.788
  981    HG1  THR 122           HG1      THR 122   2.710   0.030   0.030
  982   1HG2  THR 122          1HG2      THR 122   0.359   2.073   2.073
  983   2HG2  THR 122          3HG2      THR 122   0.810   0.804   0.804
  984   3HG2  THR 122          2HG2      THR 122  -0.705   0.688   0.688
  985    H    MET 123           H        MET 123  -1.597  -0.479  -0.479
  986    HA   MET 123           HA       MET 123  -0.920  -2.421  -2.421
  987   1HB   MET 123          2HB       MET 123  -3.436  -0.726  -0.726
  988   2HB   MET 123          1HB       MET 123  -3.064  -2.033  -2.033
  989   1HG   MET 123          2HG       MET 123  -0.871  -0.675  -0.675
  990   2HG   MET 123          1HG       MET 123  -1.778   0.673   0.673
  991   1HE   MET 123          1HE       MET 123  -1.146  -1.861  -1.861
  992   2HE   MET 123          3HE       MET 123  -1.578  -1.137  -1.137
  993   3HE   MET 123          2HE       MET 123  -2.691  -2.244  -2.244
  994    H    THR 124           H        THR 124  -2.636  -4.142  -4.142
  995    HA   THR 124           HA       THR 124  -4.307  -4.429  -4.429
  996    HB   THR 124           HB       THR 124  -2.419  -6.660  -6.660
  997    HG1  THR 124           HG1      THR 124  -1.084  -5.865  -5.865
  998   1HG2  THR 124          2HG2      THR 124  -4.473  -7.072  -7.072
  999   2HG2  THR 124          1HG2      THR 124  -3.898  -5.889  -5.889
 1000   3HG2  THR 124          3HG2      THR 124  -2.991  -7.378  -7.378
 1001    H    ALA 125           H        ALA 125  -5.932  -5.980  -5.980
 1002    HA   ALA 125           HA       ALA 125  -6.037  -7.597  -7.597
 1003   1HB   ALA 125          2HB       ALA 125  -6.860  -5.127  -5.127
 1004   2HB   ALA 125          1HB       ALA 125  -8.323  -5.691  -5.691
 1005   3HB   ALA 125          3HB       ALA 125  -7.759  -6.495  -6.495
 1006    H    ASP 126           H        ASP 126  -6.324  -9.365  -9.365
 1007    HA   ASP 126           HA       ASP 126  -7.644 -10.983 -10.983
 1008   1HB   ASP 126          2HB       ASP 126  -9.594  -9.234  -9.234
 1009   2HB   ASP 126          1HB       ASP 126 -10.028  -9.458  -9.458
 1010    H    ASP 127           H        ASP 127  -9.003  -8.073  -8.073
 1011    HA   ASP 127           HA       ASP 127  -7.230  -8.455  -8.455
 1012   1HB   ASP 127          2HB       ASP 127 -10.204  -8.897  -8.897
 1013   2HB   ASP 127          1HB       ASP 127  -9.407  -8.239  -8.239
 1014    H    VAL 128           H        VAL 128  -7.863  -6.443  -6.443
 1015    HA   VAL 128           HA       VAL 128  -8.468  -4.126  -4.126
 1016    HB   VAL 128           HB       VAL 128  -9.273  -2.949  -2.949
 1017   1HG1  VAL 128          3HG1      VAL 128 -10.640  -4.827  -4.827
 1018   2HG1  VAL 128          2HG1      VAL 128 -10.648  -5.585  -5.585
 1019   3HG1  VAL 128          1HG1      VAL 128 -11.335  -3.975  -3.975
 1020   1HG2  VAL 128          3HG2      VAL 128  -7.931  -5.189  -5.189
 1021   2HG2  VAL 128          2HG2      VAL 128  -8.354  -3.598  -3.598
 1022   3HG2  VAL 128          1HG2      VAL 128  -9.550  -4.892  -4.892
 1023    H    VAL 129           H        VAL 129  -7.421  -2.084  -2.084
 1024    HA   VAL 129           HA       VAL 129  -4.871  -2.722  -2.722
 1025    HB   VAL 129           HB       VAL 129  -5.096  -1.991  -1.991
 1026   1HG1  VAL 129          1HG1      VAL 129  -3.913  -0.012  -0.012
 1027   2HG1  VAL 129          3HG1      VAL 129  -2.750  -1.081  -1.081
 1028   3HG1  VAL 129          2HG1      VAL 129  -2.832  -1.006  -1.006
 1029   1HG2  VAL 129          1HG2      VAL 129  -3.589  -3.853  -3.853
 1030   2HG2  VAL 129          3HG2      VAL 129  -4.311  -4.127  -4.127
 1031   3HG2  VAL 129          2HG2      VAL 129  -2.760  -3.300  -3.300
 1032    H    CYS 130           H        CYS 130  -4.694  -1.237  -1.237
 1033    HA   CYS 130           HA       CYS 130  -5.996   1.411   1.411
 1034   1HB   CYS 130          2HB       CYS 130  -6.126  -0.228  -0.228
 1035   2HB   CYS 130          1HB       CYS 130  -4.673   0.662   0.662
 1036    HG   CYS 130           HG       CYS 130  -6.507   2.788   2.788
 1037    H    THR 131           H        THR 131  -4.684   3.040   3.040
 1038    HA   THR 131           HA       THR 131  -1.777   2.864   2.864
 1039    HB   THR 131           HB       THR 131  -3.102   4.244   4.244
 1040    HG1  THR 131           HG1      THR 131  -3.156   2.170   2.170
 1041   1HG2  THR 131          2HG2      THR 131  -0.316   4.134   4.134
 1042   2HG2  THR 131          1HG2      THR 131  -0.528   4.049   4.049
 1043   3HG2  THR 131          3HG2      THR 131  -1.146   5.436   5.436
 1044    H    ARG 132           H        ARG 132  -1.029   4.452   4.452
 1045    HA   ARG 132           HA       ARG 132  -2.414   7.086   7.086
 1046   1HB   ARG 132          2HB       ARG 132  -1.406   5.529   5.529
 1047   2HB   ARG 132          1HB       ARG 132  -2.110   7.143   7.143
 1048   1HG   ARG 132          2HG       ARG 132  -4.226   6.344   6.344
 1049   2HG   ARG 132          1HG       ARG 132  -3.811   5.191   5.191
 1050   1HD   ARG 132          2HD       ARG 132  -3.086   3.564   3.564
 1051   2HD   ARG 132          1HD       ARG 132  -2.953   4.745   4.745
 1052    HE   ARG 132           HE       ARG 132  -5.332   3.288   3.288
 1053   1HH1  ARG 132          1HH2      ARG 132  -6.457   5.837   5.837
 1054   2HH1  ARG 132          2HH2      ARG 132  -6.919   6.552   6.552
 1055   1HH2  ARG 132          2HH1      ARG 132  -4.937   4.443   4.443
 1056   2HH2  ARG 132          1HH1      ARG 132  -6.058   5.763   5.763
 1057    H    VAL 133           H        VAL 133  -0.830   8.382   8.382
 1058    HA   VAL 133           HA       VAL 133   2.004   7.831   7.831
 1059    HB   VAL 133           HB       VAL 133   0.621  10.389  10.389
 1060   1HG1  VAL 133          1HG1      VAL 133   3.455   9.448   9.448
 1061   2HG1  VAL 133          3HG1      VAL 133   2.929  10.422  10.422
 1062   3HG1  VAL 133          2HG1      VAL 133   2.812  11.069  11.069
 1063   1HG2  VAL 133          3HG2      VAL 133  -0.014   8.408   8.408
 1064   2HG2  VAL 133          2HG2      VAL 133   0.930   9.577   9.577
 1065   3HG2  VAL 133          1HG2      VAL 133   1.696   8.110   8.110
 1066    H    TYR 134           H        TYR 134   3.397   8.574   8.574
 1067    HA   TYR 134           HA       TYR 134   2.238  10.454  10.454
 1068   1HB   TYR 134          2HB       TYR 134   3.837   7.938   7.938
 1069   2HB   TYR 134          1HB       TYR 134   3.953   9.223   9.223
 1070    HD1  TYR 134           HD2      TYR 134   2.016   9.900   9.900
 1071    HD2  TYR 134           HD1      TYR 134   1.752   6.700   6.700
 1072    HE1  TYR 134           HE2      TYR 134  -0.127   9.175   9.175
 1073    HE2  TYR 134           HE1      TYR 134  -0.392   5.973   5.973
 1074    HH   TYR 134           HH       TYR 134  -2.292   7.668   7.668
 1075    H    VAL 135           H        VAL 135   3.366  12.282  12.282
 1076    HA   VAL 135           HA       VAL 135   6.194  12.309  12.309
 1077    HB   VAL 135           HB       VAL 135   4.031  14.022  14.022
 1078   1HG1  VAL 135          2HG1      VAL 135   4.488  15.192  15.192
 1079   2HG1  VAL 135          1HG1      VAL 135   6.098  15.576  15.576
 1080   3HG1  VAL 135          3HG1      VAL 135   4.670  16.221  16.221
 1081   1HG2  VAL 135          3HG2      VAL 135   7.010  14.100  14.100
 1082   2HG2  VAL 135          2HG2      VAL 135   5.743  13.657  13.657
 1083   3HG2  VAL 135          1HG2      VAL 135   5.961  15.344  15.344
 1084    H    ARG 136           H        ARG 136   7.799  12.907  12.907
 1085    HA   ARG 136           HA       ARG 136   7.392  12.459  12.459
 1086   1HB   ARG 136          2HB       ARG 136   9.527  13.476  13.476
 1087   2HB   ARG 136          1HB       ARG 136   9.446  14.394  14.394
 1088   1HG   ARG 136          2HG       ARG 136   9.855  12.551  12.551
 1089   2HG   ARG 136          1HG       ARG 136   9.215  11.418  11.418
 1090   1HD   ARG 136          2HD       ARG 136  11.887  12.841  12.841
 1091   2HD   ARG 136          1HD       ARG 136  11.595  11.105  11.105
 1092    HE   ARG 136           HE       ARG 136  10.398  11.857  11.857
 1093   1HH1  ARG 136          2HH1      ARG 136  13.274  10.617  10.617
 1094   2HH1  ARG 136          1HH1      ARG 136  14.230  11.417  11.417
 1095   1HH2  ARG 136          1HH2      ARG 136  11.716  13.633  13.633
 1096   2HH2  ARG 136          2HH2      ARG 136  13.346  13.126  13.126
 1097    H    GLU 137           HN       GLU 137   6.494  13.496  13.496
 1098    HA   GLU 137           HA       GLU 137   4.902  15.767  15.767
 1099   1HB   GLU 137          2HB       GLU 137   5.344  14.017  14.017
 1100   2HB   GLU 137          1HB       GLU 137   6.457  15.243  15.243
 1101   1HG   GLU 137          2HG       GLU 137   3.556  15.761  15.761
 1102   2HG   GLU 137          1HG       GLU 137   4.147  15.422  15.422

  Start of MODEL   27
    1   1H    PRO   1          1H        PRO   1 -16.850   6.979   6.979
    2   2H    PRO   1          2H        PRO   1 -16.290   6.272   6.272
    3    HA   PRO   1           HA       PRO   1 -16.576   4.242   4.242
    4   1HB   PRO   1          2HB       PRO   1 -19.257   4.303   4.303
    5   2HB   PRO   1          1HB       PRO   1 -18.683   3.587   3.587
    6   1HG   PRO   1          2HG       PRO   1 -20.225   5.977   5.977
    7   2HG   PRO   1          1HG       PRO   1 -19.661   5.249   5.249
    8   1HD   PRO   1          1HD       PRO   1 -18.703   7.631   7.631
    9   2HD   PRO   1          2HD       PRO   1 -18.128   6.885   6.885
   10    H    ASN   2           H        ASN   2 -15.441   6.092   6.092
   11    HA   ASN   2           HA       ASN   2 -15.980   4.760   4.760
   12   1HB   ASN   2          2HB       ASN   2 -16.586   7.683   7.683
   13   2HB   ASN   2          1HB       ASN   2 -16.214   7.058   7.058
   14   1HD2  ASN   2          2HD2      ASN   2 -19.353   5.470   5.470
   15   2HD2  ASN   2          1HD2      ASN   2 -17.802   5.714   5.714
   16    H    PHE   3           H        PHE   3 -14.050   4.464   4.464
   17    HA   PHE   3           HA       PHE   3 -11.719   6.066   6.066
   18   1HB   PHE   3          2HB       PHE   3 -11.944   3.509   3.509
   19   2HB   PHE   3          1HB       PHE   3 -10.431   4.291   4.291
   20    HD1  PHE   3           HD1      PHE   3 -13.564   3.252   3.252
   21    HD2  PHE   3           HD2      PHE   3  -9.267   3.316   3.316
   22    HE1  PHE   3           HE1      PHE   3 -13.502   2.008   2.008
   23    HE2  PHE   3           HE2      PHE   3  -9.210   2.063   2.063
   24    HZ   PHE   3           HZ       PHE   3 -11.335   1.397   1.397
   25    H    SER   4           H        SER   4 -13.952   5.897   5.897
   26    HA   SER   4           HA       SER   4 -12.287   6.388   6.388
   27   1HB   SER   4          2HB       SER   4 -14.307   7.029   7.029
   28   2HB   SER   4          1HB       SER   4 -14.695   5.695   5.695
   29    HG   SER   4           HG       SER   4 -15.562   7.154   7.154
   30    H    GLY   5           H        GLY   5 -11.032   8.078   8.078
   31   1HA   GLY   5          2HA       GLY   5 -11.715  10.700  10.700
   32   2HA   GLY   5          1HA       GLY   5 -11.344  10.630  10.630
   33    H    ASN   6           H        ASN   6  -9.576  12.167  12.167
   34    HA   ASN   6           HA       ASN   6  -7.273  10.618  10.618
   35   1HB   ASN   6          2HB       ASN   6  -7.931  13.559  13.559
   36   2HB   ASN   6          1HB       ASN   6  -6.249  13.049  13.049
   37   1HD2  ASN   6          2HD2      ASN   6  -7.001  11.505  11.505
   38   2HD2  ASN   6          1HD2      ASN   6  -6.328  10.992  10.992
   39    H    TRP   7           H        TRP   7  -5.124  11.258  11.258
   40    HA   TRP   7           HA       TRP   7  -5.652  11.716  11.716
   41   1HB   TRP   7          2HB       TRP   7  -4.501   9.157   9.157
   42   2HB   TRP   7          1HB       TRP   7  -4.467   9.590   9.590
   43    HD1  TRP   7           HD1      TRP   7  -6.692   8.181   8.181
   44    HE1  TRP   7           HE1      TRP   7  -9.080   7.815   7.815
   45    HE3  TRP   7           HE3      TRP   7  -6.239  10.668  10.668
   46    HZ2  TRP   7           HZ2      TRP   7 -10.584   8.529   8.529
   47    HZ3  TRP   7           HZ3      TRP   7  -8.154  10.853  10.853
   48    HH2  TRP   7           HH2      TRP   7 -10.308   9.783   9.783
   49    H    LYS   8           H        LYS   8  -4.182  13.085  13.085
   50    HA   LYS   8           HA       LYS   8  -1.435  12.985  12.985
   51   1HB   LYS   8          2HB       LYS   8  -3.013  15.270  15.270
   52   2HB   LYS   8          1HB       LYS   8  -1.275  15.355  15.355
   53   1HG   LYS   8          2HG       LYS   8  -1.725  14.770  14.770
   54   2HG   LYS   8          1HG       LYS   8  -3.446  14.958  14.958
   55   1HD   LYS   8          2HD       LYS   8  -2.767  17.283  17.283
   56   2HD   LYS   8          1HD       LYS   8  -1.280  17.051  17.051
   57   1HE   LYS   8          2HE       LYS   8  -2.634  16.678  16.678
   58   2HE   LYS   8          1HE       LYS   8  -4.099  16.989  16.989
   59   1HZ   LYS   8          2HZ       LYS   8  -3.257  19.192  19.192
   60   2HZ   LYS   8          1HZ       LYS   8  -1.853  18.893  18.893
   61   3HZ   LYS   8          3HZ       LYS   8  -3.360  18.972  18.972
   62    H    ILE   9           H        ILE   9  -0.132  11.943  11.943
   63    HA   ILE   9           HA       ILE   9  -0.704  11.206  11.206
   64    HB   ILE   9           HB       ILE   9   0.978  10.099  10.099
   65   1HG1  ILE   9          2HG1      ILE   9   2.222  11.459  11.459
   66   2HG1  ILE   9          1HG1      ILE   9   1.275   9.972   9.972
   67   1HG2  ILE   9          3HG2      ILE   9   1.786  12.716  12.716
   68   2HG2  ILE   9          2HG2      ILE   9   3.143  12.023  12.023
   69   3HG2  ILE   9          1HG2      ILE   9   2.524  11.215  11.215
   70   1HD1  ILE   9          3HD1      ILE   9   3.196   9.401   9.401
   71   2HD1  ILE   9          2HD1      ILE   9   4.094  10.388  10.388
   72   3HD1  ILE   9          1HD1      ILE   9   3.280   8.921   8.921
   73    H    ILE  10           H        ILE  10   0.186  11.906  11.906
   74    HA   ILE  10           HA       ILE  10   1.105  14.743  14.743
   75    HB   ILE  10           HB       ILE  10  -0.256  15.076  15.076
   76   1HG1  ILE  10          2HG1      ILE  10  -2.167  13.112  13.112
   77   2HG1  ILE  10          1HG1      ILE  10  -0.731  12.180  12.180
   78   1HG2  ILE  10          3HG2      ILE  10  -1.591  14.225  14.225
   79   2HG2  ILE  10          2HG2      ILE  10  -2.544  14.812  14.812
   80   3HG2  ILE  10          1HG2      ILE  10  -1.331  15.855  15.855
   81   1HD1  ILE  10          1HD1      ILE  10   0.442  13.243  13.243
   82   2HD1  ILE  10          3HD1      ILE  10  -1.098  13.971  13.971
   83   3HD1  ILE  10          2HD1      ILE  10  -0.918  12.216  12.216
   84    H    ARG  11           H        ARG  11   1.145  11.516  11.516
   85    HA   ARG  11           HA       ARG  11   3.740  12.198  12.198
   86   1HB   ARG  11          2HB       ARG  11   1.232  11.447  11.447
   87   2HB   ARG  11          1HB       ARG  11   2.736  10.723  10.723
   88   1HG   ARG  11          2HG       ARG  11   3.705  12.826  12.826
   89   2HG   ARG  11          1HG       ARG  11   2.523  13.690  13.690
   90   1HD   ARG  11          2HD       ARG  11   0.768  13.267  13.267
   91   2HD   ARG  11          1HD       ARG  11   1.774  12.133  12.133
   92    HE   ARG  11           HE       ARG  11   1.843  15.034  15.034
   93   1HH1  ARG  11          1HH2      ARG  11   4.374  15.497  15.497
   94   2HH1  ARG  11          2HH2      ARG  11   5.197  14.631  14.631
   95   1HH2  ARG  11          2HH1      ARG  11   2.573  12.437  12.437
   96   2HH2  ARG  11          1HH1      ARG  11   4.177  12.899  12.899
   97    H    SER  12           H        SER  12   4.739  10.060  10.060
   98    HA   SER  12           HA       SER  12   3.823   7.509   7.509
   99   1HB   SER  12          2HB       SER  12   4.089   8.114   8.114
  100   2HB   SER  12          1HB       SER  12   5.558   9.027   9.027
  101    HG   SER  12           HG       SER  12   5.852   6.898   6.898
  102    H    GLU  13           H        GLU  13   5.454   5.854   5.854
  103    HA   GLU  13           HA       GLU  13   8.055   6.697   6.697
  104   1HB   GLU  13          2HB       GLU  13   7.618   5.402   5.402
  105   2HB   GLU  13          1HB       GLU  13   6.685   6.890   6.890
  106   1HG   GLU  13          2HG       GLU  13   5.246   4.695   4.695
  107   2HG   GLU  13          1HG       GLU  13   5.683   4.277   4.277
  108    H    ASN  14           H        ASN  14   9.318   4.654   4.654
  109    HA   ASN  14           HA       ASN  14  10.220   2.564   2.564
  110   1HB   ASN  14          2HB       ASN  14   7.428   1.830   1.830
  111   2HB   ASN  14          1HB       ASN  14   8.706   0.750   0.750
  112   1HD2  ASN  14          2HD2      ASN  14   6.198   2.179   2.179
  113   2HD2  ASN  14          1HD2      ASN  14   5.899   2.213   2.213
  114    H    PHE  15           H        PHE  15   9.984   4.746   4.746
  115    HA   PHE  15           HA       PHE  15   9.285   3.576   3.576
  116   1HB   PHE  15          2HB       PHE  15   9.711   6.082   6.082
  117   2HB   PHE  15          1HB       PHE  15  11.420   5.692   5.692
  118    HD1  PHE  15           HD2      PHE  15  11.925   4.187   4.187
  119    HD2  PHE  15           HD1      PHE  15   8.533   6.768   6.768
  120    HE1  PHE  15           HE2      PHE  15  11.584   4.254   4.254
  121    HE2  PHE  15           HE1      PHE  15   8.208   6.821   6.821
  122    HZ   PHE  15           HZ       PHE  15   9.726   5.556   5.556
  123    H    GLU  16           H        GLU  16  12.532   4.307   4.307
  124    HA   GLU  16           HA       GLU  16  13.950   2.727   2.727
  125   1HB   GLU  16          2HB       GLU  16  15.811   2.813   2.813
  126   2HB   GLU  16          1HB       GLU  16  15.086   4.394   4.394
  127   1HG   GLU  16          2HG       GLU  16  13.530   3.510   3.510
  128   2HG   GLU  16          1HG       GLU  16  15.057   2.719   2.719
  129    H    GLU  17           H        GLU  17  12.294   1.861   1.861
  130    HA   GLU  17           HA       GLU  17  13.534  -0.669  -0.669
  131   1HB   GLU  17          2HB       GLU  17  10.736   0.257   0.257
  132   2HB   GLU  17          1HB       GLU  17  11.572  -1.112  -1.112
  133   1HG   GLU  17          2HG       GLU  17  13.447   0.636   0.636
  134   2HG   GLU  17          1HG       GLU  17  12.157   1.816   1.816
  135    H    LEU  18           H        LEU  18  10.740   0.302   0.302
  136    HA   LEU  18           HA       LEU  18  10.144  -2.444  -2.444
  137   1HB   LEU  18          2HB       LEU  18   8.350  -0.727  -0.727
  138   2HB   LEU  18          1HB       LEU  18   9.043   0.172   0.172
  139    HG   LEU  18           HG       LEU  18   8.710  -1.836  -1.836
  140   1HD1  LEU  18          3HD1      LEU  18   7.836  -2.936  -2.936
  141   2HD1  LEU  18          2HD1      LEU  18   6.840  -3.373  -3.373
  142   3HD1  LEU  18          1HD1      LEU  18   8.561  -3.756  -3.756
  143   1HD2  LEU  18          3HD2      LEU  18   6.936   0.082   0.082
  144   2HD2  LEU  18          2HD2      LEU  18   6.540  -1.243  -1.243
  145   3HD2  LEU  18          1HD2      LEU  18   6.030  -1.310  -1.310
  146    H    LEU  19           H        LEU  19  12.294   0.004   0.004
  147    HA   LEU  19           HA       LEU  19  12.344  -0.983  -0.983
  148   1HB   LEU  19          2HB       LEU  19  13.766   1.237   1.237
  149   2HB   LEU  19          1HB       LEU  19  14.207   0.791   0.791
  150    HG   LEU  19           HG       LEU  19  12.362   2.695   2.695
  151   1HD1  LEU  19          1HD1      LEU  19  13.422   2.113   2.113
  152   2HD1  LEU  19          3HD1      LEU  19  12.149   0.916   0.916
  153   3HD1  LEU  19          2HD1      LEU  19  11.740   2.627   2.627
  154   1HD2  LEU  19          2HD2      LEU  19  10.736   0.197   0.197
  155   2HD2  LEU  19          1HD2      LEU  19  10.694   1.114   1.114
  156   3HD2  LEU  19          3HD2      LEU  19  10.109   1.844   1.844
  157    H    LYS  20           H        LYS  20  13.964  -1.436  -1.436
  158    HA   LYS  20           HA       LYS  20  16.382  -2.615  -2.615
  159   1HB   LYS  20          2HB       LYS  20  15.449  -2.871  -2.871
  160   2HB   LYS  20          1HB       LYS  20  17.086  -3.075  -3.075
  161   1HG   LYS  20          2HG       LYS  20  16.113  -0.466  -0.466
  162   2HG   LYS  20          1HG       LYS  20  15.874  -0.703  -0.703
  163   1HD   LYS  20          2HD       LYS  20  18.494  -1.176  -1.176
  164   2HD   LYS  20          1HD       LYS  20  18.108   0.266   0.266
  165   1HE   LYS  20          2HE       LYS  20  17.658  -2.295  -2.295
  166   2HE   LYS  20          1HE       LYS  20  19.343  -1.933  -1.933
  167   1HZ   LYS  20          3HZ       LYS  20  19.048   0.247   0.247
  168   2HZ   LYS  20          2HZ       LYS  20  17.444  -0.147  -0.147
  169   3HZ   LYS  20          1HZ       LYS  20  18.731  -1.004  -1.004
  170    H    VAL  21           H        VAL  21  13.263  -3.601  -3.601
  171    HA   VAL  21           HA       VAL  21  13.887  -6.445  -6.445
  172    HB   VAL  21           HB       VAL  21  12.114  -5.360  -5.360
  173   1HG1  VAL  21          1HG1      VAL  21  11.318  -3.817  -3.817
  174   2HG1  VAL  21          3HG1      VAL  21  10.515  -5.191  -5.191
  175   3HG1  VAL  21          2HG1      VAL  21  10.032  -4.650  -4.650
  176   1HG2  VAL  21          3HG2      VAL  21  11.352  -7.549  -7.549
  177   2HG2  VAL  21          2HG2      VAL  21  11.943  -7.726  -7.726
  178   3HG2  VAL  21          1HG2      VAL  21  10.323  -7.093  -7.093
  179    H    LEU  22           H        LEU  22  12.264  -4.212  -4.212
  180    HA   LEU  22           HA       LEU  22  11.403  -6.087  -6.087
  181   1HB   LEU  22          2HB       LEU  22  11.701  -3.161  -3.161
  182   2HB   LEU  22          1HB       LEU  22  11.822  -3.705  -3.705
  183    HG   LEU  22           HG       LEU  22   9.634  -4.731  -4.731
  184   1HD1  LEU  22          1HD1      LEU  22   9.846  -5.508  -5.508
  185   2HD1  LEU  22          3HD1      LEU  22   9.513  -3.857  -3.857
  186   3HD1  LEU  22          2HD1      LEU  22   8.292  -4.765  -4.765
  187   1HD2  LEU  22          3HD2      LEU  22   9.980  -2.156  -2.156
  188   2HD2  LEU  22          2HD2      LEU  22   8.350  -2.759  -2.759
  189   3HD2  LEU  22          1HD2      LEU  22   9.310  -2.111  -2.111
  190    H    GLY  23           H        GLY  23  14.116  -3.848  -3.848
  191   1HA   GLY  23          2HA       GLY  23  15.506  -5.350  -5.350
  192   2HA   GLY  23          1HA       GLY  23  15.872  -3.694  -3.694
  193    H    VAL  24           H        VAL  24  18.041  -4.012  -4.012
  194    HA   VAL  24           HA       VAL  24  18.657  -5.281  -5.281
  195    HB   VAL  24           HB       VAL  24  20.528  -6.637  -6.637
  196   1HG1  VAL  24          1HG1      VAL  24  18.207  -7.548  -7.548
  197   2HG1  VAL  24          3HG1      VAL  24  17.853  -7.382  -7.382
  198   3HG1  VAL  24          2HG1      VAL  24  19.134  -8.469  -8.469
  199   1HG2  VAL  24          3HG2      VAL  24  19.183  -5.792  -5.792
  200   2HG2  VAL  24          2HG2      VAL  24  20.848  -5.469  -5.469
  201   3HG2  VAL  24          1HG2      VAL  24  20.342  -7.117  -7.117
  202    H    ASN  25           H        ASN  25  19.881  -3.562  -3.562
  203    HA   ASN  25           HA       ASN  25  22.364  -2.689  -2.689
  204   1HB   ASN  25          2HB       ASN  25  21.040  -2.349  -2.349
  205   2HB   ASN  25          1HB       ASN  25  20.804  -0.761  -0.761
  206   1HD2  ASN  25          2HD2      ASN  25  24.133   0.244   0.244
  207   2HD2  ASN  25          1HD2      ASN  25  22.578   0.684   0.684
  208    H    VAL  26           H        VAL  26  22.483   0.007   0.007
  209    HA   VAL  26           HA       VAL  26  20.633   0.697   0.697
  210    HB   VAL  26           HB       VAL  26  22.576   2.151   2.151
  211   1HG1  VAL  26          3HG1      VAL  26  21.813  -0.370  -0.370
  212   2HG1  VAL  26          2HG1      VAL  26  23.484  -0.667  -0.667
  213   3HG1  VAL  26          1HG1      VAL  26  23.127   0.480   0.480
  214   1HG2  VAL  26          1HG2      VAL  26  24.070   0.339   0.339
  215   2HG2  VAL  26          3HG2      VAL  26  23.959   2.096   2.096
  216   3HG2  VAL  26          2HG2      VAL  26  24.834   1.336   1.336
  217    H    MET  27           H        MET  27  22.612   2.007   2.007
  218    HA   MET  27           HA       MET  27  21.557   4.689   4.689
  219   1HB   MET  27          2HB       MET  27  23.678   4.017   4.017
  220   2HB   MET  27          1HB       MET  27  22.661   3.325   3.325
  221   1HG   MET  27          2HG       MET  27  21.813   5.417   5.417
  222   2HG   MET  27          1HG       MET  27  22.244   6.168   6.168
  223   1HE   MET  27          2HE       MET  27  24.018   7.636   7.636
  224   2HE   MET  27          1HE       MET  27  24.889   6.198   6.198
  225   3HE   MET  27          3HE       MET  27  25.677   7.377   7.377
  226    H    LEU  28           H        LEU  28  20.444   1.728   1.728
  227    HA   LEU  28           HA       LEU  28  18.611   2.729   2.729
  228   1HB   LEU  28          2HB       LEU  28  19.115   0.220   0.220
  229   2HB   LEU  28          1HB       LEU  28  17.441   0.432   0.432
  230    HG   LEU  28           HG       LEU  28  18.732  -0.738  -0.738
  231   1HD1  LEU  28          2HD1      LEU  28  17.314   1.775   1.775
  232   2HD1  LEU  28          1HD1      LEU  28  18.496   1.502   1.502
  233   3HD1  LEU  28          3HD1      LEU  28  17.251   0.296   0.296
  234   1HD2  LEU  28          2HD2      LEU  28  20.844   0.736   0.736
  235   2HD2  LEU  28          1HD2      LEU  28  20.740   0.011   0.011
  236   3HD2  LEU  28          3HD2      LEU  28  20.323   1.709   1.709
  237    H    ARG  29           H        ARG  29  18.058   1.855   1.855
  238    HA   ARG  29           HA       ARG  29  15.291   2.594   2.594
  239   1HB   ARG  29          2HB       ARG  29  17.043   2.759   2.759
  240   2HB   ARG  29          1HB       ARG  29  15.341   2.328   2.328
  241   1HG   ARG  29          2HG       ARG  29  15.945   0.155   0.155
  242   2HG   ARG  29          1HG       ARG  29  16.694   0.447   0.447
  243   1HD   ARG  29          2HD       ARG  29  18.243  -0.542  -0.542
  244   2HD   ARG  29          1HD       ARG  29  18.808   0.968   0.968
  245    HE   ARG  29           HE       ARG  29  17.317   1.106   1.106
  246   1HH1  ARG  29          2HH1      ARG  29  18.579   3.559   3.559
  247   2HH1  ARG  29          1HH1      ARG  29  20.144   3.493   3.493
  248   1HH2  ARG  29          1HH2      ARG  29  20.052   0.065   0.065
  249   2HH2  ARG  29          2HH2      ARG  29  20.978   1.515   1.515
  250    H    LYS  30           H        LYS  30  18.228   4.390   4.390
  251    HA   LYS  30           HA       LYS  30  16.988   6.708   6.708
  252   1HB   LYS  30          2HB       LYS  30  19.497   6.063   6.063
  253   2HB   LYS  30          1HB       LYS  30  19.502   6.834   6.834
  254   1HG   LYS  30          2HG       LYS  30  18.807   8.938   8.938
  255   2HG   LYS  30          1HG       LYS  30  18.471   8.204   8.204
  256   1HD   LYS  30          2HD       LYS  30  20.926   7.572   7.572
  257   2HD   LYS  30          1HD       LYS  30  21.173   8.589   8.589
  258   1HE   LYS  30          2HE       LYS  30  20.188  10.510  10.510
  259   2HE   LYS  30          1HE       LYS  30  20.056   9.486   9.486
  260   1HZ   LYS  30          3HZ       LYS  30  22.556   9.076   9.076
  261   2HZ   LYS  30          2HZ       LYS  30  22.469  10.518  10.518
  262   3HZ   LYS  30          1HZ       LYS  30  22.069  10.514  10.514
  263    H    ILE  31           H        ILE  31  17.723   5.858   5.858
  264    HA   ILE  31           HA       ILE  31  16.877   8.423   8.423
  265    HB   ILE  31           HB       ILE  31  17.130   5.711   5.711
  266   1HG1  ILE  31          2HG1      ILE  31  19.090   8.014   8.014
  267   2HG1  ILE  31          1HG1      ILE  31  19.190   6.743   6.743
  268   1HG2  ILE  31          2HG2      ILE  31  16.781   8.529   8.529
  269   2HG2  ILE  31          1HG2      ILE  31  17.464   7.243   7.243
  270   3HG2  ILE  31          3HG2      ILE  31  15.818   7.101   7.101
  271   1HD1  ILE  31          2HD1      ILE  31  18.985   6.017   6.017
  272   2HD1  ILE  31          1HD1      ILE  31  20.544   6.472   6.472
  273   3HD1  ILE  31          3HD1      ILE  31  19.668   5.083   5.083
  274    H    ALA  32           H        ALA  32  15.268   5.465   5.465
  275    HA   ALA  32           HA       ALA  32  12.815   6.049   6.049
  276   1HB   ALA  32          2HB       ALA  32  13.516   3.724   3.724
  277   2HB   ALA  32          1HB       ALA  32  13.363   4.034   4.034
  278   3HB   ALA  32          3HB       ALA  32  11.933   4.070   4.070
  279    H    VAL  33           H        VAL  33  14.134   6.826   6.826
  280    HA   VAL  33           HA       VAL  33  11.536   7.438   7.438
  281    HB   VAL  33           HB       VAL  33  14.233   8.398   8.398
  282   1HG1  VAL  33          2HG1      VAL  33  12.056   9.130   9.130
  283   2HG1  VAL  33          1HG1      VAL  33  11.777   7.444   7.444
  284   3HG1  VAL  33          3HG1      VAL  33  13.163   8.310   8.310
  285   1HG2  VAL  33          3HG2      VAL  33  13.393   5.630   5.630
  286   2HG2  VAL  33          2HG2      VAL  33  14.945   6.256   6.256
  287   3HG2  VAL  33          1HG2      VAL  33  13.642   5.988   5.988
  288    H    ALA  34           H        ALA  34  14.332   9.168   9.168
  289    HA   ALA  34           HA       ALA  34  13.292  11.818  11.818
  290   1HB   ALA  34          3HB       ALA  34  15.708  11.198  11.198
  291   2HB   ALA  34          2HB       ALA  34  15.207  10.883  10.883
  292   3HB   ALA  34          1HB       ALA  34  15.068  12.508  12.508
  293    H    ALA  35           H        ALA  35  13.136   9.430   9.430
  294    HA   ALA  35           HA       ALA  35  11.799  11.015  11.015
  295   1HB   ALA  35          2HB       ALA  35  11.848   8.034   8.034
  296   2HB   ALA  35          1HB       ALA  35  11.027   8.724   8.724
  297   3HB   ALA  35          3HB       ALA  35  12.772   8.905   8.905
  298    H    ALA  36           H        ALA  36  10.591   8.745   8.745
  299    HA   ALA  36           HA       ALA  36   7.804   9.515   9.515
  300   1HB   ALA  36          1HB       ALA  36   9.233   7.588   7.588
  301   2HB   ALA  36          3HB       ALA  36   7.507   7.911   7.911
  302   3HB   ALA  36          2HB       ALA  36   8.140   7.214   7.214
  303    H    SER  37           H        SER  37   9.382  11.771  11.771
  304    HA   SER  37           HA       SER  37   9.285  12.172  12.172
  305   1HB   SER  37          2HB       SER  37  10.614  13.570  13.570
  306   2HB   SER  37          1HB       SER  37   9.097  14.297  14.297
  307    HG   SER  37           HG       SER  37  10.169  15.502  15.502
  308    H    LYS  38           H        LYS  38   7.021  12.685  12.685
  309    HA   LYS  38           HA       LYS  38   4.771  12.732  12.732
  310   1HB   LYS  38          2HB       LYS  38   5.551  15.163  15.163
  311   2HB   LYS  38          1HB       LYS  38   3.902  14.906  14.906
  312   1HG   LYS  38          2HG       LYS  38   4.890  14.631  14.631
  313   2HG   LYS  38          1HG       LYS  38   6.406  15.235  15.235
  314   1HD   LYS  38          2HD       LYS  38   4.733  17.127  17.127
  315   2HD   LYS  38          1HD       LYS  38   3.858  16.678  16.678
  316   1HE   LYS  38          2HE       LYS  38   5.930  17.027  17.027
  317   2HE   LYS  38          1HE       LYS  38   6.763  17.537  17.537
  318   1HZ   LYS  38          2HZ       LYS  38   4.897  19.224  19.224
  319   2HZ   LYS  38          1HZ       LYS  38   4.531  18.872  18.872
  320   3HZ   LYS  38          3HZ       LYS  38   6.051  19.504  19.504
  321    HA   PRO  39           HA       PRO  39   4.184  10.887  10.887
  322   1HB   PRO  39          2HB       PRO  39   3.417   8.401   8.401
  323   2HB   PRO  39          1HB       PRO  39   5.086   8.858   8.858
  324   1HG   PRO  39          2HG       PRO  39   3.787   8.495   8.495
  325   2HG   PRO  39          1HG       PRO  39   5.490   8.312   8.312
  326   1HD   PRO  39          2HD       PRO  39   4.384  10.532  10.532
  327   2HD   PRO  39          1HD       PRO  39   5.968  10.483  10.483
  328    H    ALA  40           H        ALA  40   2.157  10.663  10.663
  329    HA   ALA  40           HA       ALA  40  -0.172  11.392  11.392
  330   1HB   ALA  40          3HB       ALA  40   0.413  12.567  12.567
  331   2HB   ALA  40          2HB       ALA  40  -0.091  11.088  11.088
  332   3HB   ALA  40          1HB       ALA  40  -1.251  12.002  12.002
  333    H    VAL  41           H        VAL  41  -2.299  10.296  10.296
  334    HA   VAL  41           HA       VAL  41  -2.008   7.504   7.504
  335    HB   VAL  41           HB       VAL  41  -2.659   8.354   8.354
  336   1HG1  VAL  41          2HG1      VAL  41  -3.580   5.759   5.759
  337   2HG1  VAL  41          1HG1      VAL  41  -3.650   6.124   6.124
  338   3HG1  VAL  41          3HG1      VAL  41  -4.634   7.046   7.046
  339   1HG2  VAL  41          1HG2      VAL  41  -0.992   6.199   6.199
  340   2HG2  VAL  41          3HG2      VAL  41  -0.431   7.580   7.580
  341   3HG2  VAL  41          2HG2      VAL  41  -1.294   6.262   6.262
  342    H    GLU  42           H        GLU  42  -4.231   6.513   6.513
  343    HA   GLU  42           HA       GLU  42  -6.500   8.385   8.385
  344   1HB   GLU  42          2HB       GLU  42  -5.372   8.926   8.926
  345   2HB   GLU  42          1HB       GLU  42  -5.394   7.219   7.219
  346   1HG   GLU  42          2HG       GLU  42  -7.925   7.319   7.319
  347   2HG   GLU  42          1HG       GLU  42  -7.775   9.065   9.065
  348    H    ILE  43           H        ILE  43  -8.077   7.156   7.156
  349    HA   ILE  43           HA       ILE  43  -8.107   4.243   4.243
  350    HB   ILE  43           HB       ILE  43  -9.194   5.823   5.823
  351   1HG1  ILE  43          2HG1      ILE  43  -7.688   3.501   3.501
  352   2HG1  ILE  43          1HG1      ILE  43  -6.786   4.326   4.326
  353   1HG2  ILE  43          1HG2      ILE  43  -9.914   3.081   3.081
  354   2HG2  ILE  43          3HG2      ILE  43  -9.752   3.342   3.342
  355   3HG2  ILE  43          2HG2      ILE  43 -10.917   4.285   4.285
  356   1HD1  ILE  43          2HD1      ILE  43  -7.932   6.062   6.062
  357   2HD1  ILE  43          1HD1      ILE  43  -6.614   5.003   5.003
  358   3HD1  ILE  43          3HD1      ILE  43  -6.370   6.156   6.156
  359    H    LYS  44           H        LYS  44  -9.874   3.366   3.366
  360    HA   LYS  44           HA       LYS  44 -12.163   5.177   5.177
  361   1HB   LYS  44          2HB       LYS  44 -11.841   2.844   2.844
  362   2HB   LYS  44          1HB       LYS  44 -12.147   4.525   4.525
  363   1HG   LYS  44          2HG       LYS  44  -9.766   5.053   5.053
  364   2HG   LYS  44          1HG       LYS  44  -9.422   3.441   3.441
  365   1HD   LYS  44          2HD       LYS  44  -9.807   2.431   2.431
  366   2HD   LYS  44          1HD       LYS  44 -10.801   3.769   3.769
  367   1HE   LYS  44          2HE       LYS  44  -8.844   5.209   5.209
  368   2HE   LYS  44          1HE       LYS  44  -7.820   3.953   3.953
  369   1HZ   LYS  44          2HZ       LYS  44  -9.345   3.707   3.707
  370   2HZ   LYS  44          1HZ       LYS  44  -7.678   4.018   4.018
  371   3HZ   LYS  44          3HZ       LYS  44  -8.302   2.539   2.539
  372    H    GLN  45           H        GLN  45 -13.797   4.513   4.513
  373    HA   GLN  45           HA       GLN  45 -13.927   1.635   1.635
  374   1HB   GLN  45          2HB       GLN  45 -14.003   3.290   3.290
  375   2HB   GLN  45          1HB       GLN  45 -15.471   3.980   3.980
  376   1HG   GLN  45          2HG       GLN  45 -16.642   1.846   1.846
  377   2HG   GLN  45          1HG       GLN  45 -15.175   1.103   1.103
  378   1HE2  GLN  45          2HE2      GLN  45 -16.468   1.956   1.956
  379   2HE2  GLN  45          1HE2      GLN  45 -16.129   0.693   0.693
  380    H    GLU  46           H        GLU  46 -15.202   0.357   0.357
  381    HA   GLU  46           HA       GLU  46 -17.772   1.481   1.481
  382   1HB   GLU  46          2HB       GLU  46 -16.028  -0.698  -0.698
  383   2HB   GLU  46          1HB       GLU  46 -17.602  -0.203  -0.203
  384   1HG   GLU  46          2HG       GLU  46 -16.426   2.210   2.210
  385   2HG   GLU  46          1HG       GLU  46 -14.985   1.216   1.216
  386    H    GLY  47           H        GLY  47 -17.935   0.651   0.651
  387   1HA   GLY  47          2HA       GLY  47 -19.468  -0.779  -0.779
  388   2HA   GLY  47          1HA       GLY  47 -19.393  -1.925  -1.925
  389    H    ASP  48           H        ASP  48 -18.447  -3.795  -3.795
  390    HA   ASP  48           HA       ASP  48 -16.532  -3.815  -3.815
  391   1HB   ASP  48          2HB       ASP  48 -16.298  -6.268  -6.268
  392   2HB   ASP  48          1HB       ASP  48 -17.891  -5.771  -5.771
  393    H    THR  49           H        THR  49 -16.167  -2.947  -2.947
  394    HA   THR  49           HA       THR  49 -13.543  -4.257  -4.257
  395    HB   THR  49           HB       THR  49 -15.339  -2.630  -2.630
  396    HG1  THR  49           HG1      THR  49 -14.299  -5.264  -5.264
  397   1HG2  THR  49          1HG2      THR  49 -12.454  -3.397  -3.397
  398   2HG2  THR  49          3HG2      THR  49 -13.529  -3.303  -3.303
  399   3HG2  THR  49          2HG2      THR  49 -13.257  -1.877  -1.877
  400    H    PHE  50           H        PHE  50 -11.640  -3.111  -3.111
  401    HA   PHE  50           HA       PHE  50 -11.800  -0.172  -0.172
  402   1HB   PHE  50          2HB       PHE  50 -10.254  -2.097  -2.097
  403   2HB   PHE  50          1HB       PHE  50 -10.140  -0.336  -0.336
  404    HD1  PHE  50           HD1      PHE  50 -12.325  -3.247  -3.247
  405    HD2  PHE  50           HD2      PHE  50 -11.948   1.009   1.009
  406    HE1  PHE  50           HE1      PHE  50 -14.375  -3.187  -3.187
  407    HE2  PHE  50           HE2      PHE  50 -13.994   1.073   1.073
  408    HZ   PHE  50           HZ       PHE  50 -15.216  -1.029  -1.029
  409    H    TYR  51           H        TYR  51 -10.570   0.675   0.675
  410    HA   TYR  51           HA       TYR  51  -8.225  -0.823  -0.823
  411   1HB   TYR  51          2HB       TYR  51  -9.968  -0.135  -0.135
  412   2HB   TYR  51          1HB       TYR  51  -9.768   1.537   1.537
  413    HD1  TYR  51           HD1      TYR  51  -7.211   2.400   2.400
  414    HD2  TYR  51           HD2      TYR  51  -8.813  -0.868  -0.868
  415    HE1  TYR  51           HE1      TYR  51  -5.396   2.661   2.661
  416    HE2  TYR  51           HE2      TYR  51  -7.010  -0.591  -0.591
  417    HH   TYR  51           HH       TYR  51  -5.137   2.114   2.114
  418    H    ILE  52           H        ILE  52  -6.302  -0.121  -0.121
  419    HA   ILE  52           HA       ILE  52  -6.212   2.635   2.635
  420    HB   ILE  52           HB       ILE  52  -3.876   0.805   0.805
  421   1HG1  ILE  52          2HG1      ILE  52  -5.866  -0.689  -0.689
  422   2HG1  ILE  52          1HG1      ILE  52  -4.831  -0.477  -0.477
  423   1HG2  ILE  52          1HG2      ILE  52  -5.325   2.789   2.789
  424   2HG2  ILE  52          3HG2      ILE  52  -3.960   1.822   1.822
  425   3HG2  ILE  52          2HG2      ILE  52  -3.744   2.973   2.973
  426   1HD1  ILE  52          3HD1      ILE  52  -6.899   1.561   1.561
  427   2HD1  ILE  52          2HD1      ILE  52  -7.598  -0.057  -0.057
  428   3HD1  ILE  52          1HD1      ILE  52  -6.525   0.408   0.408
  429    H    LYS  53           H        LYS  53  -4.591   4.133   4.133
  430    HA   LYS  53           HA       LYS  53  -2.879   3.194   3.194
  431   1HB   LYS  53          2HB       LYS  53  -5.212   4.259   4.259
  432   2HB   LYS  53          1HB       LYS  53  -4.354   5.765   5.765
  433   1HG   LYS  53          2HG       LYS  53  -2.444   4.551   4.551
  434   2HG   LYS  53          1HG       LYS  53  -3.829   3.695   3.695
  435   1HD   LYS  53          2HD       LYS  53  -4.840   6.143   6.143
  436   2HD   LYS  53          1HD       LYS  53  -3.137   6.603   6.603
  437   1HE   LYS  53          2HE       LYS  53  -2.726   5.045   5.045
  438   2HE   LYS  53          1HE       LYS  53  -4.445   4.648   4.648
  439   1HZ   LYS  53          2HZ       LYS  53  -3.303   7.363   7.363
  440   2HZ   LYS  53          1HZ       LYS  53  -3.878   6.353   6.353
  441   3HZ   LYS  53          3HZ       LYS  53  -4.951   6.952   6.952
  442    H    THR  54           H        THR  54  -0.965   3.692   3.692
  443    HA   THR  54           HA       THR  54  -0.720   6.344   6.344
  444    HB   THR  54           HB       THR  54   1.270   4.061   4.061
  445    HG1  THR  54           HG1      THR  54  -0.130   3.136   3.136
  446   1HG2  THR  54          2HG2      THR  54   2.138   6.305   6.305
  447   2HG2  THR  54          1HG2      THR  54   0.902   6.435   6.435
  448   3HG2  THR  54          3HG2      THR  54   2.157   5.205   5.205
  449    H    SER  55           H        SER  55   1.096   7.712   7.712
  450    HA   SER  55           HA       SER  55   2.588   7.088   7.088
  451   1HB   SER  55          2HB       SER  55   1.923   9.639   9.639
  452   2HB   SER  55          1HB       SER  55   1.016   8.251   8.251
  453    HG   SER  55           HG       SER  55  -0.209   9.977   9.977
  454    H    THR  56           H        THR  56   4.641   7.454   7.454
  455    HA   THR  56           HA       THR  56   5.263   9.542   9.542
  456    HB   THR  56           HB       THR  56   7.648   8.373   8.373
  457    HG1  THR  56           HG1      THR  56   7.468   6.581   6.581
  458   1HG2  THR  56          1HG2      THR  56   5.322   7.463   7.463
  459   2HG2  THR  56          3HG2      THR  56   6.894   6.671   6.671
  460   3HG2  THR  56          2HG2      THR  56   6.743   8.385   8.385
  461    H    THR  57           H        THR  57   7.754  10.315  10.315
  462    HA   THR  57           HA       THR  57   7.406  12.266  12.266
  463    HB   THR  57           HB       THR  57   9.100  12.430  12.430
  464    HG1  THR  57           HG1      THR  57  10.804  13.115  13.115
  465   1HG2  THR  57          3HG2      THR  57   9.635   9.858   9.858
  466   2HG2  THR  57          2HG2      THR  57  10.876  10.497  10.497
  467   3HG2  THR  57          1HG2      THR  57  10.860  10.962  10.962
  468    H    VAL  58           H        VAL  58   8.864   9.027   9.027
  469    HA   VAL  58           HA       VAL  58   8.950   9.420   9.420
  470    HB   VAL  58           HB       VAL  58  10.879   7.772   7.772
  471   1HG1  VAL  58          2HG1      VAL  58  10.536   8.448   8.448
  472   2HG1  VAL  58          1HG1      VAL  58  12.172   8.229   8.229
  473   3HG1  VAL  58          3HG1      VAL  58  10.999   6.917   6.917
  474   1HG2  VAL  58          2HG2      VAL  58  10.757  10.625  10.625
  475   2HG2  VAL  58          1HG2      VAL  58  11.998   9.666   9.666
  476   3HG2  VAL  58          3HG2      VAL  58  12.142  10.037  10.037
  477    H    ARG  59           H        ARG  59   7.600   7.531   7.531
  478    HA   ARG  59           HA       ARG  59   7.266   5.251   5.251
  479   1HB   ARG  59          2HB       ARG  59   8.436   4.979   4.979
  480   2HB   ARG  59          1HB       ARG  59   6.767   4.915   4.915
  481   1HG   ARG  59          2HG       ARG  59   6.319   2.943   2.943
  482   2HG   ARG  59          1HG       ARG  59   7.439   3.287   3.287
  483   1HD   ARG  59          2HD       ARG  59   8.513   2.812   2.812
  484   2HD   ARG  59          1HD       ARG  59   8.054   1.435   1.435
  485    HE   ARG  59           HE       ARG  59   9.648   2.625   2.625
  486   1HH1  ARG  59          2HH1      ARG  59  10.402   4.414   4.414
  487   2HH1  ARG  59          1HH1      ARG  59  11.926   3.703   3.703
  488   1HH2  ARG  59          1HH2      ARG  59  11.433   0.870   0.870
  489   2HH2  ARG  59          2HH2      ARG  59  12.510   1.697   1.697
  490    H    THR  60           H        THR  60   5.169   3.965   3.965
  491    HA   THR  60           HA       THR  60   2.922   5.508   5.508
  492    HB   THR  60           HB       THR  60   2.987   4.850   4.850
  493    HG1  THR  60           HG1      THR  60   3.184   7.388   7.388
  494   1HG2  THR  60          1HG2      THR  60   1.047   6.231   6.231
  495   2HG2  THR  60          3HG2      THR  60   1.003   6.499   6.499
  496   3HG2  THR  60          2HG2      THR  60   0.743   4.880   4.880
  497    H    THR  61           H        THR  61   2.176   3.750   3.750
  498    HA   THR  61           HA       THR  61   1.881   1.140   1.140
  499    HB   THR  61           HB       THR  61   1.430   0.352   0.352
  500    HG1  THR  61           HG1      THR  61   2.894   2.719   2.719
  501   1HG2  THR  61          3HG2      THR  61   4.019   1.143   1.143
  502   2HG2  THR  61          2HG2      THR  61   4.047   0.569   0.569
  503   3HG2  THR  61          1HG2      THR  61   3.407  -0.464  -0.464
  504    H    GLU  62           H        GLU  62  -0.150  -0.113  -0.113
  505    HA   GLU  62           HA       GLU  62  -2.426   1.308   1.308
  506   1HB   GLU  62          2HB       GLU  62  -3.720   1.572   1.572
  507   2HB   GLU  62          1HB       GLU  62  -2.221   2.487   2.487
  508   1HG   GLU  62          2HG       GLU  62  -1.484   0.026   0.026
  509   2HG   GLU  62          1HG       GLU  62  -3.146   0.190   0.190
  510    H    ILE  63           H        ILE  63  -3.364  -0.371  -0.371
  511    HA   ILE  63           HA       ILE  63  -3.395  -3.046  -3.046
  512    HB   ILE  63           HB       ILE  63  -3.779  -3.991  -3.991
  513   1HG1  ILE  63          2HG1      ILE  63  -3.792  -1.133  -1.133
  514   2HG1  ILE  63          1HG1      ILE  63  -5.230  -2.135  -2.135
  515   1HG2  ILE  63          3HG2      ILE  63  -1.459  -3.142  -3.142
  516   2HG2  ILE  63          2HG2      ILE  63  -1.682  -1.867  -1.867
  517   3HG2  ILE  63          1HG2      ILE  63  -1.654  -3.557  -3.557
  518   1HD1  ILE  63          2HD1      ILE  63  -3.784  -3.862  -3.862
  519   2HD1  ILE  63          1HD1      ILE  63  -2.997  -2.382  -2.382
  520   3HD1  ILE  63          3HD1      ILE  63  -4.732  -2.600  -2.600
  521    H    ASN  64           H        ASN  64  -5.483  -4.363  -4.363
  522    HA   ASN  64           HA       ASN  64  -7.946  -2.802  -2.802
  523   1HB   ASN  64          2HB       ASN  64  -8.910  -3.568  -3.568
  524   2HB   ASN  64          1HB       ASN  64  -7.595  -2.412  -2.412
  525   1HD2  ASN  64          2HD2      ASN  64  -5.273  -4.858  -4.858
  526   2HD2  ASN  64          1HD2      ASN  64  -5.349  -3.472  -3.472
  527    H    PHE  65           H        PHE  65  -9.424  -4.112  -4.112
  528    HA   PHE  65           HA       PHE  65  -9.585  -6.984  -6.984
  529   1HB   PHE  65          2HB       PHE  65  -8.926  -7.750  -7.750
  530   2HB   PHE  65          1HB       PHE  65  -7.603  -6.826  -6.826
  531    HD1  PHE  65           HD2      PHE  65  -7.224  -4.432  -4.432
  532    HD2  PHE  65           HD1      PHE  65 -10.082  -6.987  -6.987
  533    HE1  PHE  65           HE2      PHE  65  -7.356  -2.841  -2.841
  534    HE2  PHE  65           HE1      PHE  65 -10.223  -5.399  -5.399
  535    HZ   PHE  65           HZ       PHE  65  -8.866  -3.321  -3.321
  536    H    LYS  66           H        LYS  66 -10.893  -7.981  -7.981
  537    HA   LYS  66           HA       LYS  66 -13.096  -6.114  -6.114
  538   1HB   LYS  66          2HB       LYS  66 -14.672  -8.111  -8.111
  539   2HB   LYS  66          1HB       LYS  66 -14.098  -7.367  -7.367
  540   1HG   LYS  66          2HG       LYS  66 -12.235  -9.109  -9.109
  541   2HG   LYS  66          1HG       LYS  66 -13.131  -9.918  -9.918
  542   1HD   LYS  66          2HD       LYS  66 -14.476  -9.153  -9.153
  543   2HD   LYS  66          1HD       LYS  66 -13.597 -10.674 -10.674
  544   1HE   LYS  66          2HE       LYS  66 -15.006 -11.110 -11.110
  545   2HE   LYS  66          1HE       LYS  66 -16.012  -9.758  -9.758
  546   1HZ   LYS  66          2HZ       LYS  66 -16.267 -10.915 -10.915
  547   2HZ   LYS  66          1HZ       LYS  66 -15.458 -12.257 -12.257
  548   3HZ   LYS  66          3HZ       LYS  66 -16.944 -11.762 -11.762
  549    H    VAL  67           H        VAL  67 -14.145  -6.780  -6.780
  550    HA   VAL  67           HA       VAL  67 -12.177  -8.054  -8.054
  551    HB   VAL  67           HB       VAL  67 -14.835  -7.456  -7.456
  552   1HG1  VAL  67          2HG1      VAL  67 -11.930  -6.959  -6.959
  553   2HG1  VAL  67          1HG1      VAL  67 -13.185  -6.103  -6.103
  554   3HG1  VAL  67          3HG1      VAL  67 -13.120  -7.865  -7.865
  555   1HG2  VAL  67          2HG2      VAL  67 -13.310  -5.402  -5.402
  556   2HG2  VAL  67          1HG2      VAL  67 -15.044  -5.527  -5.527
  557   3HG2  VAL  67          3HG2      VAL  67 -13.975  -4.926  -4.926
  558    H    GLY  68           H        GLY  68 -12.150 -10.261 -10.261
  559   1HA   GLY  68          2HA       GLY  68 -13.691 -12.092 -12.092
  560   2HA   GLY  68          1HA       GLY  68 -14.679 -11.754 -11.754
  561    H    GLU  69           H        GLU  69 -12.074 -11.287 -11.287
  562    HA   GLU  69           HA       GLU  69 -11.163 -14.131 -14.131
  563   1HB   GLU  69          2HB       GLU  69 -11.299 -14.055 -14.055
  564   2HB   GLU  69          1HB       GLU  69 -12.882 -13.866 -13.866
  565   1HG   GLU  69          2HG       GLU  69 -13.151 -11.799 -11.799
  566   2HG   GLU  69          1HG       GLU  69 -11.528 -11.302 -11.302
  567    H    GLU  70           H        GLU  70  -9.149 -14.378 -14.378
  568    HA   GLU  70           HA       GLU  70  -7.280 -12.210 -12.210
  569   1HB   GLU  70          2HB       GLU  70  -5.583 -13.858 -13.858
  570   2HB   GLU  70          1HB       GLU  70  -6.570 -14.479 -14.479
  571   1HG   GLU  70          2HG       GLU  70  -7.721 -14.968 -14.968
  572   2HG   GLU  70          1HG       GLU  70  -6.164 -15.754 -15.754
  573    H    PHE  71           H        PHE  71  -5.575 -11.735 -11.735
  574    HA   PHE  71           HA       PHE  71  -6.459 -11.865 -11.865
  575   1HB   PHE  71          2HB       PHE  71  -6.542  -9.356  -9.356
  576   2HB   PHE  71          1HB       PHE  71  -7.874 -10.028 -10.028
  577    HD1  PHE  71           HD2      PHE  71  -7.649 -10.069 -10.069
  578    HD2  PHE  71           HD1      PHE  71  -5.096  -7.748  -7.748
  579    HE1  PHE  71           HE2      PHE  71  -6.995  -8.660  -8.660
  580    HE2  PHE  71           HE1      PHE  71  -4.443  -6.336  -6.336
  581    HZ   PHE  71           HZ       PHE  71  -5.391  -6.789  -6.789
  582    H    GLU  72           H        GLU  72  -4.901 -10.357 -10.357
  583    HA   GLU  72           HA       GLU  72  -2.200 -10.601 -10.601
  584   1HB   GLU  72          2HB       GLU  72  -2.568 -10.257 -10.257
  585   2HB   GLU  72          1HB       GLU  72  -1.247 -11.016 -11.016
  586   1HG   GLU  72          2HG       GLU  72  -2.867 -12.838 -12.838
  587   2HG   GLU  72          1HG       GLU  72  -4.023 -12.139 -12.139
  588    H    GLU  73           H        GLU  73  -0.846  -8.809  -8.809
  589    HA   GLU  73           HA       GLU  73  -1.507  -6.382  -6.382
  590   1HB   GLU  73          2HB       GLU  73  -2.001  -4.938  -4.938
  591   2HB   GLU  73          1HB       GLU  73  -3.101  -6.307  -6.307
  592   1HG   GLU  73          2HG       GLU  73  -0.500  -6.136  -6.136
  593   2HG   GLU  73          1HG       GLU  73  -2.058  -5.635  -5.635
  594    H    GLN  74           H        GLN  74  -0.061  -4.551  -4.551
  595    HA   GLN  74           HA       GLN  74   2.680  -5.751  -5.751
  596   1HB   GLN  74          2HB       GLN  74   1.574  -2.978  -2.978
  597   2HB   GLN  74          1HB       GLN  74   3.266  -3.177  -3.177
  598   1HG   GLN  74          2HG       GLN  74   3.478  -4.809  -4.809
  599   2HG   GLN  74          1HG       GLN  74   1.880  -4.272  -4.272
  600   1HE2  GLN  74          2HE2      GLN  74   4.957  -1.533  -1.533
  601   2HE2  GLN  74          1HE2      GLN  74   5.000  -2.763  -2.763
  602    H    THR  75           H        THR  75   4.271  -5.033  -5.033
  603    HA   THR  75           HA       THR  75   2.955  -4.810  -4.810
  604    HB   THR  75           HB       THR  75   4.599  -6.677  -6.677
  605    HG1  THR  75           HG1      THR  75   4.101  -6.098  -6.098
  606   1HG2  THR  75          1HG2      THR  75   6.244  -4.487  -4.487
  607   2HG2  THR  75          3HG2      THR  75   6.974  -5.229  -5.229
  608   3HG2  THR  75          2HG2      THR  75   6.646  -6.203  -6.203
  609    H    VAL  76           H        VAL  76   5.684  -3.735  -3.735
  610    HA   VAL  76           HA       VAL  76   5.130  -0.911  -0.911
  611    HB   VAL  76           HB       VAL  76   6.464  -1.965  -1.965
  612   1HG1  VAL  76          2HG1      VAL  76   5.802   0.728   0.728
  613   2HG1  VAL  76          1HG1      VAL  76   5.528   0.472   0.472
  614   3HG1  VAL  76          3HG1      VAL  76   7.136   0.231   0.231
  615   1HG2  VAL  76          3HG2      VAL  76   4.083  -2.668  -2.668
  616   2HG2  VAL  76          2HG2      VAL  76   4.332  -1.509  -1.509
  617   3HG2  VAL  76          1HG2      VAL  76   3.625  -0.979  -0.979
  618    H    ASP  77           H        ASP  77   7.599  -3.364  -3.364
  619    HA   ASP  77           HA       ASP  77   9.753  -1.393  -1.393
  620   1HB   ASP  77          2HB       ASP  77  11.171  -3.467  -3.467
  621   2HB   ASP  77          1HB       ASP  77  10.370  -3.319  -3.319
  622    H    GLY  78           H        GLY  78   8.029  -3.833  -3.833
  623   1HA   GLY  78          2HA       GLY  78   7.674  -2.892  -2.892
  624   2HA   GLY  78          1HA       GLY  78   9.437  -2.914  -2.914
  625    H    ARG  79           H        ARG  79   7.125  -5.241  -5.241
  626    HA   ARG  79           HA       ARG  79   8.097  -7.289  -7.289
  627   1HB   ARG  79          2HB       ARG  79   8.237  -7.272  -7.272
  628   2HB   ARG  79          1HB       ARG  79   7.865  -8.795  -8.795
  629   1HG   ARG  79          2HG       ARG  79  10.122  -7.188  -7.188
  630   2HG   ARG  79          1HG       ARG  79  10.388  -8.015  -8.015
  631   1HD   ARG  79          2HD       ARG  79   9.430  -9.317  -9.317
  632   2HD   ARG  79          1HD       ARG  79  11.049  -9.458  -9.458
  633    HE   ARG  79           HE       ARG  79   9.510 -10.351 -10.351
  634   1HH1  ARG  79          1HH2      ARG  79   7.221 -11.252 -11.252
  635   2HH1  ARG  79          2HH2      ARG  79   7.638 -12.753 -12.753
  636   1HH2  ARG  79          2HH1      ARG  79  11.056 -12.187 -12.187
  637   2HH2  ARG  79          1HH1      ARG  79   9.808 -13.282 -13.282
  638    HA   PRO  80           HA       PRO  80   3.767  -8.237  -8.237
  639   1HB   PRO  80          2HB       PRO  80   3.877 -10.828 -10.828
  640   2HB   PRO  80          1HB       PRO  80   4.163  -9.411  -9.411
  641   1HG   PRO  80          2HG       PRO  80   6.126 -11.371 -11.371
  642   2HG   PRO  80          1HG       PRO  80   6.236 -10.357 -10.357
  643   1HD   PRO  80          2HD       PRO  80   7.513  -9.863  -9.863
  644   2HD   PRO  80          1HD       PRO  80   7.366  -8.718  -8.718
  645    H    CYS  81           H        CYS  81   2.219  -9.169  -9.169
  646    HA   CYS  81           HA       CYS  81   2.809 -11.527 -11.527
  647   1HB   CYS  81          2HB       CYS  81   2.451 -10.344 -10.344
  648   2HB   CYS  81          1HB       CYS  81   3.955  -9.893  -9.893
  649    HG   CYS  81           HG       CYS  81   1.475  -8.062  -8.062
  650    H    LYS  82           H        LYS  82   0.916 -12.465 -12.465
  651    HA   LYS  82           HA       LYS  82  -1.605 -11.253 -11.253
  652   1HB   LYS  82          2HB       LYS  82  -1.171 -13.608 -13.608
  653   2HB   LYS  82          1HB       LYS  82  -0.980 -13.975 -13.975
  654   1HG   LYS  82          2HG       LYS  82  -3.396 -12.943 -12.943
  655   2HG   LYS  82          1HG       LYS  82  -3.465 -13.346 -13.346
  656   1HD   LYS  82          2HD       LYS  82  -4.257 -15.311 -15.311
  657   2HD   LYS  82          1HD       LYS  82  -2.545 -15.670 -15.670
  658   1HE   LYS  82          2HE       LYS  82  -2.063 -15.126 -15.126
  659   2HE   LYS  82          1HE       LYS  82  -3.697 -14.508 -14.508
  660   1HZ   LYS  82          3HZ       LYS  82  -3.081 -17.312 -17.312
  661   2HZ   LYS  82          2HZ       LYS  82  -3.338 -16.792 -16.792
  662   3HZ   LYS  82          1HZ       LYS  82  -4.589 -16.682 -16.682
  663    H    SER  83           H        SER  83  -2.761 -10.048 -10.048
  664    HA   SER  83           HA       SER  83  -2.207 -10.270 -10.270
  665   1HB   SER  83          2HB       SER  83  -2.015  -8.027  -8.027
  666   2HB   SER  83          1HB       SER  83  -3.313  -8.151  -8.151
  667    HG   SER  83           HG       SER  83  -3.845  -7.001  -7.001
  668    H    LEU  84           H        LEU  84  -4.235  -9.788  -9.788
  669    HA   LEU  84           HA       LEU  84  -6.761 -10.842 -10.842
  670   1HB   LEU  84          2HB       LEU  84  -5.580 -12.879 -12.879
  671   2HB   LEU  84          1HB       LEU  84  -5.405 -12.121 -12.121
  672    HG   LEU  84           HG       LEU  84  -7.850 -12.017 -12.017
  673   1HD1  LEU  84          2HD1      LEU  84  -7.885 -13.397 -13.397
  674   2HD1  LEU  84          1HD1      LEU  84  -9.292 -13.157 -13.157
  675   3HD1  LEU  84          3HD1      LEU  84  -8.466 -11.768 -11.768
  676   1HD2  LEU  84          1HD2      LEU  84  -6.657 -14.062 -14.062
  677   2HD2  LEU  84          3HD2      LEU  84  -8.289 -14.425 -14.425
  678   3HD2  LEU  84          2HD2      LEU  84  -6.906 -14.753 -14.753
  679    H    VAL  85           H        VAL  85  -8.577 -10.176 -10.176
  680    HA   VAL  85           HA       VAL  85  -7.759  -8.468  -8.468
  681    HB   VAL  85           HB       VAL  85  -9.524  -7.394  -7.394
  682   1HG1  VAL  85          3HG1      VAL  85  -9.823  -6.447  -6.447
  683   2HG1  VAL  85          2HG1      VAL  85  -8.105  -6.048  -6.048
  684   3HG1  VAL  85          1HG1      VAL  85  -9.167  -5.266  -5.266
  685   1HG2  VAL  85          3HG2      VAL  85  -6.565  -7.043  -7.043
  686   2HG2  VAL  85          2HG2      VAL  85  -7.338  -7.598  -7.598
  687   3HG2  VAL  85          1HG2      VAL  85  -7.499  -5.916  -5.916
  688    H    LYS  86           H        LYS  86  -9.132  -8.580  -8.580
  689    HA   LYS  86           HA       LYS  86 -11.958  -9.384  -9.384
  690   1HB   LYS  86          2HB       LYS  86 -11.660 -10.353 -10.353
  691   2HB   LYS  86          1HB       LYS  86 -11.273 -11.335 -11.335
  692   1HG   LYS  86          2HG       LYS  86  -8.897 -10.729 -10.729
  693   2HG   LYS  86          1HG       LYS  86  -9.283  -9.700  -9.700
  694   1HD   LYS  86          2HD       LYS  86  -8.531 -11.758 -11.758
  695   2HD   LYS  86          1HD       LYS  86 -10.289 -11.788 -11.788
  696   1HE   LYS  86          2HE       LYS  86 -10.050 -13.849 -13.849
  697   2HE   LYS  86          1HE       LYS  86 -10.018 -12.902 -12.902
  698   1HZ   LYS  86          2HZ       LYS  86  -7.535 -13.399 -13.399
  699   2HZ   LYS  86          1HZ       LYS  86  -8.141 -14.577 -14.577
  700   3HZ   LYS  86          3HZ       LYS  86  -7.732 -13.039 -13.039
  701    H    TRP  87           H        TRP  87 -13.399  -8.543  -8.543
  702    HA   TRP  87           HA       TRP  87 -12.524  -5.834  -5.834
  703   1HB   TRP  87          2HB       TRP  87 -15.110  -7.363  -7.363
  704   2HB   TRP  87          1HB       TRP  87 -14.880  -5.793  -5.793
  705    HD1  TRP  87           HD1      TRP  87 -15.758  -7.410  -7.410
  706    HE1  TRP  87           HE1      TRP  87 -15.958  -5.673  -5.673
  707    HE3  TRP  87           HE3      TRP  87 -13.663  -3.388  -3.388
  708    HZ2  TRP  87           HZ2      TRP  87 -15.309  -2.931  -2.931
  709    HZ3  TRP  87           HZ3      TRP  87 -13.433  -1.226  -1.226
  710    HH2  TRP  87           HH2      TRP  87 -14.256  -0.999  -0.999
  711    H    GLU  88           H        GLU  88 -13.129  -5.120  -5.120
  712    HA   GLU  88           HA       GLU  88 -12.493  -7.197  -7.197
  713   1HB   GLU  88          2HB       GLU  88 -10.509  -5.668  -5.668
  714   2HB   GLU  88          1HB       GLU  88 -11.365  -4.408  -4.408
  715   1HG   GLU  88          2HG       GLU  88  -9.967  -5.294  -5.294
  716   2HG   GLU  88          1HG       GLU  88 -11.481  -6.154  -6.154
  717    H    SER  89           H        SER  89 -13.528  -3.898  -3.898
  718    HA   SER  89           HA       SER  89 -15.636  -4.146  -4.146
  719   1HB   SER  89          2HB       SER  89 -15.217  -1.872  -1.872
  720   2HB   SER  89          1HB       SER  89 -13.678  -2.726  -2.726
  721    HG   SER  89           HG       SER  89 -14.271  -0.534  -0.534
  722    H    GLU  90           H        GLU  90 -16.589  -1.432  -1.432
  723    HA   GLU  90           HA       GLU  90 -18.046  -2.183  -2.183
  724   1HB   GLU  90          2HB       GLU  90 -19.151   0.034   0.034
  725   2HB   GLU  90          1HB       GLU  90 -19.201  -0.940  -0.940
  726   1HG   GLU  90          2HG       GLU  90 -16.784   0.490   0.490
  727   2HG   GLU  90          1HG       GLU  90 -17.957   1.653   1.653
  728    H    ASN  91           H        ASN  91 -15.229  -0.240  -0.240
  729    HA   ASN  91           HA       ASN  91 -14.983   0.291   0.291
  730   1HB   ASN  91          2HB       ASN  91 -14.409   2.430   2.430
  731   2HB   ASN  91          1HB       ASN  91 -14.467   2.601   2.601
  732   1HD2  ASN  91          2HD2      ASN  91 -17.768   3.432   3.432
  733   2HD2  ASN  91          1HD2      ASN  91 -16.182   3.581   3.581
  734    H    LYS  92           H        LYS  92 -13.561  -1.500  -1.500
  735    HA   LYS  92           HA       LYS  92 -10.829  -0.483  -0.483
  736   1HB   LYS  92          2HB       LYS  92 -11.322  -0.068  -0.068
  737   2HB   LYS  92          1HB       LYS  92 -11.672  -1.782  -1.782
  738   1HG   LYS  92          2HG       LYS  92  -9.331  -2.255  -2.255
  739   2HG   LYS  92          1HG       LYS  92  -9.023  -0.522  -0.522
  740   1HD   LYS  92          2HD       LYS  92  -9.566  -0.587  -0.587
  741   2HD   LYS  92          1HD       LYS  92  -9.904  -2.314  -2.314
  742   1HE   LYS  92          2HE       LYS  92  -7.252  -1.337  -1.337
  743   2HE   LYS  92          1HE       LYS  92  -7.510  -1.432  -1.432
  744   1HZ   LYS  92          2HZ       LYS  92  -8.078  -3.674  -3.674
  745   2HZ   LYS  92          1HZ       LYS  92  -6.596  -3.487  -3.487
  746   3HZ   LYS  92          3HZ       LYS  92  -8.021  -3.722  -3.722
  747    H    MET  93           H        MET  93 -10.073  -1.934  -1.934
  748    HA   MET  93           HA       MET  93 -10.713  -4.822  -4.822
  749   1HB   MET  93          2HB       MET  93 -10.047  -4.927  -4.927
  750   2HB   MET  93          1HB       MET  93 -11.676  -4.474  -4.474
  751   1HG   MET  93          2HG       MET  93 -11.359  -2.236  -2.236
  752   2HG   MET  93          1HG       MET  93  -9.614  -2.320  -2.320
  753   1HE   MET  93          3HE       MET  93 -12.502  -3.758  -3.758
  754   2HE   MET  93          2HE       MET  93 -12.432  -2.409  -2.409
  755   3HE   MET  93          1HE       MET  93 -12.056  -4.037  -4.037
  756    H    VAL  94           H        VAL  94  -9.076  -6.344  -6.344
  757    HA   VAL  94           HA       VAL  94  -6.317  -5.262  -5.262
  758    HB   VAL  94           HB       VAL  94  -7.121  -8.127  -8.127
  759   1HG1  VAL  94          3HG1      VAL  94  -4.889  -6.301  -6.301
  760   2HG1  VAL  94          2HG1      VAL  94  -5.267  -7.693  -7.693
  761   3HG1  VAL  94          1HG1      VAL  94  -4.807  -7.925  -7.925
  762   1HG2  VAL  94          2HG2      VAL  94  -7.672  -5.746  -5.746
  763   2HG2  VAL  94          1HG2      VAL  94  -8.634  -7.207  -7.207
  764   3HG2  VAL  94          3HG2      VAL  94  -7.182  -7.253  -7.253
  765    H    CYS  95           H        CYS  95  -4.613  -6.825  -6.825
  766    HA   CYS  95           HA       CYS  95  -5.663  -8.076  -8.076
  767   1HB   CYS  95          2HB       CYS  95  -5.251  -5.692  -5.692
  768   2HB   CYS  95          1HB       CYS  95  -3.584  -5.871  -5.871
  769    HG   CYS  95           HG       CYS  95  -3.078  -7.356  -7.356
  770    H    GLU  96           H        GLU  96  -4.430  -9.750  -9.750
  771    HA   GLU  96           HA       GLU  96  -1.841 -10.264 -10.264
  772   1HB   GLU  96          2HB       GLU  96  -3.565 -12.276 -12.276
  773   2HB   GLU  96          1HB       GLU  96  -2.205 -12.616 -12.616
  774   1HG   GLU  96          2HG       GLU  96  -4.611 -11.123 -11.123
  775   2HG   GLU  96          1HG       GLU  96  -4.622 -12.884 -12.884
  776    H    GLN  97           H        GLN  97  -0.159 -11.333 -11.333
  777    HA   GLN  97           HA       GLN  97  -0.618 -10.973 -10.973
  778   1HB   GLN  97          2HB       GLN  97  -0.009  -8.693  -8.693
  779   2HB   GLN  97          1HB       GLN  97   1.624  -9.323  -9.323
  780   1HG   GLN  97          2HG       GLN  97   1.065  -9.740  -9.740
  781   2HG   GLN  97          1HG       GLN  97  -0.404  -8.805  -8.805
  782   1HE2  GLN  97          2HE2      GLN  97   1.302  -5.772  -5.772
  783   2HE2  GLN  97          1HE2      GLN  97  -0.141  -6.655  -6.655
  784    H    LYS  98           H        LYS  98   0.767 -12.140 -12.140
  785    HA   LYS  98           HA       LYS  98   3.299 -13.158 -13.158
  786   1HB   LYS  98          2HB       LYS  98   2.754 -15.450 -15.450
  787   2HB   LYS  98          1HB       LYS  98   1.667 -14.929 -14.929
  788   1HG   LYS  98          2HG       LYS  98  -0.145 -14.859 -14.859
  789   2HG   LYS  98          1HG       LYS  98   0.784 -14.203 -14.203
  790   1HD   LYS  98          2HD       LYS  98   0.375 -16.313 -16.313
  791   2HD   LYS  98          1HD       LYS  98   1.863 -16.650 -16.650
  792   1HE   LYS  98          2HE       LYS  98   0.282 -17.125 -17.125
  793   2HE   LYS  98          1HE       LYS  98  -0.977 -17.266 -17.266
  794   1HZ   LYS  98          2HZ       LYS  98   1.579 -18.728 -18.728
  795   2HZ   LYS  98          1HZ       LYS  98   0.278 -19.365 -19.365
  796   3HZ   LYS  98          3HZ       LYS  98   0.099 -19.048 -19.048
  797    H    LEU  99           H        LEU  99   4.798 -13.884 -13.884
  798    HA   LEU  99           HA       LEU  99   4.633 -12.181 -12.181
  799   1HB   LEU  99          2HB       LEU  99   6.364 -14.576 -14.576
  800   2HB   LEU  99          1HB       LEU  99   6.570 -13.569 -13.569
  801    HG   LEU  99           HG       LEU  99   6.426 -12.165 -12.165
  802   1HD1  LEU  99          1HD1      LEU  99   8.819 -13.778 -13.778
  803   2HD1  LEU  99          3HD1      LEU  99   8.844 -12.608 -12.608
  804   3HD1  LEU  99          2HD1      LEU  99   7.872 -14.073 -14.073
  805   1HD2  LEU  99          1HD2      LEU  99   6.715 -11.036 -11.036
  806   2HD2  LEU  99          3HD2      LEU  99   8.045 -10.717 -10.717
  807   3HD2  LEU  99          2HD2      LEU  99   8.246 -11.889 -11.889
  808    H    LEU 100           H        LEU 100   4.848 -13.082 -13.082
  809    HA   LEU 100           HA       LEU 100   2.830 -15.212 -15.212
  810   1HB   LEU 100          2HB       LEU 100   3.913 -12.997 -12.997
  811   2HB   LEU 100          1HB       LEU 100   2.952 -14.326 -14.326
  812    HG   LEU 100           HG       LEU 100   2.003 -12.649 -12.649
  813   1HD1  LEU 100          2HD1      LEU 100   1.977 -12.090 -12.090
  814   2HD1  LEU 100          1HD1      LEU 100   0.514 -11.718 -11.718
  815   3HD1  LEU 100          3HD1      LEU 100   2.044 -10.965 -10.965
  816   1HD2  LEU 100          1HD2      LEU 100   0.819 -14.674 -14.674
  817   2HD2  LEU 100          3HD2      LEU 100   0.711 -14.603 -14.603
  818   3HD2  LEU 100          2HD2      LEU 100  -0.221 -13.477 -13.477
  819    H    LYS 101           H        LYS 101   6.183 -14.771 -14.771
  820    HA   LYS 101           HA       LYS 101   6.625 -17.330 -17.330
  821   1HB   LYS 101          2HB       LYS 101   7.195 -14.797 -14.797
  822   2HB   LYS 101          1HB       LYS 101   8.718 -15.620 -15.620
  823   1HG   LYS 101          2HG       LYS 101   6.577 -17.344 -17.344
  824   2HG   LYS 101          1HG       LYS 101   7.174 -16.099 -16.099
  825   1HD   LYS 101          2HD       LYS 101   9.244 -17.601 -17.601
  826   2HD   LYS 101          1HD       LYS 101   8.371 -18.512 -18.512
  827   1HE   LYS 101          2HE       LYS 101   9.051 -17.048 -17.048
  828   2HE   LYS 101          1HE       LYS 101   9.532 -15.790 -15.790
  829   1HZ   LYS 101          1HZ       LYS 101  10.849 -18.415 -18.415
  830   2HZ   LYS 101          3HZ       LYS 101  11.313 -17.306 -17.306
  831   3HZ   LYS 101          2HZ       LYS 101  11.449 -16.890 -16.890
  832    H    GLY 102           H        GLY 102   8.321 -18.446 -18.446
  833   1HA   GLY 102          2HA       GLY 102  10.018 -18.921 -18.921
  834   2HA   GLY 102          1HA       GLY 102  10.506 -17.232 -17.232
  835    H    GLU 103           H        GLU 103  10.864 -17.225 -17.225
  836    HA   GLU 103           HA       GLU 103   8.673 -16.157 -16.157
  837   1HB   GLU 103          2HB       GLU 103   7.977 -18.568 -18.568
  838   2HB   GLU 103          1HB       GLU 103   9.465 -18.962 -18.962
  839   1HG   GLU 103          2HG       GLU 103   8.822 -17.634 -17.634
  840   2HG   GLU 103          1HG       GLU 103   7.459 -16.941 -16.941
  841    H    GLY 104           H        GLY 104   9.446 -15.128 -15.128
  842   1HA   GLY 104          2HA       GLY 104  11.946 -15.927 -15.927
  843   2HA   GLY 104          1HA       GLY 104  12.051 -14.407 -14.407
  844    HA   PRO 105           HA       PRO 105  10.199 -12.493 -12.493
  845   1HB   PRO 105          2HB       PRO 105   9.335 -10.155 -10.155
  846   2HB   PRO 105          1HB       PRO 105  11.039 -10.492 -10.492
  847   1HG   PRO 105          2HG       PRO 105   9.649 -10.431 -10.431
  848   2HG   PRO 105          1HG       PRO 105  11.372 -10.237 -10.237
  849   1HD   PRO 105          2HD       PRO 105  10.079 -12.594 -12.594
  850   2HD   PRO 105          1HD       PRO 105  11.772 -12.442 -12.442
  851    H    LYS 106           H        LYS 106   8.003 -11.133 -11.133
  852    HA   LYS 106           HA       LYS 106   5.756 -12.339 -12.339
  853   1HB   LYS 106          2HB       LYS 106   6.078 -13.697 -13.697
  854   2HB   LYS 106          1HB       LYS 106   6.038 -12.239 -12.239
  855   1HG   LYS 106          2HG       LYS 106   3.764 -11.900 -11.900
  856   2HG   LYS 106          1HG       LYS 106   3.750 -12.831 -12.831
  857   1HD   LYS 106          2HD       LYS 106   3.444 -14.812 -14.812
  858   2HD   LYS 106          1HD       LYS 106   4.539 -14.374 -14.374
  859   1HE   LYS 106          2HE       LYS 106   2.138 -14.613 -14.613
  860   2HE   LYS 106          1HE       LYS 106   2.831 -13.028 -13.028
  861   1HZ   LYS 106          1HZ       LYS 106   1.369 -13.546 -13.546
  862   2HZ   LYS 106          3HZ       LYS 106   0.544 -13.121 -13.121
  863   3HZ   LYS 106          2HZ       LYS 106   1.691 -12.059 -12.059
  864    H    THR 107           H        THR 107   4.058 -10.857 -10.857
  865    HA   THR 107           HA       THR 107   4.398  -8.219  -8.219
  866    HB   THR 107           HB       THR 107   3.022  -7.607  -7.607
  867    HG1  THR 107           HG1      THR 107   3.526  -9.825  -9.825
  868   1HG2  THR 107          1HG2      THR 107   5.254  -6.762  -6.762
  869   2HG2  THR 107          3HG2      THR 107   5.996  -7.628  -7.628
  870   3HG2  THR 107          2HG2      THR 107   4.861  -6.315  -6.315
  871    H    SER 108           H        SER 108   2.600  -7.172  -7.172
  872    HA   SER 108           HA       SER 108  -0.111  -8.066  -8.066
  873   1HB   SER 108          2HB       SER 108  -0.653  -8.702  -8.702
  874   2HB   SER 108          1HB       SER 108   0.569  -9.779  -9.779
  875    HG   SER 108           HG       SER 108   1.670  -9.202  -9.202
  876    H    TRP 109           H        TRP 109  -1.504  -6.291  -6.291
  877    HA   TRP 109           HA       TRP 109  -0.456  -4.171  -4.171
  878   1HB   TRP 109          2HB       TRP 109  -1.041  -2.412  -2.412
  879   2HB   TRP 109          1HB       TRP 109   0.330  -3.413  -3.413
  880    HD1  TRP 109           HD1      TRP 109   0.105  -4.920  -4.920
  881    HE1  TRP 109           HE1      TRP 109  -1.695  -5.164  -5.164
  882    HE3  TRP 109           HE3      TRP 109  -3.718  -2.284  -2.284
  883    HZ2  TRP 109           HZ2      TRP 109  -4.392  -4.363  -4.363
  884    HZ3  TRP 109           HZ3      TRP 109  -5.888  -2.049  -2.049
  885    HH2  TRP 109           HH2      TRP 109  -6.230  -3.082  -3.082
  886    H    THR 110           H        THR 110  -2.198  -2.349  -2.349
  887    HA   THR 110           HA       THR 110  -4.933  -3.522  -3.522
  888    HB   THR 110           HB       THR 110  -5.475  -3.109  -3.109
  889    HG1  THR 110           HG1      THR 110  -4.672  -1.156  -1.156
  890   1HG2  THR 110          2HG2      THR 110  -3.589  -4.919  -4.919
  891   2HG2  THR 110          1HG2      THR 110  -2.633  -3.865  -3.865
  892   3HG2  THR 110          3HG2      THR 110  -4.117  -4.597  -4.597
  893    H    MET 111           H        MET 111  -6.571  -1.733  -1.733
  894    HA   MET 111           HA       MET 111  -5.724   1.028   1.028
  895   1HB   MET 111          2HB       MET 111  -6.652  -0.655  -0.655
  896   2HB   MET 111          1HB       MET 111  -7.854   0.596   0.596
  897   1HG   MET 111          2HG       MET 111  -6.105   2.323   2.323
  898   2HG   MET 111          1HG       MET 111  -4.898   1.069   1.069
  899   1HE   MET 111          1HE       MET 111  -4.502  -0.135  -0.135
  900   2HE   MET 111          3HE       MET 111  -5.478  -0.587  -0.587
  901   3HE   MET 111          2HE       MET 111  -4.363   0.774   0.774
  902    H    GLU 112           H        GLU 112  -7.019   2.326   2.326
  903    HA   GLU 112           HA       GLU 112  -9.702   1.266   1.266
  904   1HB   GLU 112          2HB       GLU 112  -7.959   1.229   1.229
  905   2HB   GLU 112          1HB       GLU 112  -7.873   2.986   2.986
  906   1HG   GLU 112          2HG       GLU 112 -10.565   2.633   2.633
  907   2HG   GLU 112          1HG       GLU 112  -9.985   1.280   1.280
  908    H    LEU 113           H        LEU 113 -11.376   2.816   2.816
  909    HA   LEU 113           HA       LEU 113 -10.732   5.466   5.466
  910   1HB   LEU 113          2HB       LEU 113 -12.516   3.534   3.534
  911   2HB   LEU 113          1HB       LEU 113 -13.553   4.557   4.557
  912    HG   LEU 113           HG       LEU 113 -13.492   5.156   5.156
  913   1HD1  LEU 113          3HD1      LEU 113 -13.197   6.913   6.913
  914   2HD1  LEU 113          2HD1      LEU 113 -12.540   7.664   7.664
  915   3HD1  LEU 113          1HD1      LEU 113 -14.205   7.097   7.097
  916   1HD2  LEU 113          1HD2      LEU 113 -10.693   4.968   4.968
  917   2HD2  LEU 113          3HD2      LEU 113 -11.544   5.414   5.414
  918   3HD2  LEU 113          2HD2      LEU 113 -11.037   6.663   6.663
  919    H    THR 114           H        THR 114 -11.536   7.329   7.329
  920    HA   THR 114           HA       THR 114 -12.289   6.784   6.784
  921    HB   THR 114           HB       THR 114 -11.721   9.052   9.052
  922    HG1  THR 114           HG1      THR 114 -12.115  10.521  10.521
  923   1HG2  THR 114          3HG2      THR 114  -9.783   7.590   7.590
  924   2HG2  THR 114          2HG2      THR 114  -9.831   8.051   8.051
  925   3HG2  THR 114          1HG2      THR 114  -9.446   9.256   9.256
  926    H    ASN 115           H        ASN 115 -14.081   8.030   8.030
  927    HA   ASN 115           HA       ASN 115 -16.519   7.729   7.729
  928   1HB   ASN 115          2HB       ASN 115 -15.906   8.120   8.120
  929   2HB   ASN 115          1HB       ASN 115 -16.453   9.742   9.742
  930   1HD2  ASN 115          2HD2      ASN 115 -19.152   6.723   6.723
  931   2HD2  ASN 115          1HD2      ASN 115 -17.497   6.452   6.452
  932    H    ASP 116           H        ASP 116 -14.218  10.338  10.338
  933    HA   ASP 116           HA       ASP 116 -16.123  12.323  12.323
  934   1HB   ASP 116          2HB       ASP 116 -13.128  12.317  12.317
  935   2HB   ASP 116          1HB       ASP 116 -13.968  13.666  13.666
  936    H    GLY 117           H        GLY 117 -13.773  10.035  10.035
  937   1HA   GLY 117          2HA       GLY 117 -14.381   9.314   9.314
  938   2HA   GLY 117          1HA       GLY 117 -14.334  11.029  11.029
  939    H    GLU 118           H        GLU 118 -11.935  10.890  10.890
  940    HA   GLU 118           HA       GLU 118  -9.812  11.135  11.135
  941   1HB   GLU 118          2HB       GLU 118  -9.725  10.293  10.293
  942   2HB   GLU 118          1HB       GLU 118  -8.324  10.801  10.801
  943   1HG   GLU 118          2HG       GLU 118  -9.367  12.996  12.996
  944   2HG   GLU 118          1HG       GLU 118 -10.785  12.493  12.493
  945    H    LEU 119           H        LEU 119  -7.840   9.566   9.566
  946    HA   LEU 119           HA       LEU 119  -8.686   6.725   6.725
  947   1HB   LEU 119          2HB       LEU 119  -9.215   7.552   7.552
  948   2HB   LEU 119          1HB       LEU 119  -7.507   7.905   7.905
  949    HG   LEU 119           HG       LEU 119  -8.488   5.143   5.143
  950   1HD1  LEU 119          3HD1      LEU 119  -8.419   6.545   6.545
  951   2HD1  LEU 119          2HD1      LEU 119  -8.069   4.818   4.818
  952   3HD1  LEU 119          1HD1      LEU 119  -9.624   5.428   5.428
  953   1HD2  LEU 119          3HD2      LEU 119  -5.936   6.402   6.402
  954   2HD2  LEU 119          2HD2      LEU 119  -6.177   5.105   5.105
  955   3HD2  LEU 119          1HD2      LEU 119  -6.297   4.767   4.767
  956    H    ILE 120           H        ILE 120  -7.142   5.898   5.898
  957    HA   ILE 120           HA       ILE 120  -4.315   6.781   6.781
  958    HB   ILE 120           HB       ILE 120  -5.079   7.143   7.143
  959   1HG1  ILE 120          2HG1      ILE 120  -3.301   4.687   4.687
  960   2HG1  ILE 120          1HG1      ILE 120  -2.738   6.328   6.328
  961   1HG2  ILE 120          3HG2      ILE 120  -5.891   4.242   4.242
  962   2HG2  ILE 120          2HG2      ILE 120  -5.639   5.017   5.017
  963   3HG2  ILE 120          1HG2      ILE 120  -6.882   5.623   5.623
  964   1HD1  ILE 120          2HD1      ILE 120  -4.265   5.808   5.808
  965   2HD1  ILE 120          1HD1      ILE 120  -2.579   5.297   5.297
  966   3HD1  ILE 120          3HD1      ILE 120  -2.999   6.994   6.994
  967    H    LEU 121           H        LEU 121  -2.724   5.118   5.118
  968    HA   LEU 121           HA       LEU 121  -3.867   2.399   2.399
  969   1HB   LEU 121          2HB       LEU 121  -3.555   3.537   3.537
  970   2HB   LEU 121          1HB       LEU 121  -1.892   3.939   3.939
  971    HG   LEU 121           HG       LEU 121  -2.622   1.054   1.054
  972   1HD1  LEU 121          3HD1      LEU 121  -3.689   2.108   2.108
  973   2HD1  LEU 121          2HD1      LEU 121  -2.025   2.273   2.273
  974   3HD1  LEU 121          1HD1      LEU 121  -2.677   0.676   0.676
  975   1HD2  LEU 121          3HD2      LEU 121  -0.275   2.757   2.757
  976   2HD2  LEU 121          2HD2      LEU 121  -0.359   1.536   1.536
  977   3HD2  LEU 121          1HD2      LEU 121  -0.335   1.047   1.047
  978    H    THR 122           H        THR 122  -2.428   0.720   0.720
  979    HA   THR 122           HA       THR 122   0.167   1.505   1.505
  980    HB   THR 122           HB       THR 122  -0.857  -0.916  -0.916
  981    HG1  THR 122           HG1      THR 122  -2.894   0.106   0.106
  982   1HG2  THR 122          3HG2      THR 122  -0.128   1.847   1.847
  983   2HG2  THR 122          2HG2      THR 122  -0.638   0.567   0.567
  984   3HG2  THR 122          1HG2      THR 122   0.817   0.364   0.364
  985    H    MET 123           H        MET 123   1.698  -0.405  -0.405
  986    HA   MET 123           HA       MET 123   0.995  -2.391  -2.391
  987   1HB   MET 123          2HB       MET 123   3.484  -0.659  -0.659
  988   2HB   MET 123          1HB       MET 123   3.070  -1.934  -1.934
  989   1HG   MET 123          2HG       MET 123   0.835  -0.544  -0.544
  990   2HG   MET 123          1HG       MET 123   1.841   0.777   0.777
  991   1HE   MET 123          3HE       MET 123   0.905  -1.713  -1.713
  992   2HE   MET 123          2HE       MET 123   1.033  -0.830  -0.830
  993   3HE   MET 123          1HE       MET 123   2.247  -2.038  -2.038
  994    H    THR 124           H        THR 124   2.618  -4.136  -4.136
  995    HA   THR 124           HA       THR 124   4.387  -4.368  -4.368
  996    HB   THR 124           HB       THR 124   2.479  -6.594  -6.594
  997    HG1  THR 124           HG1      THR 124   0.999  -5.485  -5.485
  998   1HG2  THR 124          1HG2      THR 124   4.594  -7.056  -7.056
  999   2HG2  THR 124          3HG2      THR 124   4.070  -5.914  -5.914
 1000   3HG2  THR 124          2HG2      THR 124   3.148  -7.389  -7.389
 1001    H    ALA 125           H        ALA 125   6.002  -5.952  -5.952
 1002    HA   ALA 125           HA       ALA 125   6.104  -7.555  -7.555
 1003   1HB   ALA 125          3HB       ALA 125   8.073  -5.290  -5.290
 1004   2HB   ALA 125          2HB       ALA 125   8.202  -6.520  -6.520
 1005   3HB   ALA 125          1HB       ALA 125   6.861  -5.374  -5.374
 1006    H    ASP 126           H        ASP 126   6.462  -9.355  -9.355
 1007    HA   ASP 126           HA       ASP 126   7.812 -10.951 -10.951
 1008   1HB   ASP 126          2HB       ASP 126   9.717  -9.108  -9.108
 1009   2HB   ASP 126          1HB       ASP 126  10.152  -9.394  -9.394
 1010    H    ASP 127           H        ASP 127   9.100  -8.049  -8.049
 1011    HA   ASP 127           HA       ASP 127   7.311  -8.518  -8.518
 1012   1HB   ASP 127          2HB       ASP 127  10.306  -8.871  -8.871
 1013   2HB   ASP 127          1HB       ASP 127   9.400  -8.398  -8.398
 1014    H    VAL 128           H        VAL 128   7.951  -6.427  -6.427
 1015    HA   VAL 128           HA       VAL 128   8.495  -4.175  -4.175
 1016    HB   VAL 128           HB       VAL 128   9.402  -2.920  -2.920
 1017   1HG1  VAL 128          2HG1      VAL 128  10.822  -4.613  -4.613
 1018   2HG1  VAL 128          1HG1      VAL 128  10.655  -5.668  -5.668
 1019   3HG1  VAL 128          3HG1      VAL 128  11.449  -4.103  -4.103
 1020   1HG2  VAL 128          1HG2      VAL 128   8.218  -5.182  -5.182
 1021   2HG2  VAL 128          3HG2      VAL 128   8.432  -3.499  -3.499
 1022   3HG2  VAL 128          2HG2      VAL 128   9.786  -4.625  -4.625
 1023    H    VAL 129           H        VAL 129   7.475  -2.083  -2.083
 1024    HA   VAL 129           HA       VAL 129   5.002  -2.689  -2.689
 1025    HB   VAL 129           HB       VAL 129   5.069  -2.113  -2.113
 1026   1HG1  VAL 129          1HG1      VAL 129   3.092  -0.871  -0.871
 1027   2HG1  VAL 129          3HG1      VAL 129   2.551  -1.401  -1.401
 1028   3HG1  VAL 129          2HG1      VAL 129   3.817  -0.182  -0.182
 1029   1HG2  VAL 129          2HG2      VAL 129   3.629  -3.875  -3.875
 1030   2HG2  VAL 129          1HG2      VAL 129   4.370  -4.268  -4.268
 1031   3HG2  VAL 129          3HG2      VAL 129   2.805  -3.457  -3.457
 1032    H    CYS 130           H        CYS 130   4.917  -1.122  -1.122
 1033    HA   CYS 130           HA       CYS 130   6.063   1.558   1.558
 1034   1HB   CYS 130          2HB       CYS 130   6.536   0.080   0.080
 1035   2HB   CYS 130          1HB       CYS 130   5.042   0.827   0.827
 1036    HG   CYS 130           HG       CYS 130   6.223   2.992   2.992
 1037    H    THR 131           H        THR 131   4.588   2.946   2.946
 1038    HA   THR 131           HA       THR 131   1.761   2.784   2.784
 1039    HB   THR 131           HB       THR 131   2.893   4.124   4.124
 1040    HG1  THR 131           HG1      THR 131   2.449   2.319   2.319
 1041   1HG2  THR 131          1HG2      THR 131   0.112   3.756   3.756
 1042   2HG2  THR 131          3HG2      THR 131   0.386   3.981   3.981
 1043   3HG2  THR 131          2HG2      THR 131   0.878   5.233   5.233
 1044    H    ARG 132           H        ARG 132   0.725   4.666   4.666
 1045    HA   ARG 132           HA       ARG 132   2.187   7.211   7.211
 1046   1HB   ARG 132          2HB       ARG 132   1.109   5.894   5.894
 1047   2HB   ARG 132          1HB       ARG 132   1.951   7.439   7.439
 1048   1HG   ARG 132          2HG       ARG 132   3.914   6.131   6.131
 1049   2HG   ARG 132          1HG       ARG 132   3.078   4.674   4.674
 1050   1HD   ARG 132          2HD       ARG 132   3.302   6.801   6.801
 1051   2HD   ARG 132          1HD       ARG 132   4.831   6.072   6.072
 1052    HE   ARG 132           HE       ARG 132   2.665   4.184   4.184
 1053   1HH1  ARG 132          1HH2      ARG 132   5.747   3.826   3.826
 1054   2HH1  ARG 132          2HH2      ARG 132   6.027   3.685   3.685
 1055   1HH2  ARG 132          2HH1      ARG 132   2.902   4.904   4.904
 1056   2HH2  ARG 132          1HH1      ARG 132   4.416   4.295   4.295
 1057    H    VAL 133           H        VAL 133   0.603   8.646   8.646
 1058    HA   VAL 133           HA       VAL 133  -2.224   7.891   7.891
 1059    HB   VAL 133           HB       VAL 133  -0.949  10.508  10.508
 1060   1HG1  VAL 133          2HG1      VAL 133  -3.692   9.327   9.327
 1061   2HG1  VAL 133          1HG1      VAL 133  -3.080  10.804  10.804
 1062   3HG1  VAL 133          3HG1      VAL 133  -3.337  10.736  10.736
 1063   1HG2  VAL 133          3HG2      VAL 133  -1.646   7.999   7.999
 1064   2HG2  VAL 133          2HG2      VAL 133  -0.074   8.791   8.791
 1065   3HG2  VAL 133          1HG2      VAL 133  -1.381   9.552   9.552
 1066    H    TYR 134           H        TYR 134  -3.758   8.685   8.685
 1067    HA   TYR 134           HA       TYR 134  -2.722  10.624  10.624
 1068   1HB   TYR 134          2HB       TYR 134  -4.177   8.032   8.032
 1069   2HB   TYR 134          1HB       TYR 134  -4.429   9.338   9.338
 1070    HD1  TYR 134           HD2      TYR 134  -2.573  10.209  10.209
 1071    HD2  TYR 134           HD1      TYR 134  -2.028   6.917   6.917
 1072    HE1  TYR 134           HE2      TYR 134  -0.431   9.641   9.641
 1073    HE2  TYR 134           HE1      TYR 134   0.112   6.349   6.349
 1074    HH   TYR 134           HH       TYR 134   0.991   6.978   6.978
 1075    H    VAL 135           H        VAL 135  -3.932  12.393  12.393
 1076    HA   VAL 135           HA       VAL 135  -6.747  12.252  12.252
 1077    HB   VAL 135           HB       VAL 135  -4.664  14.047  14.047
 1078   1HG1  VAL 135          3HG1      VAL 135  -6.762  15.462  15.462
 1079   2HG1  VAL 135          2HG1      VAL 135  -5.554  16.258  16.258
 1080   3HG1  VAL 135          1HG1      VAL 135  -5.049  15.321  15.321
 1081   1HG2  VAL 135          1HG2      VAL 135  -6.637  13.335  13.335
 1082   2HG2  VAL 135          3HG2      VAL 135  -6.361  15.076  15.076
 1083   3HG2  VAL 135          2HG2      VAL 135  -7.643  14.414  14.414
 1084    H    ARG 136           H        ARG 136  -8.401  12.843  12.843
 1085    HA   ARG 136           HA       ARG 136  -7.997  12.461  12.461
 1086   1HB   ARG 136          2HB       ARG 136 -10.151  13.381  13.381
 1087   2HB   ARG 136          1HB       ARG 136 -10.094  14.341  14.341
 1088   1HG   ARG 136          2HG       ARG 136 -10.448  12.523  12.523
 1089   2HG   ARG 136          1HG       ARG 136  -9.781  11.378  11.378
 1090   1HD   ARG 136          2HD       ARG 136 -12.478  12.754  12.754
 1091   2HD   ARG 136          1HD       ARG 136 -12.170  11.029  11.029
 1092    HE   ARG 136           HE       ARG 136 -10.943  11.703  11.703
 1093   1HH1  ARG 136          2HH1      ARG 136 -13.496   9.987   9.987
 1094   2HH1  ARG 136          1HH1      ARG 136 -14.598  10.722  10.722
 1095   1HH2  ARG 136          1HH2      ARG 136 -12.611  13.517  13.517
 1096   2HH2  ARG 136          2HH2      ARG 136 -14.096  12.724  12.724
 1097    H    GLU 137           HN       GLU 137  -7.066  13.543  13.543
 1098    HA   GLU 137           HA       GLU 137  -5.794  15.197  15.197
 1099   1HB   GLU 137          2HB       GLU 137  -8.305  15.710  15.710
 1100   2HB   GLU 137          1HB       GLU 137  -7.999  17.037  17.037
 1101   1HG   GLU 137          2HG       GLU 137  -6.020  17.625  17.625
 1102   2HG   GLU 137          1HG       GLU 137  -6.834  16.585  16.585

  Start of MODEL   28
    1   1H    PRO   1          1H        PRO   1 -16.776   6.819   6.819
    2   2H    PRO   1          2H        PRO   1 -16.172   6.311   6.311
    3    HA   PRO   1           HA       PRO   1 -16.299   4.191   4.191
    4   1HB   PRO   1          2HB       PRO   1 -18.986   3.939   3.939
    5   2HB   PRO   1          1HB       PRO   1 -18.345   3.434   3.434
    6   1HG   PRO   1          2HG       PRO   1 -20.077   5.642   5.642
    7   2HG   PRO   1          1HG       PRO   1 -19.427   5.137   5.137
    8   1HD   PRO   1          1HD       PRO   1 -18.686   7.424   7.424
    9   2HD   PRO   1          2HD       PRO   1 -18.050   6.921   6.921
   10    H    ASN   2           H        ASN   2 -15.353   5.955   5.955
   11    HA   ASN   2           HA       ASN   2 -15.875   4.324   4.324
   12   1HB   ASN   2          2HB       ASN   2 -16.951   7.031   7.031
   13   2HB   ASN   2          1HB       ASN   2 -15.979   6.878   6.878
   14   1HD2  ASN   2          2HD2      ASN   2 -19.043   5.726   5.726
   15   2HD2  ASN   2          1HD2      ASN   2 -18.005   7.062   7.062
   16    H    PHE   3           H        PHE   3 -13.980   3.994   3.994
   17    HA   PHE   3           HA       PHE   3 -11.650   5.685   5.685
   18   1HB   PHE   3          2HB       PHE   3 -11.878   3.014   3.014
   19   2HB   PHE   3          1HB       PHE   3 -10.367   3.843   3.843
   20    HD1  PHE   3           HD1      PHE   3 -13.443   2.847   2.847
   21    HD2  PHE   3           HD2      PHE   3  -9.152   3.075   3.075
   22    HE1  PHE   3           HE1      PHE   3 -13.321   1.760   1.760
   23    HE2  PHE   3           HE2      PHE   3  -9.039   1.981   1.981
   24    HZ   PHE   3           HZ       PHE   3 -11.123   1.314   1.314
   25    H    SER   4           H        SER   4 -13.963   5.358   5.358
   26    HA   SER   4           HA       SER   4 -12.315   5.719   5.719
   27   1HB   SER   4          2HB       SER   4 -14.358   6.123   6.123
   28   2HB   SER   4          1HB       SER   4 -14.709   4.907   4.907
   29    HG   SER   4           HG       SER   4 -15.418   7.619   7.619
   30    H    GLY   5           H        GLY   5 -11.152   7.446   7.446
   31   1HA   GLY   5          2HA       GLY   5 -11.970  10.007  10.007
   32   2HA   GLY   5          1HA       GLY   5 -11.588  10.057  10.057
   33    H    ASN   6           H        ASN   6  -9.895  11.614  11.614
   34    HA   ASN   6           HA       ASN   6  -7.532  10.135  10.135
   35   1HB   ASN   6          2HB       ASN   6  -8.330  13.046  13.046
   36   2HB   ASN   6          1HB       ASN   6  -6.623  12.618  12.618
   37   1HD2  ASN   6          2HD2      ASN   6  -7.293  10.912  10.912
   38   2HD2  ASN   6          1HD2      ASN   6  -6.595  10.491  10.491
   39    H    TRP   7           H        TRP   7  -5.407  10.873  10.873
   40    HA   TRP   7           HA       TRP   7  -5.911  11.462  11.462
   41   1HB   TRP   7          2HB       TRP   7  -4.714   8.874   8.874
   42   2HB   TRP   7          1HB       TRP   7  -4.669   9.397   9.397
   43    HD1  TRP   7           HD1      TRP   7  -6.883   7.785   7.785
   44    HE1  TRP   7           HE1      TRP   7  -9.244   7.401   7.401
   45    HE3  TRP   7           HE3      TRP   7  -6.455  10.540  10.540
   46    HZ2  TRP   7           HZ2      TRP   7 -10.746   8.215   8.215
   47    HZ3  TRP   7           HZ3      TRP   7  -8.357  10.763  10.763
   48    HH2  TRP   7           HH2      TRP   7 -10.482   9.601   9.601
   49    H    LYS   8           H        LYS   8  -4.456  12.887  12.887
   50    HA   LYS   8           HA       LYS   8  -1.710  12.768  12.768
   51   1HB   LYS   8          2HB       LYS   8  -3.491  15.042  15.042
   52   2HB   LYS   8          1HB       LYS   8  -1.767  15.227  15.227
   53   1HG   LYS   8          2HG       LYS   8  -1.643  14.242  14.242
   54   2HG   LYS   8          1HG       LYS   8  -3.205  15.058  15.058
   55   1HD   LYS   8          2HD       LYS   8  -1.863  17.018  17.018
   56   2HD   LYS   8          1HD       LYS   8  -0.482  16.219  16.219
   57   1HE   LYS   8          2HE       LYS   8  -2.069  16.229  16.229
   58   2HE   LYS   8          1HE       LYS   8  -2.815  17.586  17.586
   59   1HZ   LYS   8          2HZ       LYS   8  -0.473  18.466  18.466
   60   2HZ   LYS   8          1HZ       LYS   8  -0.012  17.310  17.310
   61   3HZ   LYS   8          3HZ       LYS   8  -1.135  18.514  18.514
   62    H    ILE   9           H        ILE   9  -0.264  12.021  12.021
   63    HA   ILE   9           HA       ILE   9  -0.922  11.413  11.413
   64    HB   ILE   9           HB       ILE   9   0.767  10.190  10.190
   65   1HG1  ILE   9          2HG1      ILE   9   2.004  11.655  11.655
   66   2HG1  ILE   9          1HG1      ILE   9   0.946  10.251  10.251
   67   1HG2  ILE   9          3HG2      ILE   9   1.583  12.585  12.585
   68   2HG2  ILE   9          2HG2      ILE   9   2.808  12.328  12.328
   69   3HG2  ILE   9          1HG2      ILE   9   2.594  11.141  11.141
   70   1HD1  ILE   9          1HD1      ILE   9   2.845   9.379   9.379
   71   2HD1  ILE   9          3HD1      ILE   9   3.799  10.390  10.390
   72   3HD1  ILE   9          2HD1      ILE   9   2.866   9.041   9.041
   73    H    ILE  10           H        ILE  10  -0.142  12.292  12.292
   74    HA   ILE  10           HA       ILE  10   0.827  15.113  15.113
   75    HB   ILE  10           HB       ILE  10  -0.530  15.623  15.623
   76   1HG1  ILE  10          2HG1      ILE  10  -2.410  13.651  13.651
   77   2HG1  ILE  10          1HG1      ILE  10  -0.974  12.691  12.691
   78   1HG2  ILE  10          1HG2      ILE  10  -1.414  15.783  15.783
   79   2HG2  ILE  10          3HG2      ILE  10  -2.320  14.314  14.314
   80   3HG2  ILE  10          2HG2      ILE  10  -2.617  15.782  15.782
   81   1HD1  ILE  10          1HD1      ILE  10   0.192  14.140  14.140
   82   2HD1  ILE  10          3HD1      ILE  10  -1.440  14.592  14.592
   83   3HD1  ILE  10          2HD1      ILE  10  -0.938  12.902  12.902
   84    H    ARG  11           H        ARG  11   0.908  12.009  12.009
   85    HA   ARG  11           HA       ARG  11   3.456  12.862  12.862
   86   1HB   ARG  11          2HB       ARG  11   0.957  11.984  11.984
   87   2HB   ARG  11          1HB       ARG  11   2.462  11.290  11.290
   88   1HG   ARG  11          2HG       ARG  11   3.399  13.497  13.497
   89   2HG   ARG  11          1HG       ARG  11   2.003  14.260  14.260
   90   1HD   ARG  11          2HD       ARG  11   0.735  12.792  12.792
   91   2HD   ARG  11          1HD       ARG  11   2.265  13.075  13.075
   92    HE   ARG  11           HE       ARG  11   1.673  15.586  15.586
   93   1HH1  ARG  11          1HH2      ARG  11  -1.026  13.710  13.710
   94   2HH1  ARG  11          2HH2      ARG  11  -1.773  14.527  14.527
   95   1HH2  ARG  11          2HH1      ARG  11   1.042  16.397  16.397
   96   2HH2  ARG  11          1HH1      ARG  11  -0.603  16.048  16.048
   97    H    SER  12           H        SER  12   4.622  10.831  10.831
   98    HA   SER  12           HA       SER  12   3.888   8.215   8.215
   99   1HB   SER  12          2HB       SER  12   5.342   7.942   7.942
  100   2HB   SER  12          1HB       SER  12   4.312   9.335   9.335
  101    HG   SER  12           HG       SER  12   6.031  10.529  10.529
  102    H    GLU  13           H        GLU  13   5.438   6.666   6.666
  103    HA   GLU  13           HA       GLU  13   8.008   7.621   7.621
  104   1HB   GLU  13          2HB       GLU  13   7.523   6.388   6.388
  105   2HB   GLU  13          1HB       GLU  13   6.578   7.857   7.857
  106   1HG   GLU  13          2HG       GLU  13   5.330   5.430   5.430
  107   2HG   GLU  13          1HG       GLU  13   5.511   5.403   5.403
  108    H    ASN  14           H        ASN  14   9.406   5.745   5.745
  109    HA   ASN  14           HA       ASN  14  10.401   3.678   3.678
  110   1HB   ASN  14          2HB       ASN  14   7.635   2.695   2.695
  111   2HB   ASN  14          1HB       ASN  14   9.009   1.753   1.753
  112   1HD2  ASN  14          2HD2      ASN  14   6.511   3.205   3.205
  113   2HD2  ASN  14          1HD2      ASN  14   6.143   3.074   3.074
  114    H    PHE  15           H        PHE  15   9.821   5.696   5.696
  115    HA   PHE  15           HA       PHE  15   9.108   4.298   4.298
  116   1HB   PHE  15          2HB       PHE  15   9.266   6.842   6.842
  117   2HB   PHE  15          1HB       PHE  15  11.003   6.649   6.649
  118    HD1  PHE  15           HD2      PHE  15  10.134   4.160   4.160
  119    HD2  PHE  15           HD1      PHE  15   9.651   8.414   8.414
  120    HE1  PHE  15           HE2      PHE  15   9.954   4.293   4.293
  121    HE2  PHE  15           HE1      PHE  15   9.453   8.535   8.535
  122    HZ   PHE  15           HZ       PHE  15   9.606   6.457   6.457
  123    H    GLU  16           H        GLU  16  12.364   5.440   5.440
  124    HA   GLU  16           HA       GLU  16  13.783   3.820   3.820
  125   1HB   GLU  16          2HB       GLU  16  15.735   4.156   4.156
  126   2HB   GLU  16          1HB       GLU  16  14.910   5.650   5.650
  127   1HG   GLU  16          2HG       GLU  16  13.867   5.845   5.845
  128   2HG   GLU  16          1HG       GLU  16  14.120   4.142   4.142
  129    H    GLU  17           H        GLU  17  12.398   3.061   3.061
  130    HA   GLU  17           HA       GLU  17  13.871   0.676   0.676
  131   1HB   GLU  17          2HB       GLU  17  11.038   1.383   1.383
  132   2HB   GLU  17          1HB       GLU  17  12.063   0.173   0.173
  133   1HG   GLU  17          2HG       GLU  17  13.756   2.127   2.127
  134   2HG   GLU  17          1HG       GLU  17  12.358   3.165   3.165
  135    H    LEU  18           H        LEU  18  10.988   1.324   1.324
  136    HA   LEU  18           HA       LEU  18  10.468  -1.500  -1.500
  137   1HB   LEU  18          2HB       LEU  18   8.705   0.380   0.380
  138   2HB   LEU  18          1HB       LEU  18   9.301   0.824   0.824
  139    HG   LEU  18           HG       LEU  18   8.888  -1.521  -1.521
  140   1HD1  LEU  18          1HD1      LEU  18   8.093  -1.751  -1.751
  141   2HD1  LEU  18          3HD1      LEU  18   7.117  -2.632  -2.632
  142   3HD1  LEU  18          2HD1      LEU  18   8.848  -2.941  -2.941
  143   1HD2  LEU  18          2HD2      LEU  18   7.136   0.540   0.540
  144   2HD2  LEU  18          1HD2      LEU  18   6.722  -1.019  -1.019
  145   3HD2  LEU  18          3HD2      LEU  18   6.262  -0.661  -0.661
  146    H    LEU  19           H        LEU  19  12.433   0.974   0.974
  147    HA   LEU  19           HA       LEU  19  12.500  -0.469  -0.469
  148   1HB   LEU  19          2HB       LEU  19  14.233   1.893   1.893
  149   2HB   LEU  19          1HB       LEU  19  13.732   1.370   1.370
  150    HG   LEU  19           HG       LEU  19  12.120   2.818   2.818
  151   1HD1  LEU  19          2HD1      LEU  19  13.506   3.639   3.639
  152   2HD1  LEU  19          1HD1      LEU  19  11.828   3.589   3.589
  153   3HD1  LEU  19          3HD1      LEU  19  12.273   4.551   4.551
  154   1HD2  LEU  19          2HD2      LEU  19  10.741   0.877   0.877
  155   2HD2  LEU  19          1HD2      LEU  19  10.075   2.450   2.450
  156   3HD2  LEU  19          3HD2      LEU  19  10.948   1.510   1.510
  157    H    LYS  20           H        LYS  20  14.176  -0.393  -0.393
  158    HA   LYS  20           HA       LYS  20  16.670  -1.506  -1.506
  159   1HB   LYS  20          2HB       LYS  20  15.847  -1.275  -1.275
  160   2HB   LYS  20          1HB       LYS  20  17.476  -1.520  -1.520
  161   1HG   LYS  20          2HG       LYS  20  16.231   0.846   0.846
  162   2HG   LYS  20          1HG       LYS  20  16.264   0.938   0.938
  163   1HD   LYS  20          2HD       LYS  20  18.666   0.317   0.317
  164   2HD   LYS  20          1HD       LYS  20  18.321   1.884   1.884
  165   1HE   LYS  20          2HE       LYS  20  18.210   0.539   0.539
  166   2HE   LYS  20          1HE       LYS  20  19.112  -0.685  -0.685
  167   1HZ   LYS  20          1HZ       LYS  20  19.956   2.150   2.150
  168   2HZ   LYS  20          3HZ       LYS  20  20.453   1.035   1.035
  169   3HZ   LYS  20          2HZ       LYS  20  20.869   0.790   0.790
  170    H    VAL  21           H        VAL  21  13.684  -2.516  -2.516
  171    HA   VAL  21           HA       VAL  21  14.538  -5.247  -5.247
  172    HB   VAL  21           HB       VAL  21  12.686  -4.125  -4.125
  173   1HG1  VAL  21          2HG1      VAL  21  11.768  -2.874  -2.874
  174   2HG1  VAL  21          1HG1      VAL  21  11.110  -4.384  -4.384
  175   3HG1  VAL  21          3HG1      VAL  21  10.541  -3.732  -3.732
  176   1HG2  VAL  21          1HG2      VAL  21  12.344  -6.678  -6.678
  177   2HG2  VAL  21          3HG2      VAL  21  12.450  -6.407  -6.407
  178   3HG2  VAL  21          2HG2      VAL  21  10.947  -6.063  -6.063
  179    H    LEU  22           H        LEU  22  12.744  -3.511  -3.511
  180    HA   LEU  22           HA       LEU  22  12.049  -5.732  -5.732
  181   1HB   LEU  22          2HB       LEU  22  12.103  -2.774  -2.774
  182   2HB   LEU  22          1HB       LEU  22  12.287  -3.551  -3.551
  183    HG   LEU  22           HG       LEU  22  10.194  -4.743  -4.743
  184   1HD1  LEU  22          3HD1      LEU  22  10.442  -5.093  -5.093
  185   2HD1  LEU  22          2HD1      LEU  22   9.967  -3.413  -3.413
  186   3HD1  LEU  22          1HD1      LEU  22   8.835  -4.556  -4.556
  187   1HD2  LEU  22          3HD2      LEU  22   9.955  -1.839  -1.839
  188   2HD2  LEU  22          2HD2      LEU  22  10.079  -2.419  -2.419
  189   3HD2  LEU  22          1HD2      LEU  22   8.654  -2.804  -2.804
  190    H    GLY  23           H        GLY  23  14.560  -3.268  -3.268
  191   1HA   GLY  23          2HA       GLY  23  16.128  -5.002  -5.002
  192   2HA   GLY  23          1HA       GLY  23  16.343  -3.262  -3.262
  193    H    VAL  24           H        VAL  24  18.556  -3.407  -3.407
  194    HA   VAL  24           HA       VAL  24  19.140  -3.982  -3.982
  195    HB   VAL  24           HB       VAL  24  21.102  -5.472  -5.472
  196   1HG1  VAL  24          3HG1      VAL  24  18.743  -6.230  -6.230
  197   2HG1  VAL  24          2HG1      VAL  24  18.521  -6.743  -6.743
  198   3HG1  VAL  24          1HG1      VAL  24  19.816  -7.442  -7.442
  199   1HG2  VAL  24          1HG2      VAL  24  19.670  -5.433  -5.433
  200   2HG2  VAL  24          3HG2      VAL  24  21.345  -4.986  -4.986
  201   3HG2  VAL  24          2HG2      VAL  24  20.843  -6.672  -6.672
  202    H    ASN  25           H        ASN  25  20.478  -3.195  -3.195
  203    HA   ASN  25           HA       ASN  25  22.866  -1.921  -1.921
  204   1HB   ASN  25          2HB       ASN  25  21.841  -2.383  -2.383
  205   2HB   ASN  25          1HB       ASN  25  21.190  -0.759  -0.759
  206   1HD2  ASN  25          2HD2      ASN  25  24.270   0.804   0.804
  207   2HD2  ASN  25          1HD2      ASN  25  22.600   0.970   0.970
  208    H    VAL  26           H        VAL  26  23.110   0.626   0.626
  209    HA   VAL  26           HA       VAL  26  21.068   1.850   1.850
  210    HB   VAL  26           HB       VAL  26  22.916   3.686   3.686
  211   1HG1  VAL  26          3HG1      VAL  26  22.770   0.981   0.981
  212   2HG1  VAL  26          2HG1      VAL  26  24.156   1.998   1.998
  213   3HG1  VAL  26          1HG1      VAL  26  22.520   2.570   2.570
  214   1HG2  VAL  26          3HG2      VAL  26  24.359   2.787   2.787
  215   2HG2  VAL  26          2HG2      VAL  26  25.205   2.847   2.847
  216   3HG2  VAL  26          1HG2      VAL  26  24.591   1.311   1.311
  217    H    MET  27           H        MET  27  22.939   2.473   2.473
  218    HA   MET  27           HA       MET  27  21.699   4.975   4.975
  219   1HB   MET  27          2HB       MET  27  23.772   3.758   3.758
  220   2HB   MET  27          1HB       MET  27  22.560   3.028   3.028
  221   1HG   MET  27          2HG       MET  27  22.026   5.033   5.033
  222   2HG   MET  27          1HG       MET  27  22.430   5.982   5.982
  223   1HE   MET  27          2HE       MET  27  24.173   6.723   6.723
  224   2HE   MET  27          1HE       MET  27  25.820   6.150   6.150
  225   3HE   MET  27          3HE       MET  27  25.219   7.550   7.550
  226    H    LEU  28           H        LEU  28  20.675   1.654   1.654
  227    HA   LEU  28           HA       LEU  28  18.613   1.971   1.971
  228   1HB   LEU  28          2HB       LEU  28  19.359  -0.009  -0.009
  229   2HB   LEU  28          1HB       LEU  28  17.692  -0.057  -0.057
  230    HG   LEU  28           HG       LEU  28  19.113  -1.573  -1.573
  231   1HD1  LEU  28          3HD1      LEU  28  17.191  -0.084  -0.084
  232   2HD1  LEU  28          2HD1      LEU  28  18.507   0.739   0.739
  233   3HD1  LEU  28          1HD1      LEU  28  18.237  -0.984  -0.984
  234   1HD2  LEU  28          1HD2      LEU  28  21.060   0.336   0.336
  235   2HD2  LEU  28          3HD2      LEU  28  21.129  -0.973  -0.973
  236   3HD2  LEU  28          2HD2      LEU  28  20.553   0.622   0.622
  237    H    ARG  29           H        ARG  29  18.098   1.444   1.444
  238    HA   ARG  29           HA       ARG  29  15.440   2.293   2.293
  239   1HB   ARG  29          2HB       ARG  29  15.922   2.842   2.842
  240   2HB   ARG  29          1HB       ARG  29  16.316   1.204   1.204
  241   1HG   ARG  29          2HG       ARG  29  18.267   1.724   1.724
  242   2HG   ARG  29          1HG       ARG  29  18.703   2.345   2.345
  243   1HD   ARG  29          2HD       ARG  29  19.130   4.280   4.280
  244   2HD   ARG  29          1HD       ARG  29  17.382   4.499   4.499
  245    HE   ARG  29           HE       ARG  29  17.333   3.384   3.384
  246   1HH1  ARG  29          1HH2      ARG  29  20.488   3.132   3.132
  247   2HH1  ARG  29          2HH2      ARG  29  21.046   4.209   4.209
  248   1HH2  ARG  29          2HH1      ARG  29  17.904   5.533   5.533
  249   2HH2  ARG  29          1HH1      ARG  29  19.583   5.568   5.568
  250    H    LYS  30           H        LYS  30  18.366   4.273   4.273
  251    HA   LYS  30           HA       LYS  30  17.121   6.712   6.712
  252   1HB   LYS  30          2HB       LYS  30  19.643   6.126   6.126
  253   2HB   LYS  30          1HB       LYS  30  19.497   6.598   6.598
  254   1HG   LYS  30          2HG       LYS  30  20.037   8.649   8.649
  255   2HG   LYS  30          1HG       LYS  30  18.281   8.715   8.715
  256   1HD   LYS  30          2HD       LYS  30  19.021   9.303   9.303
  257   2HD   LYS  30          1HD       LYS  30  18.670   7.581   7.581
  258   1HE   LYS  30          2HE       LYS  30  20.940   6.984   6.984
  259   2HE   LYS  30          1HE       LYS  30  21.425   8.501   8.501
  260   1HZ   LYS  30          1HZ       LYS  30  20.609   9.592   9.592
  261   2HZ   LYS  30          3HZ       LYS  30  20.581   8.041   8.041
  262   3HZ   LYS  30          2HZ       LYS  30  22.045   8.693   8.693
  263    H    ILE  31           H        ILE  31  17.647   5.274   5.274
  264    HA   ILE  31           HA       ILE  31  16.684   7.566   7.566
  265    HB   ILE  31           HB       ILE  31  16.800   4.632   4.632
  266   1HG1  ILE  31          2HG1      ILE  31  18.653   6.755   6.755
  267   2HG1  ILE  31          1HG1      ILE  31  18.922   6.121   6.121
  268   1HG2  ILE  31          3HG2      ILE  31  16.051   7.132   7.132
  269   2HG2  ILE  31          2HG2      ILE  31  16.920   5.863   5.863
  270   3HG2  ILE  31          1HG2      ILE  31  15.359   5.514   5.514
  271   1HD1  ILE  31          1HD1      ILE  31  18.596   3.788   3.788
  272   2HD1  ILE  31          3HD1      ILE  31  19.129   4.730   4.730
  273   3HD1  ILE  31          2HD1      ILE  31  20.164   4.595   4.595
  274    H    ALA  32           H        ALA  32  15.103   4.898   4.898
  275    HA   ALA  32           HA       ALA  32  12.529   5.338   5.338
  276   1HB   ALA  32          3HB       ALA  32  13.411   3.632   3.632
  277   2HB   ALA  32          2HB       ALA  32  11.728   3.736   3.736
  278   3HB   ALA  32          1HB       ALA  32  12.950   3.098   3.098
  279    H    VAL  33           H        VAL  33  14.190   6.470   6.470
  280    HA   VAL  33           HA       VAL  33  11.851   7.517   7.517
  281    HB   VAL  33           HB       VAL  33  14.721   8.412   8.412
  282   1HG1  VAL  33          3HG1      VAL  33  12.730   9.583   9.583
  283   2HG1  VAL  33          2HG1      VAL  33  12.532   8.103   8.103
  284   3HG1  VAL  33          1HG1      VAL  33  14.025   9.034   9.034
  285   1HG2  VAL  33          1HG2      VAL  33  13.751   5.753   5.753
  286   2HG2  VAL  33          3HG2      VAL  33  15.300   6.380   6.380
  287   3HG2  VAL  33          2HG2      VAL  33  13.913   6.374   6.374
  288    H    ALA  34           H        ALA  34  14.276   8.688   8.688
  289    HA   ALA  34           HA       ALA  34  13.303  11.435  11.435
  290   1HB   ALA  34          2HB       ALA  34  15.174  10.006  10.006
  291   2HB   ALA  34          1HB       ALA  34  14.883  11.746  11.746
  292   3HB   ALA  34          3HB       ALA  34  15.667  10.964  10.964
  293    H    ALA  35           H        ALA  35  12.814   8.509   8.509
  294    HA   ALA  35           HA       ALA  35  11.459   9.638   9.638
  295   1HB   ALA  35          3HB       ALA  35  11.586   6.926   6.926
  296   2HB   ALA  35          2HB       ALA  35  10.380   7.231   7.231
  297   3HB   ALA  35          1HB       ALA  35  12.095   7.415   7.415
  298    H    ALA  36           H        ALA  36  10.353   8.491   8.491
  299    HA   ALA  36           HA       ALA  36   7.557   8.707   8.707
  300   1HB   ALA  36          1HB       ALA  36   9.321   8.334   8.334
  301   2HB   ALA  36          3HB       ALA  36   8.011   9.434   9.434
  302   3HB   ALA  36          2HB       ALA  36   7.645   7.823   7.823
  303    H    SER  37           H        SER  37   9.485  11.002  11.002
  304    HA   SER  37           HA       SER  37   9.185  13.313  13.313
  305   1HB   SER  37          2HB       SER  37   8.918  12.941  12.941
  306   2HB   SER  37          1HB       SER  37   8.710  14.540  14.540
  307    HG   SER  37           HG       SER  37  10.776  14.590  14.590
  308    H    LYS  38           H        LYS  38   6.991  12.000  12.000
  309    HA   LYS  38           HA       LYS  38   4.727  12.322  12.322
  310   1HB   LYS  38          2HB       LYS  38   4.875  14.873  14.873
  311   2HB   LYS  38          1HB       LYS  38   3.732  14.486  14.486
  312   1HG   LYS  38          2HG       LYS  38   5.758  14.306  14.306
  313   2HG   LYS  38          1HG       LYS  38   6.688  15.063  15.063
  314   1HD   LYS  38          2HD       LYS  38   4.903  16.902  16.902
  315   2HD   LYS  38          1HD       LYS  38   4.342  16.213  16.213
  316   1HE   LYS  38          2HE       LYS  38   6.374  16.698  16.698
  317   2HE   LYS  38          1HE       LYS  38   7.243  16.928  16.928
  318   1HZ   LYS  38          3HZ       LYS  38   5.630  18.837  18.837
  319   2HZ   LYS  38          2HZ       LYS  38   5.259  18.710  18.710
  320   3HZ   LYS  38          1HZ       LYS  38   6.845  19.070  19.070
  321    HA   PRO  39           HA       PRO  39   3.947  10.768  10.768
  322   1HB   PRO  39          2HB       PRO  39   3.211   8.233   8.233
  323   2HB   PRO  39          1HB       PRO  39   4.862   8.708   8.708
  324   1HG   PRO  39          2HG       PRO  39   3.680   8.210   8.210
  325   2HG   PRO  39          1HG       PRO  39   5.357   8.029   8.029
  326   1HD   PRO  39          2HD       PRO  39   4.367  10.180  10.180
  327   2HD   PRO  39          1HD       PRO  39   5.895  10.173  10.173
  328    H    ALA  40           H        ALA  40   1.844  10.232  10.232
  329    HA   ALA  40           HA       ALA  40  -0.413  10.939  10.939
  330   1HB   ALA  40          1HB       ALA  40  -0.088  12.424  12.424
  331   2HB   ALA  40          3HB       ALA  40  -0.246  11.036  11.036
  332   3HB   ALA  40          2HB       ALA  40  -1.622  11.560  11.560
  333    H    VAL  41           H        VAL  41  -2.552   9.884   9.884
  334    HA   VAL  41           HA       VAL  41  -2.224   7.177   7.177
  335    HB   VAL  41           HB       VAL  41  -3.152   7.731   7.731
  336   1HG1  VAL  41          1HG1      VAL  41  -3.313   5.231   5.231
  337   2HG1  VAL  41          3HG1      VAL  41  -3.415   5.203   5.203
  338   3HG1  VAL  41          2HG1      VAL  41  -4.633   6.065   6.065
  339   1HG2  VAL  41          3HG2      VAL  41  -0.794   6.326   6.326
  340   2HG2  VAL  41          2HG2      VAL  41  -0.803   7.573   7.573
  341   3HG2  VAL  41          1HG2      VAL  41  -1.331   5.935   5.935
  342    H    GLU  42           H        GLU  42  -4.416   6.173   6.173
  343    HA   GLU  42           HA       GLU  42  -6.725   8.011   8.011
  344   1HB   GLU  42          2HB       GLU  42  -5.749   8.584   8.584
  345   2HB   GLU  42          1HB       GLU  42  -5.773   6.886   6.886
  346   1HG   GLU  42          2HG       GLU  42  -8.277   6.922   6.922
  347   2HG   GLU  42          1HG       GLU  42  -8.161   8.665   8.665
  348    H    ILE  43           H        ILE  43  -8.038   6.669   6.669
  349    HA   ILE  43           HA       ILE  43  -8.035   3.773   3.773
  350    HB   ILE  43           HB       ILE  43  -9.153   5.372   5.372
  351   1HG1  ILE  43          2HG1      ILE  43  -7.234   3.227   3.227
  352   2HG1  ILE  43          1HG1      ILE  43  -6.574   4.426   4.426
  353   1HG2  ILE  43          2HG2      ILE  43  -9.543   2.513   2.513
  354   2HG2  ILE  43          1HG2      ILE  43  -9.321   2.884   2.884
  355   3HG2  ILE  43          3HG2      ILE  43 -10.653   3.616   3.616
  356   1HD1  ILE  43          1HD1      ILE  43  -8.008   5.725   5.725
  357   2HD1  ILE  43          3HD1      ILE  43  -6.769   4.642   4.642
  358   3HD1  ILE  43          2HD1      ILE  43  -6.328   5.919   5.919
  359    H    LYS  44           H        LYS  44  -9.790   2.717   2.717
  360    HA   LYS  44           HA       LYS  44 -12.232   4.343   4.343
  361   1HB   LYS  44          2HB       LYS  44 -11.926   1.938   1.938
  362   2HB   LYS  44          1HB       LYS  44 -12.271   3.590   3.590
  363   1HG   LYS  44          2HG       LYS  44  -9.910   4.151   4.151
  364   2HG   LYS  44          1HG       LYS  44  -9.494   2.615   2.615
  365   1HD   LYS  44          2HD       LYS  44  -9.769   1.432   1.432
  366   2HD   LYS  44          1HD       LYS  44 -11.052   2.492   2.492
  367   1HE   LYS  44          2HE       LYS  44  -8.211   3.475   3.475
  368   2HE   LYS  44          1HE       LYS  44  -8.760   2.601   2.601
  369   1HZ   LYS  44          2HZ       LYS  44 -10.277   4.904   4.904
  370   2HZ   LYS  44          1HZ       LYS  44  -8.957   5.133   5.133
  371   3HZ   LYS  44          3HZ       LYS  44 -10.302   4.239   4.239
  372    H    GLN  45           H        GLN  45 -13.825   3.661   3.661
  373    HA   GLN  45           HA       GLN  45 -13.696   0.860   0.860
  374   1HB   GLN  45          2HB       GLN  45 -13.890   2.642   2.642
  375   2HB   GLN  45          1HB       GLN  45 -15.399   3.182   3.182
  376   1HG   GLN  45          2HG       GLN  45 -16.468   1.058   1.058
  377   2HG   GLN  45          1HG       GLN  45 -14.951   0.389   0.389
  378   1HE2  GLN  45          2HE2      GLN  45 -16.214   1.369   1.369
  379   2HE2  GLN  45          1HE2      GLN  45 -15.966   0.054   0.054
  380    H    GLU  46           H        GLU  46 -14.899  -0.630  -0.630
  381    HA   GLU  46           HA       GLU  46 -17.526   0.203   0.203
  382   1HB   GLU  46          2HB       GLU  46 -15.384  -1.640  -1.640
  383   2HB   GLU  46          1HB       GLU  46 -17.059  -2.088  -2.088
  384   1HG   GLU  46          2HG       GLU  46 -16.684  -0.760  -0.760
  385   2HG   GLU  46          1HG       GLU  46 -17.202   0.489   0.489
  386    H    GLY  47           H        GLY  47 -17.560  -0.304  -0.304
  387   1HA   GLY  47          2HA       GLY  47 -19.001  -1.604  -1.604
  388   2HA   GLY  47          1HA       GLY  47 -19.002  -2.883  -2.883
  389    H    ASP  48           H        ASP  48 -17.980  -4.676  -4.676
  390    HA   ASP  48           HA       ASP  48 -15.990  -4.516  -4.516
  391   1HB   ASP  48          2HB       ASP  48 -15.706  -7.003  -7.003
  392   2HB   ASP  48          1HB       ASP  48 -17.276  -6.514  -6.514
  393    H    THR  49           H        THR  49 -15.745  -3.858  -3.858
  394    HA   THR  49           HA       THR  49 -13.089  -5.101  -5.101
  395    HB   THR  49           HB       THR  49 -14.963  -3.644  -3.644
  396    HG1  THR  49           HG1      THR  49 -15.558  -5.708  -5.708
  397   1HG2  THR  49          3HG2      THR  49 -12.071  -4.115  -4.115
  398   2HG2  THR  49          2HG2      THR  49 -13.009  -4.730  -4.730
  399   3HG2  THR  49          1HG2      THR  49 -13.114  -3.027  -3.027
  400    H    PHE  50           H        PHE  50 -11.223  -3.872  -3.872
  401    HA   PHE  50           HA       PHE  50 -11.492  -0.929  -0.929
  402   1HB   PHE  50          2HB       PHE  50  -9.807  -2.689  -2.689
  403   2HB   PHE  50          1HB       PHE  50  -9.736  -0.924  -0.924
  404    HD1  PHE  50           HD2      PHE  50 -11.791   0.415   0.415
  405    HD2  PHE  50           HD1      PHE  50 -11.576  -3.829  -3.829
  406    HE1  PHE  50           HE2      PHE  50 -13.782   0.518   0.518
  407    HE2  PHE  50           HE1      PHE  50 -13.567  -3.728  -3.728
  408    HZ   PHE  50           HZ       PHE  50 -14.679  -1.561  -1.561
  409    H    TYR  51           H        TYR  51 -10.408  -0.154  -0.154
  410    HA   TYR  51           HA       TYR  51  -8.021  -1.580  -1.580
  411   1HB   TYR  51          2HB       TYR  51  -9.887  -1.039  -1.039
  412   2HB   TYR  51          1HB       TYR  51  -9.677   0.667   0.667
  413    HD1  TYR  51           HD1      TYR  51  -7.278   1.619   1.619
  414    HD2  TYR  51           HD2      TYR  51  -8.675  -1.994  -1.994
  415    HE1  TYR  51           HE1      TYR  51  -5.514   1.800   1.800
  416    HE2  TYR  51           HE2      TYR  51  -6.908  -1.809  -1.809
  417    HH   TYR  51           HH       TYR  51  -5.533   0.132   0.132
  418    H    ILE  52           H        ILE  52  -6.016  -0.366  -0.366
  419    HA   ILE  52           HA       ILE  52  -6.077   2.321   2.321
  420    HB   ILE  52           HB       ILE  52  -3.950   0.414   0.414
  421   1HG1  ILE  52          2HG1      ILE  52  -6.818   0.444   0.444
  422   2HG1  ILE  52          1HG1      ILE  52  -5.965  -0.925  -0.925
  423   1HG2  ILE  52          2HG2      ILE  52  -4.145   2.928   2.928
  424   2HG2  ILE  52          1HG2      ILE  52  -5.503   2.481   2.481
  425   3HG2  ILE  52          3HG2      ILE  52  -3.894   1.841   1.841
  426   1HD1  ILE  52          1HD1      ILE  52  -4.328  -0.136  -0.136
  427   2HD1  ILE  52          3HD1      ILE  52  -5.964   0.043   0.043
  428   3HD1  ILE  52          2HD1      ILE  52  -5.432  -1.511  -1.511
  429    H    LYS  53           H        LYS  53  -5.201   3.572   3.572
  430    HA   LYS  53           HA       LYS  53  -2.813   2.576   2.576
  431   1HB   LYS  53          2HB       LYS  53  -4.739   3.466   3.466
  432   2HB   LYS  53          1HB       LYS  53  -4.549   5.016   5.016
  433   1HG   LYS  53          2HG       LYS  53  -2.548   5.485   5.485
  434   2HG   LYS  53          1HG       LYS  53  -2.173   3.783   3.783
  435   1HD   LYS  53          2HD       LYS  53  -2.799   4.557   4.557
  436   2HD   LYS  53          1HD       LYS  53  -4.262   3.778   3.778
  437   1HE   LYS  53          2HE       LYS  53  -5.105   5.818   5.818
  438   2HE   LYS  53          1HE       LYS  53  -4.807   6.171   6.171
  439   1HZ   LYS  53          1HZ       LYS  53  -2.784   6.668   6.668
  440   2HZ   LYS  53          3HZ       LYS  53  -3.933   7.834   7.834
  441   3HZ   LYS  53          2HZ       LYS  53  -2.813   7.266   7.266
  442    H    THR  54           H        THR  54  -0.956   3.175   3.175
  443    HA   THR  54           HA       THR  54  -0.900   5.823   5.823
  444    HB   THR  54           HB       THR  54   1.205   3.635   3.635
  445    HG1  THR  54           HG1      THR  54  -0.969   4.129   4.129
  446   1HG2  THR  54          1HG2      THR  54   1.201   6.290   6.290
  447   2HG2  THR  54          3HG2      THR  54   0.909   5.308   5.308
  448   3HG2  THR  54          2HG2      THR  54   2.340   5.020   5.020
  449    H    SER  55           H        SER  55   0.383   7.466   7.466
  450    HA   SER  55           HA       SER  55   2.120   6.718   6.718
  451   1HB   SER  55          2HB       SER  55   1.365   9.198   9.198
  452   2HB   SER  55          1HB       SER  55   0.473   7.757   7.757
  453    HG   SER  55           HG       SER  55  -1.112   8.746   8.746
  454    H    THR  56           H        THR  56   4.161   7.291   7.291
  455    HA   THR  56           HA       THR  56   4.762   9.417   9.417
  456    HB   THR  56           HB       THR  56   7.191   8.384   8.384
  457    HG1  THR  56           HG1      THR  56   6.904   6.155   6.155
  458   1HG2  THR  56          3HG2      THR  56   5.164   7.275   7.275
  459   2HG2  THR  56          2HG2      THR  56   6.885   6.882   6.882
  460   3HG2  THR  56          1HG2      THR  56   6.353   8.540   8.540
  461    H    THR  57           H        THR  57   7.209  10.291  10.291
  462    HA   THR  57           HA       THR  57   6.662  12.288  12.288
  463    HB   THR  57           HB       THR  57   8.646  12.321  12.321
  464    HG1  THR  57           HG1      THR  57   9.441  12.136  12.136
  465   1HG2  THR  57          1HG2      THR  57   9.050   9.839   9.839
  466   2HG2  THR  57          3HG2      THR  57   9.748  10.116  10.116
  467   3HG2  THR  57          2HG2      THR  57  10.503  10.824  10.824
  468    H    VAL  58           H        VAL  58   8.035   9.050   9.050
  469    HA   VAL  58           HA       VAL  58   7.363   9.484   9.484
  470    HB   VAL  58           HB       VAL  58   9.845   8.104   8.104
  471   1HG1  VAL  58          1HG1      VAL  58   8.604   8.618   8.618
  472   2HG1  VAL  58          3HG1      VAL  58  10.360   8.742   8.742
  473   3HG1  VAL  58          2HG1      VAL  58   9.554   7.236   7.236
  474   1HG2  VAL  58          2HG2      VAL  58   9.244  10.947  10.947
  475   2HG2  VAL  58          1HG2      VAL  58  10.572  10.228  10.228
  476   3HG2  VAL  58          3HG2      VAL  58  10.673  10.351  10.351
  477    H    ARG  59           H        ARG  59   6.978   7.422   7.422
  478    HA   ARG  59           HA       ARG  59   6.559   5.070   5.070
  479   1HB   ARG  59          2HB       ARG  59   7.972   5.022   5.022
  480   2HB   ARG  59          1HB       ARG  59   6.386   4.872   4.872
  481   1HG   ARG  59          2HG       ARG  59   5.988   2.798   2.798
  482   2HG   ARG  59          1HG       ARG  59   6.910   3.139   3.139
  483   1HD   ARG  59          2HD       ARG  59   8.918   3.218   3.218
  484   2HD   ARG  59          1HD       ARG  59   7.844   2.086   2.086
  485    HE   ARG  59           HE       ARG  59   7.889   0.793   0.793
  486   1HH1  ARG  59          1HH2      ARG  59   9.527   2.161   2.161
  487   2HH1  ARG  59          2HH2      ARG  59  11.151   1.683   1.683
  488   1HH2  ARG  59          2HH1      ARG  59  10.366   0.483   0.483
  489   2HH2  ARG  59          1HH1      ARG  59  11.626   0.734   0.734
  490    H    THR  60           H        THR  60   4.652   3.621   3.621
  491    HA   THR  60           HA       THR  60   2.375   5.029   5.029
  492    HB   THR  60           HB       THR  60   2.182   4.156   4.156
  493    HG1  THR  60           HG1      THR  60   2.627   6.163   6.163
  494   1HG2  THR  60          1HG2      THR  60   0.412   5.682   5.682
  495   2HG2  THR  60          3HG2      THR  60   0.149   5.706   5.706
  496   3HG2  THR  60          2HG2      THR  60   0.044   4.185   4.185
  497    H    THR  61           H        THR  61   2.295   3.179   3.179
  498    HA   THR  61           HA       THR  61   2.109   0.483   0.483
  499    HB   THR  61           HB       THR  61   1.435   0.041   0.041
  500    HG1  THR  61           HG1      THR  61   3.004   2.371   2.371
  501   1HG2  THR  61          2HG2      THR  61   3.558  -0.551  -0.551
  502   2HG2  THR  61          1HG2      THR  61   4.272   0.870   0.870
  503   3HG2  THR  61          3HG2      THR  61   3.700  -0.472  -0.472
  504    H    GLU  62           H        GLU  62   0.198  -0.917  -0.917
  505    HA   GLU  62           HA       GLU  62  -2.357   0.462   0.462
  506   1HB   GLU  62          2HB       GLU  62  -1.486  -0.457  -0.457
  507   2HB   GLU  62          1HB       GLU  62  -3.152  -0.804  -0.804
  508   1HG   GLU  62          2HG       GLU  62  -3.585   1.540   1.540
  509   2HG   GLU  62          1HG       GLU  62  -1.886   1.940   1.940
  510    H    ILE  63           H        ILE  63  -3.557  -0.921  -0.921
  511    HA   ILE  63           HA       ILE  63  -3.147  -3.874  -3.874
  512    HB   ILE  63           HB       ILE  63  -3.593  -4.139  -4.139
  513   1HG1  ILE  63          2HG1      ILE  63  -3.269  -1.126  -1.126
  514   2HG1  ILE  63          1HG1      ILE  63  -4.826  -1.947  -1.947
  515   1HG2  ILE  63          3HG2      ILE  63  -1.275  -3.992  -3.992
  516   2HG2  ILE  63          2HG2      ILE  63  -1.294  -2.257  -2.257
  517   3HG2  ILE  63          1HG2      ILE  63  -1.391  -3.402  -3.402
  518   1HD1  ILE  63          1HD1      ILE  63  -2.719  -2.968  -2.968
  519   2HD1  ILE  63          3HD1      ILE  63  -3.307  -1.342  -1.342
  520   3HD1  ILE  63          2HD1      ILE  63  -4.435  -2.696  -2.696
  521    H    ASN  64           H        ASN  64  -5.167  -5.130  -5.130
  522    HA   ASN  64           HA       ASN  64  -7.660  -3.625  -3.625
  523   1HB   ASN  64          2HB       ASN  64  -8.687  -4.590  -4.590
  524   2HB   ASN  64          1HB       ASN  64  -7.389  -3.452  -3.452
  525   1HD2  ASN  64          2HD2      ASN  64  -5.101  -5.999  -5.999
  526   2HD2  ASN  64          1HD2      ASN  64  -5.143  -4.535  -4.535
  527    H    PHE  65           H        PHE  65  -9.039  -4.898  -4.898
  528    HA   PHE  65           HA       PHE  65  -9.150  -7.805  -7.805
  529   1HB   PHE  65          2HB       PHE  65  -8.330  -8.444  -8.444
  530   2HB   PHE  65          1HB       PHE  65  -7.089  -7.523  -7.523
  531    HD1  PHE  65           HD2      PHE  65  -6.640  -5.140  -5.140
  532    HD2  PHE  65           HD1      PHE  65  -9.442  -7.574  -7.574
  533    HE1  PHE  65           HE2      PHE  65  -6.656  -3.483  -3.483
  534    HE2  PHE  65           HE1      PHE  65  -9.466  -5.925  -5.925
  535    HZ   PHE  65           HZ       PHE  65  -8.073  -3.872  -3.872
  536    H    LYS  66           H        LYS  66 -10.308  -8.720  -8.720
  537    HA   LYS  66           HA       LYS  66 -12.545  -6.886  -6.886
  538   1HB   LYS  66          2HB       LYS  66 -14.091  -8.855  -8.855
  539   2HB   LYS  66          1HB       LYS  66 -13.468  -8.368  -8.368
  540   1HG   LYS  66          2HG       LYS  66 -12.120 -10.231 -10.231
  541   2HG   LYS  66          1HG       LYS  66 -11.921 -10.396 -10.396
  542   1HD   LYS  66          2HD       LYS  66 -14.579 -10.868 -10.868
  543   2HD   LYS  66          1HD       LYS  66 -13.399 -12.157 -12.157
  544   1HE   LYS  66          2HE       LYS  66 -13.721 -12.247 -12.247
  545   2HE   LYS  66          1HE       LYS  66 -14.010 -10.512 -10.512
  546   1HZ   LYS  66          1HZ       LYS  66 -15.950 -12.298 -12.298
  547   2HZ   LYS  66          3HZ       LYS  66 -15.974 -12.072 -12.072
  548   3HZ   LYS  66          2HZ       LYS  66 -16.203 -10.746 -10.746
  549    H    VAL  67           H        VAL  67 -13.511  -7.470  -7.470
  550    HA   VAL  67           HA       VAL  67 -11.438  -8.547  -8.547
  551    HB   VAL  67           HB       VAL  67 -14.053  -7.984  -7.984
  552   1HG1  VAL  67          2HG1      VAL  67 -11.234  -6.934  -6.934
  553   2HG1  VAL  67          1HG1      VAL  67 -12.588  -6.623  -6.623
  554   3HG1  VAL  67          3HG1      VAL  67 -11.981  -8.266  -8.266
  555   1HG2  VAL  67          2HG2      VAL  67 -12.729  -5.952  -5.952
  556   2HG2  VAL  67          1HG2      VAL  67 -14.444  -6.202  -6.202
  557   3HG2  VAL  67          3HG2      VAL  67 -13.421  -5.425  -5.425
  558    H    GLY  68           H        GLY  68 -11.385 -10.804 -10.804
  559   1HA   GLY  68          2HA       GLY  68 -12.782 -12.593 -12.593
  560   2HA   GLY  68          1HA       GLY  68 -13.900 -12.330 -12.330
  561    H    GLU  69           H        GLU  69 -11.570 -11.957 -11.957
  562    HA   GLU  69           HA       GLU  69 -10.711 -14.829 -14.829
  563   1HB   GLU  69          2HB       GLU  69 -11.373 -15.105 -15.105
  564   2HB   GLU  69          1HB       GLU  69 -12.554 -13.897 -13.897
  565   1HG   GLU  69          2HG       GLU  69 -11.114 -12.122 -12.122
  566   2HG   GLU  69          1HG       GLU  69  -9.941 -13.341 -13.341
  567    H    GLU  70           H        GLU  70  -8.688 -15.229 -15.229
  568    HA   GLU  70           HA       GLU  70  -6.735 -13.090 -13.090
  569   1HB   GLU  70          2HB       GLU  70  -6.253 -15.851 -15.851
  570   2HB   GLU  70          1HB       GLU  70  -5.052 -14.776 -14.776
  571   1HG   GLU  70          2HG       GLU  70  -5.949 -15.048 -15.048
  572   2HG   GLU  70          1HG       GLU  70  -7.442 -15.758 -15.758
  573    H    PHE  71           H        PHE  71  -5.061 -12.644 -12.644
  574    HA   PHE  71           HA       PHE  71  -5.878 -13.055 -13.055
  575   1HB   PHE  71          2HB       PHE  71  -6.093 -10.598 -10.598
  576   2HB   PHE  71          1HB       PHE  71  -7.383 -11.223 -11.223
  577    HD1  PHE  71           HD2      PHE  71  -7.155 -10.966 -10.966
  578    HD2  PHE  71           HD1      PHE  71  -4.659  -8.876  -8.876
  579    HE1  PHE  71           HE2      PHE  71  -6.505  -9.360  -9.360
  580    HE2  PHE  71           HE1      PHE  71  -4.006  -7.273  -7.273
  581    HZ   PHE  71           HZ       PHE  71  -4.928  -7.512  -7.512
  582    H    GLU  72           H        GLU  72  -4.382 -11.657 -11.657
  583    HA   GLU  72           HA       GLU  72  -1.670 -11.689 -11.689
  584   1HB   GLU  72          2HB       GLU  72  -2.151 -11.352 -11.352
  585   2HB   GLU  72          1HB       GLU  72  -0.738 -11.998 -11.998
  586   1HG   GLU  72          2HG       GLU  72  -2.109 -13.966 -13.966
  587   2HG   GLU  72          1HG       GLU  72  -3.439 -13.350 -13.350
  588    H    GLU  73           H        GLU  73  -0.394  -9.811  -9.811
  589    HA   GLU  73           HA       GLU  73  -1.332  -7.398  -7.398
  590   1HB   GLU  73          2HB       GLU  73  -1.517  -6.071  -6.071
  591   2HB   GLU  73          1HB       GLU  73  -2.783  -7.287  -7.287
  592   1HG   GLU  73          2HG       GLU  73  -1.971  -8.571  -8.571
  593   2HG   GLU  73          1HG       GLU  73  -0.292  -8.165  -8.165
  594    H    GLN  74           H        GLN  74   0.117  -5.478  -5.478
  595    HA   GLN  74           HA       GLN  74   2.908  -6.569  -6.569
  596   1HB   GLN  74          2HB       GLN  74   1.622  -4.009  -4.009
  597   2HB   GLN  74          1HB       GLN  74   3.263  -3.895  -3.895
  598   1HG   GLN  74          2HG       GLN  74   3.590  -6.009  -6.009
  599   2HG   GLN  74          1HG       GLN  74   2.290  -5.183  -5.183
  600   1HE2  GLN  74          2HE2      GLN  74   6.029  -3.684  -3.684
  601   2HE2  GLN  74          1HE2      GLN  74   5.683  -5.178  -5.178
  602    H    THR  75           H        THR  75   4.476  -5.703  -5.703
  603    HA   THR  75           HA       THR  75   3.195  -5.124  -5.124
  604    HB   THR  75           HB       THR  75   4.881  -6.994  -6.994
  605    HG1  THR  75           HG1      THR  75   5.117  -6.704  -6.704
  606   1HG2  THR  75          2HG2      THR  75   6.443  -4.875  -4.875
  607   2HG2  THR  75          1HG2      THR  75   7.248  -5.447  -5.447
  608   3HG2  THR  75          3HG2      THR  75   6.866  -6.577  -6.577
  609    H    VAL  76           H        VAL  76   5.935  -3.834  -3.834
  610    HA   VAL  76           HA       VAL  76   5.280  -1.158  -1.158
  611    HB   VAL  76           HB       VAL  76   6.593  -1.808  -1.808
  612   1HG1  VAL  76          1HG1      VAL  76   5.766   0.727   0.727
  613   2HG1  VAL  76          3HG1      VAL  76   5.789   0.655   0.655
  614   3HG1  VAL  76          2HG1      VAL  76   7.270   0.369   0.369
  615   1HG2  VAL  76          1HG2      VAL  76   4.006  -2.325  -2.325
  616   2HG2  VAL  76          3HG2      VAL  76   4.536  -1.718  -1.718
  617   3HG2  VAL  76          2HG2      VAL  76   3.874  -0.607  -0.607
  618    H    ASP  77           H        ASP  77   7.784  -3.539  -3.539
  619    HA   ASP  77           HA       ASP  77   9.930  -1.600  -1.600
  620   1HB   ASP  77          2HB       ASP  77   9.928  -3.952  -3.952
  621   2HB   ASP  77          1HB       ASP  77  10.475  -4.498  -4.498
  622    H    GLY  78           H        GLY  78   8.112  -4.123  -4.123
  623   1HA   GLY  78          2HA       GLY  78   7.737  -3.502  -3.502
  624   2HA   GLY  78          1HA       GLY  78   9.498  -3.437  -3.437
  625    H    ARG  79           H        ARG  79   7.389  -5.737  -5.737
  626    HA   ARG  79           HA       ARG  79   8.441  -7.913  -7.913
  627   1HB   ARG  79          2HB       ARG  79   8.456  -7.627  -7.627
  628   2HB   ARG  79          1HB       ARG  79   8.386  -9.225  -9.225
  629   1HG   ARG  79          2HG       ARG  79  10.400  -8.466  -8.466
  630   2HG   ARG  79          1HG       ARG  79  10.543  -7.141  -7.141
  631   1HD   ARG  79          2HD       ARG  79  11.987  -8.968  -8.968
  632   2HD   ARG  79          1HD       ARG  79  10.648  -8.808  -8.808
  633    HE   ARG  79           HE       ARG  79   9.833 -10.662 -10.662
  634   1HH1  ARG  79          1HH2      ARG  79  10.941 -10.554 -10.554
  635   2HH1  ARG  79          2HH2      ARG  79  11.680 -12.121 -12.121
  636   1HH2  ARG  79          2HH1      ARG  79  11.360 -12.583 -12.583
  637   2HH2  ARG  79          1HH1      ARG  79  11.917 -13.270 -13.270
  638    HA   PRO  80           HA       PRO  80   4.152  -9.053  -9.053
  639   1HB   PRO  80          2HB       PRO  80   4.383 -11.702 -11.702
  640   2HB   PRO  80          1HB       PRO  80   4.587 -10.357 -10.357
  641   1HG   PRO  80          2HG       PRO  80   6.658 -12.126 -12.126
  642   2HG   PRO  80          1HG       PRO  80   6.701 -11.227 -11.227
  643   1HD   PRO  80          2HD       PRO  80   7.980 -10.473 -10.473
  644   2HD   PRO  80          1HD       PRO  80   7.753  -9.445  -9.445
  645    H    CYS  81           H        CYS  81   2.660  -9.958  -9.958
  646    HA   CYS  81           HA       CYS  81   3.356 -12.135 -12.135
  647   1HB   CYS  81          2HB       CYS  81   2.912 -10.769 -10.769
  648   2HB   CYS  81          1HB       CYS  81   4.419 -10.357 -10.357
  649    HG   CYS  81           HG       CYS  81   1.823  -8.641  -8.641
  650    H    LYS  82           H        LYS  82   1.497 -13.097 -13.097
  651    HA   LYS  82           HA       LYS  82  -1.062 -12.091 -12.091
  652   1HB   LYS  82          2HB       LYS  82  -0.518 -14.479 -14.479
  653   2HB   LYS  82          1HB       LYS  82  -0.373 -14.630 -14.630
  654   1HG   LYS  82          2HG       LYS  82  -2.807 -13.699 -13.699
  655   2HG   LYS  82          1HG       LYS  82  -2.832 -14.196 -14.196
  656   1HD   LYS  82          2HD       LYS  82  -1.766 -16.176 -16.176
  657   2HD   LYS  82          1HD       LYS  82  -3.501 -15.871 -15.871
  658   1HE   LYS  82          2HE       LYS  82  -2.378 -16.205 -16.205
  659   2HE   LYS  82          1HE       LYS  82  -2.341 -17.648 -17.648
  660   1HZ   LYS  82          3HZ       LYS  82  -4.755 -15.973 -15.973
  661   2HZ   LYS  82          2HZ       LYS  82  -4.414 -17.380 -17.380
  662   3HZ   LYS  82          1HZ       LYS  82  -4.673 -17.473 -17.473
  663    H    SER  83           H        SER  83  -2.172 -10.690 -10.690
  664    HA   SER  83           HA       SER  83  -1.676 -10.629 -10.629
  665   1HB   SER  83          2HB       SER  83  -1.448  -8.468  -8.468
  666   2HB   SER  83          1HB       SER  83  -2.768  -8.691  -8.691
  667    HG   SER  83           HG       SER  83  -3.258  -7.348  -7.348
  668    H    LEU  84           H        LEU  84  -3.653 -10.116 -10.116
  669    HA   LEU  84           HA       LEU  84  -6.233 -11.090 -11.090
  670   1HB   LEU  84          2HB       LEU  84  -5.176 -13.194 -13.194
  671   2HB   LEU  84          1HB       LEU  84  -4.805 -12.472 -12.472
  672    HG   LEU  84           HG       LEU  84  -7.209 -12.212 -12.212
  673   1HD1  LEU  84          1HD1      LEU  84  -7.910 -11.982 -11.982
  674   2HD1  LEU  84          3HD1      LEU  84  -7.654 -13.712 -13.712
  675   3HD1  LEU  84          2HD1      LEU  84  -8.892 -13.119 -13.119
  676   1HD2  LEU  84          3HD2      LEU  84  -5.802 -14.460 -14.460
  677   2HD2  LEU  84          2HD2      LEU  84  -7.523 -14.412 -14.412
  678   3HD2  LEU  84          1HD2      LEU  84  -6.985 -15.040 -15.040
  679    H    VAL  85           H        VAL  85  -7.982 -10.417 -10.417
  680    HA   VAL  85           HA       VAL  85  -7.071  -8.706  -8.706
  681    HB   VAL  85           HB       VAL  85  -8.867  -7.694  -7.694
  682   1HG1  VAL  85          1HG1      VAL  85  -8.452  -6.831  -6.831
  683   2HG1  VAL  85          3HG1      VAL  85  -7.700  -5.642  -5.642
  684   3HG1  VAL  85          2HG1      VAL  85  -9.404  -6.050  -6.050
  685   1HG2  VAL  85          3HG2      VAL  85  -5.945  -7.251  -7.251
  686   2HG2  VAL  85          2HG2      VAL  85  -6.649  -7.844  -7.844
  687   3HG2  VAL  85          1HG2      VAL  85  -6.871  -6.160  -6.160
  688    H    LYS  86           H        LYS  86  -8.397  -8.720  -8.720
  689    HA   LYS  86           HA       LYS  86 -11.202  -9.656  -9.656
  690   1HB   LYS  86          2HB       LYS  86 -10.762 -10.406 -10.406
  691   2HB   LYS  86          1HB       LYS  86 -10.448 -11.489 -11.489
  692   1HG   LYS  86          2HG       LYS  86  -8.055 -10.670 -10.670
  693   2HG   LYS  86          1HG       LYS  86  -8.433  -9.795  -9.795
  694   1HD   LYS  86          2HD       LYS  86  -7.454 -11.938 -11.938
  695   2HD   LYS  86          1HD       LYS  86  -9.165 -11.964 -11.964
  696   1HE   LYS  86          2HE       LYS  86  -9.728 -13.350 -13.350
  697   2HE   LYS  86          1HE       LYS  86  -8.254 -12.952 -12.952
  698   1HZ   LYS  86          2HZ       LYS  86  -7.007 -14.086 -14.086
  699   2HZ   LYS  86          1HZ       LYS  86  -8.491 -14.616 -14.616
  700   3HZ   LYS  86          3HZ       LYS  86  -8.003 -15.120 -15.120
  701    H    TRP  87           H        TRP  87 -12.650  -8.688  -8.688
  702    HA   TRP  87           HA       TRP  87 -11.861  -5.916  -5.916
  703   1HB   TRP  87          2HB       TRP  87 -14.375  -7.525  -7.525
  704   2HB   TRP  87          1HB       TRP  87 -14.202  -5.900  -5.900
  705    HD1  TRP  87           HD1      TRP  87 -15.079  -7.773  -7.773
  706    HE1  TRP  87           HE1      TRP  87 -15.418  -6.176  -6.176
  707    HE3  TRP  87           HE3      TRP  87 -13.120  -3.514  -3.514
  708    HZ2  TRP  87           HZ2      TRP  87 -14.919  -3.440  -3.440
  709    HZ3  TRP  87           HZ3      TRP  87 -13.037  -1.429  -1.429
  710    HH2  TRP  87           HH2      TRP  87 -13.935  -1.389  -1.389
  711    H    GLU  88           H        GLU  88 -12.432  -5.041  -5.041
  712    HA   GLU  88           HA       GLU  88 -11.717  -6.916  -6.916
  713   1HB   GLU  88          2HB       GLU  88  -9.787  -5.393  -5.393
  714   2HB   GLU  88          1HB       GLU  88 -10.682  -4.089  -4.089
  715   1HG   GLU  88          2HG       GLU  88  -9.143  -4.862  -4.862
  716   2HG   GLU  88          1HG       GLU  88 -10.715  -5.514  -5.514
  717    H    SER  89           H        SER  89 -12.868  -3.721  -3.721
  718    HA   SER  89           HA       SER  89 -14.947  -3.857  -3.857
  719   1HB   SER  89          2HB       SER  89 -14.575  -1.567  -1.567
  720   2HB   SER  89          1HB       SER  89 -12.972  -2.297  -2.297
  721    HG   SER  89           HG       SER  89 -13.864  -0.236  -0.236
  722    H    GLU  90           H        GLU  90 -16.026  -1.264  -1.264
  723    HA   GLU  90           HA       GLU  90 -17.501  -2.241  -2.241
  724   1HB   GLU  90          2HB       GLU  90 -18.619   0.007   0.007
  725   2HB   GLU  90          1HB       GLU  90 -18.670  -0.880  -0.880
  726   1HG   GLU  90          2HG       GLU  90 -17.010   0.466   0.466
  727   2HG   GLU  90          1HG       GLU  90 -16.430   1.050   1.050
  728    H    ASN  91           H        ASN  91 -14.731  -0.163  -0.163
  729    HA   ASN  91           HA       ASN  91 -14.510   0.096   0.096
  730   1HB   ASN  91          2HB       ASN  91 -14.089   2.444   2.444
  731   2HB   ASN  91          1HB       ASN  91 -14.055   2.452   2.452
  732   1HD2  ASN  91          2HD2      ASN  91 -17.502   3.260   3.260
  733   2HD2  ASN  91          1HD2      ASN  91 -15.965   3.520   3.520
  734    H    LYS  92           H        LYS  92 -13.031  -1.459  -1.459
  735    HA   LYS  92           HA       LYS  92 -10.333  -0.369  -0.369
  736   1HB   LYS  92          2HB       LYS  92 -10.753   0.199   0.199
  737   2HB   LYS  92          1HB       LYS  92 -11.280  -1.446  -1.446
  738   1HG   LYS  92          2HG       LYS  92  -9.047  -2.309  -2.309
  739   2HG   LYS  92          1HG       LYS  92  -8.494  -0.730  -0.730
  740   1HD   LYS  92          2HD       LYS  92  -8.928   0.217   0.217
  741   2HD   LYS  92          1HD       LYS  92  -9.497  -1.356  -1.356
  742   1HE   LYS  92          2HE       LYS  92  -7.104  -2.100  -2.100
  743   2HE   LYS  92          1HE       LYS  92  -6.722  -0.433  -0.433
  744   1HZ   LYS  92          3HZ       LYS  92  -7.852  -1.006  -1.006
  745   2HZ   LYS  92          2HZ       LYS  92  -7.643  -2.628  -2.628
  746   3HZ   LYS  92          1HZ       LYS  92  -6.293  -1.614  -1.614
  747    H    MET  93           H        MET  93  -9.648  -1.881  -1.881
  748    HA   MET  93           HA       MET  93 -10.079  -4.757  -4.757
  749   1HB   MET  93          2HB       MET  93  -9.590  -5.076  -5.076
  750   2HB   MET  93          1HB       MET  93 -11.192  -4.556  -4.556
  751   1HG   MET  93          2HG       MET  93 -10.912  -2.419  -2.419
  752   2HG   MET  93          1HG       MET  93  -9.173  -2.432  -2.432
  753   1HE   MET  93          2HE       MET  93 -11.509  -4.953  -4.953
  754   2HE   MET  93          1HE       MET  93 -12.111  -3.501  -3.501
  755   3HE   MET  93          3HE       MET  93 -11.306  -4.762  -4.762
  756    H    VAL  94           H        VAL  94  -8.352  -6.178  -6.178
  757    HA   VAL  94           HA       VAL  94  -5.660  -4.899  -4.899
  758    HB   VAL  94           HB       VAL  94  -6.049  -7.740  -7.740
  759   1HG1  VAL  94          3HG1      VAL  94  -3.969  -5.862  -5.862
  760   2HG1  VAL  94          2HG1      VAL  94  -4.480  -6.011  -6.011
  761   3HG1  VAL  94          1HG1      VAL  94  -3.982  -7.441  -7.441
  762   1HG2  VAL  94          1HG2      VAL  94  -6.881  -5.341  -5.341
  763   2HG2  VAL  94          3HG2      VAL  94  -7.889  -6.712  -6.712
  764   3HG2  VAL  94          2HG2      VAL  94  -6.566  -6.937  -6.937
  765    H    CYS  95           H        CYS  95  -3.910  -6.474  -6.474
  766    HA   CYS  95           HA       CYS  95  -5.002  -8.112  -8.112
  767   1HB   CYS  95          2HB       CYS  95  -4.684  -5.856  -5.856
  768   2HB   CYS  95          1HB       CYS  95  -3.014  -5.855  -5.855
  769    HG   CYS  95           HG       CYS  95  -2.536  -6.876  -6.876
  770    H    GLU  96           H        GLU  96  -3.732  -9.822  -9.822
  771    HA   GLU  96           HA       GLU  96  -1.081 -10.042 -10.042
  772   1HB   GLU  96          2HB       GLU  96  -1.395 -12.521 -12.521
  773   2HB   GLU  96          1HB       GLU  96  -2.609 -11.792 -11.792
  774   1HG   GLU  96          2HG       GLU  96  -4.259 -11.815 -11.815
  775   2HG   GLU  96          1HG       GLU  96  -3.058 -12.189 -12.189
  776    H    GLN  97           H        GLN  97   0.658 -10.964 -10.964
  777    HA   GLN  97           HA       GLN  97   0.017 -11.115 -11.115
  778   1HB   GLN  97          2HB       GLN  97   0.530  -8.684  -8.684
  779   2HB   GLN  97          1HB       GLN  97   2.196  -9.241  -9.241
  780   1HG   GLN  97          2HG       GLN  97   1.594 -10.039 -10.039
  781   2HG   GLN  97          1HG       GLN  97   0.162  -9.026  -9.026
  782   1HE2  GLN  97          2HE2      GLN  97   1.936  -6.089  -6.089
  783   2HE2  GLN  97          1HE2      GLN  97   0.445  -6.898  -6.898
  784    H    LYS  98           H        LYS  98   1.446 -12.307 -12.307
  785    HA   LYS  98           HA       LYS  98   4.057 -13.071 -13.071
  786   1HB   LYS  98          2HB       LYS  98   3.594 -15.476 -15.476
  787   2HB   LYS  98          1HB       LYS  98   2.534 -14.846 -14.846
  788   1HG   LYS  98          2HG       LYS  98   0.754 -14.472 -14.472
  789   2HG   LYS  98          1HG       LYS  98   1.809 -15.055 -15.055
  790   1HD   LYS  98          2HD       LYS  98   1.686 -17.261 -17.261
  791   2HD   LYS  98          1HD       LYS  98   1.355 -16.815 -16.815
  792   1HE   LYS  98          2HE       LYS  98  -0.901 -16.009 -16.009
  793   2HE   LYS  98          1HE       LYS  98  -0.568 -16.582 -16.582
  794   1HZ   LYS  98          1HZ       LYS  98  -0.240 -18.812 -18.812
  795   2HZ   LYS  98          3HZ       LYS  98  -0.637 -18.243 -18.243
  796   3HZ   LYS  98          2HZ       LYS  98  -1.804 -18.228 -18.228
  797    H    LEU  99           H        LEU  99   5.559 -13.815 -13.815
  798    HA   LEU  99           HA       LEU  99   5.238 -12.466 -12.466
  799   1HB   LEU  99          2HB       LEU  99   7.044 -14.734 -14.734
  800   2HB   LEU  99          1HB       LEU  99   7.155 -13.943 -13.943
  801    HG   LEU  99           HG       LEU  99   7.113 -12.172 -12.172
  802   1HD1  LEU  99          3HD1      LEU  99   9.415 -13.983 -13.983
  803   2HD1  LEU  99          2HD1      LEU  99   9.622 -12.521 -12.521
  804   3HD1  LEU  99          1HD1      LEU  99   8.635 -13.849 -13.849
  805   1HD2  LEU  99          1HD2      LEU  99   7.265 -11.324 -11.324
  806   2HD2  LEU  99          3HD2      LEU  99   8.708 -10.920 -10.920
  807   3HD2  LEU  99          2HD2      LEU  99   8.748 -12.250 -12.250
  808    H    LEU 100           H        LEU 100   5.382 -13.624 -13.624
  809    HA   LEU 100           HA       LEU 100   3.325 -15.754 -15.754
  810   1HB   LEU 100          2HB       LEU 100   4.454 -13.824 -13.824
  811   2HB   LEU 100          1HB       LEU 100   3.487 -15.219 -15.219
  812    HG   LEU 100           HG       LEU 100   2.540 -13.227 -13.227
  813   1HD1  LEU 100          1HD1      LEU 100   2.552 -13.087 -13.087
  814   2HD1  LEU 100          3HD1      LEU 100   1.044 -12.648 -12.648
  815   3HD1  LEU 100          2HD1      LEU 100   2.531 -11.783 -11.783
  816   1HD2  LEU 100          3HD2      LEU 100   1.342 -15.505 -15.505
  817   2HD2  LEU 100          2HD2      LEU 100   1.251 -15.183 -15.183
  818   3HD2  LEU 100          1HD2      LEU 100   0.311 -14.207 -14.207
  819    H    LYS 101           H        LYS 101   6.703 -15.388 -15.388
  820    HA   LYS 101           HA       LYS 101   7.058 -18.160 -18.160
  821   1HB   LYS 101          2HB       LYS 101   7.234 -16.490 -16.490
  822   2HB   LYS 101          1HB       LYS 101   8.805 -16.102 -16.102
  823   1HG   LYS 101          2HG       LYS 101   8.874 -18.830 -18.830
  824   2HG   LYS 101          1HG       LYS 101   7.905 -18.572 -18.572
  825   1HD   LYS 101          2HD       LYS 101   9.779 -16.796 -16.796
  826   2HD   LYS 101          1HD       LYS 101  10.741 -17.771 -17.771
  827   1HE   LYS 101          2HE       LYS 101  11.178 -18.971 -18.971
  828   2HE   LYS 101          1HE       LYS 101   9.648 -19.744 -19.744
  829   1HZ   LYS 101          3HZ       LYS 101   8.657 -17.787 -17.787
  830   2HZ   LYS 101          2HZ       LYS 101  10.208 -17.703 -17.703
  831   3HZ   LYS 101          1HZ       LYS 101   9.295 -19.131 -19.131
  832    H    GLY 102           H        GLY 102   8.954 -19.063 -19.063
  833   1HA   GLY 102          2HA       GLY 102  10.755 -19.226 -19.226
  834   2HA   GLY 102          1HA       GLY 102  11.116 -17.543 -17.543
  835    H    GLU 103           H        GLU 103  11.596 -17.264 -17.264
  836    HA   GLU 103           HA       GLU 103   9.418 -16.113 -16.113
  837   1HB   GLU 103          2HB       GLU 103   8.831 -18.536 -18.536
  838   2HB   GLU 103          1HB       GLU 103  10.371 -18.766 -18.766
  839   1HG   GLU 103          2HG       GLU 103   9.747 -17.203 -17.203
  840   2HG   GLU 103          1HG       GLU 103   8.280 -16.758 -16.758
  841    H    GLY 104           H        GLY 104  10.206 -14.852 -14.852
  842   1HA   GLY 104          2HA       GLY 104  12.789 -15.381 -15.381
  843   2HA   GLY 104          1HA       GLY 104  12.784 -13.971 -13.971
  844    HA   PRO 105           HA       PRO 105  10.950 -11.762 -11.762
  845   1HB   PRO 105          2HB       PRO 105   9.955  -9.601  -9.601
  846   2HB   PRO 105          1HB       PRO 105  11.681  -9.829  -9.829
  847   1HG   PRO 105          2HG       PRO 105  10.222 -10.104 -10.104
  848   2HG   PRO 105          1HG       PRO 105  11.945  -9.811  -9.811
  849   1HD   PRO 105          2HD       PRO 105  10.714 -12.307 -12.307
  850   2HD   PRO 105          1HD       PRO 105  12.415 -12.038 -12.038
  851    H    LYS 106           H        LYS 106   8.709 -10.449 -10.449
  852    HA   LYS 106           HA       LYS 106   6.471 -11.875 -11.875
  853   1HB   LYS 106          2HB       LYS 106   6.932 -13.044 -13.044
  854   2HB   LYS 106          1HB       LYS 106   6.830 -11.511 -11.511
  855   1HG   LYS 106          2HG       LYS 106   4.529 -11.308 -11.308
  856   2HG   LYS 106          1HG       LYS 106   4.549 -12.439 -12.439
  857   1HD   LYS 106          2HD       LYS 106   4.560 -14.301 -14.301
  858   2HD   LYS 106          1HD       LYS 106   5.394 -13.458 -13.458
  859   1HE   LYS 106          2HE       LYS 106   2.513 -12.977 -12.977
  860   2HE   LYS 106          1HE       LYS 106   3.024 -13.933 -13.933
  861   1HZ   LYS 106          1HZ       LYS 106   4.337 -11.788 -11.788
  862   2HZ   LYS 106          3HZ       LYS 106   3.202 -11.032 -11.032
  863   3HZ   LYS 106          2HZ       LYS 106   2.680 -11.890 -11.890
  864    H    THR 107           H        THR 107   4.704 -10.477 -10.477
  865    HA   THR 107           HA       THR 107   4.982  -7.736  -7.736
  866    HB   THR 107           HB       THR 107   3.558  -7.329  -7.329
  867    HG1  THR 107           HG1      THR 107   4.133  -9.574  -9.574
  868   1HG2  THR 107          1HG2      THR 107   5.771  -6.329  -6.329
  869   2HG2  THR 107          3HG2      THR 107   6.529  -7.263  -7.263
  870   3HG2  THR 107          2HG2      THR 107   5.348  -6.014  -6.014
  871    H    SER 108           H        SER 108   3.142  -6.691  -6.691
  872    HA   SER 108           HA       SER 108   0.463  -7.748  -7.748
  873   1HB   SER 108          2HB       SER 108   1.627  -7.843  -7.843
  874   2HB   SER 108          1HB       SER 108  -0.034  -8.222  -8.222
  875    HG   SER 108           HG       SER 108   2.345  -9.627  -9.627
  876    H    TRP 109           H        TRP 109  -0.906  -5.947  -5.947
  877    HA   TRP 109           HA       TRP 109   0.013  -3.637  -3.637
  878   1HB   TRP 109          2HB       TRP 109  -0.748  -2.111  -2.111
  879   2HB   TRP 109          1HB       TRP 109   0.735  -3.007  -3.007
  880    HD1  TRP 109           HD1      TRP 109   0.758  -4.700  -4.700
  881    HE1  TRP 109           HE1      TRP 109  -0.958  -5.383  -5.383
  882    HE3  TRP 109           HE3      TRP 109  -3.428  -2.436  -2.436
  883    HZ2  TRP 109           HZ2      TRP 109  -3.731  -5.018  -5.018
  884    HZ3  TRP 109           HZ3      TRP 109  -5.589  -2.625  -2.625
  885    HH2  TRP 109           HH2      TRP 109  -5.748  -3.910  -3.910
  886    H    THR 110           H        THR 110  -1.720  -1.973  -1.973
  887    HA   THR 110           HA       THR 110  -4.454  -3.191  -3.191
  888    HB   THR 110           HB       THR 110  -4.940  -2.415  -2.415
  889    HG1  THR 110           HG1      THR 110  -3.961  -0.481  -0.481
  890   1HG2  THR 110          2HG2      THR 110  -2.843  -4.247  -4.247
  891   2HG2  THR 110          1HG2      THR 110  -2.314  -3.242  -3.242
  892   3HG2  THR 110          3HG2      THR 110  -3.839  -4.119  -4.119
  893    H    MET 111           H        MET 111  -6.160  -1.438  -1.438
  894    HA   MET 111           HA       MET 111  -5.392   1.310   1.310
  895   1HB   MET 111          2HB       MET 111  -6.986   1.330   1.330
  896   2HB   MET 111          1HB       MET 111  -5.480   0.455   0.455
  897   1HG   MET 111          2HG       MET 111  -6.575  -1.668  -1.668
  898   2HG   MET 111          1HG       MET 111  -8.056  -0.870  -0.870
  899   1HE   MET 111          3HE       MET 111  -5.375  -0.713  -0.713
  900   2HE   MET 111          2HE       MET 111  -6.070  -1.116  -1.116
  901   3HE   MET 111          1HE       MET 111  -6.073   0.556   0.556
  902    H    GLU 112           H        GLU 112  -6.690   2.568   2.568
  903    HA   GLU 112           HA       GLU 112  -9.347   1.451   1.451
  904   1HB   GLU 112          2HB       GLU 112  -7.750   3.508   3.508
  905   2HB   GLU 112          1HB       GLU 112  -9.131   2.571   2.571
  906   1HG   GLU 112          2HG       GLU 112  -7.682   1.056   1.056
  907   2HG   GLU 112          1HG       GLU 112  -7.258   0.655   0.655
  908    H    LEU 113           H        LEU 113 -11.070   2.969   2.969
  909    HA   LEU 113           HA       LEU 113 -10.709   5.513   5.513
  910   1HB   LEU 113          2HB       LEU 113 -12.336   3.365   3.365
  911   2HB   LEU 113          1HB       LEU 113 -13.433   4.393   4.393
  912    HG   LEU 113           HG       LEU 113 -13.412   4.749   4.749
  913   1HD1  LEU 113          2HD1      LEU 113 -14.232   6.449   6.449
  914   2HD1  LEU 113          1HD1      LEU 113 -12.618   7.151   7.151
  915   3HD1  LEU 113          3HD1      LEU 113 -13.542   7.165   7.165
  916   1HD2  LEU 113          2HD2      LEU 113 -10.627   4.860   4.860
  917   2HD2  LEU 113          1HD2      LEU 113 -11.502   5.181   5.181
  918   3HD2  LEU 113          3HD2      LEU 113 -11.108   6.506   6.506
  919    H    THR 114           H        THR 114 -11.580   7.364   7.364
  920    HA   THR 114           HA       THR 114 -12.324   6.920   6.920
  921    HB   THR 114           HB       THR 114 -11.881   9.249   9.249
  922    HG1  THR 114           HG1      THR 114 -11.812  10.682  10.682
  923   1HG2  THR 114          1HG2      THR 114  -9.911   7.717   7.717
  924   2HG2  THR 114          3HG2      THR 114  -9.855   8.314   8.314
  925   3HG2  THR 114          2HG2      THR 114  -9.583   9.422   9.422
  926    H    ASN 115           H        ASN 115 -14.166   8.150   8.150
  927    HA   ASN 115           HA       ASN 115 -16.585   7.673   7.673
  928   1HB   ASN 115          2HB       ASN 115 -15.820   9.088   9.088
  929   2HB   ASN 115          1HB       ASN 115 -17.393   9.489   9.489
  930   1HD2  ASN 115          2HD2      ASN 115 -18.861   6.401   6.401
  931   2HD2  ASN 115          1HD2      ASN 115 -19.067   7.910   7.910
  932    H    ASP 116           H        ASP 116 -14.391  10.376  10.376
  933    HA   ASP 116           HA       ASP 116 -16.368  12.226  12.226
  934   1HB   ASP 116          2HB       ASP 116 -14.265  12.823  12.823
  935   2HB   ASP 116          1HB       ASP 116 -13.378  12.604  12.604
  936    H    GLY 117           H        GLY 117 -13.933   9.966   9.966
  937   1HA   GLY 117          2HA       GLY 117 -14.508   9.111   9.111
  938   2HA   GLY 117          1HA       GLY 117 -14.512  10.807  10.807
  939    H    GLU 118           H        GLU 118 -12.122  10.877  10.877
  940    HA   GLU 118           HA       GLU 118  -9.993  11.096  11.096
  941   1HB   GLU 118          2HB       GLU 118  -9.778  10.271  10.271
  942   2HB   GLU 118          1HB       GLU 118  -8.516  11.023  11.023
  943   1HG   GLU 118          2HG       GLU 118 -10.382  12.878  12.878
  944   2HG   GLU 118          1HG       GLU 118 -10.996  12.236  12.236
  945    H    LEU 119           H        LEU 119  -7.982   9.585   9.585
  946    HA   LEU 119           HA       LEU 119  -8.730   6.736   6.736
  947   1HB   LEU 119          2HB       LEU 119  -9.357   7.425   7.425
  948   2HB   LEU 119          1HB       LEU 119  -7.673   7.838   7.838
  949    HG   LEU 119           HG       LEU 119  -8.493   5.079   5.079
  950   1HD1  LEU 119          1HD1      LEU 119  -8.645   6.347   6.347
  951   2HD1  LEU 119          3HD1      LEU 119  -8.179   4.650   4.650
  952   3HD1  LEU 119          2HD1      LEU 119  -9.738   5.185   5.185
  953   1HD2  LEU 119          2HD2      LEU 119  -6.062   6.399   6.399
  954   2HD2  LEU 119          1HD2      LEU 119  -6.169   5.196   5.196
  955   3HD2  LEU 119          3HD2      LEU 119  -6.363   4.708   4.708
  956    H    ILE 120           H        ILE 120  -7.130   6.064   6.064
  957    HA   ILE 120           HA       ILE 120  -4.351   7.016   7.016
  958    HB   ILE 120           HB       ILE 120  -5.077   7.404   7.404
  959   1HG1  ILE 120          2HG1      ILE 120  -3.188   5.032   5.032
  960   2HG1  ILE 120          1HG1      ILE 120  -2.711   6.689   6.689
  961   1HG2  ILE 120          1HG2      ILE 120  -5.873   4.516   4.516
  962   2HG2  ILE 120          3HG2      ILE 120  -5.417   5.175   5.175
  963   3HG2  ILE 120          2HG2      ILE 120  -6.769   5.874   5.874
  964   1HD1  ILE 120          1HD1      ILE 120  -3.526   7.371   7.371
  965   2HD1  ILE 120          3HD1      ILE 120  -3.825   5.671   5.671
  966   3HD1  ILE 120          2HD1      ILE 120  -2.181   6.232   6.232
  967    H    LEU 121           H        LEU 121  -2.638   5.285   5.285
  968    HA   LEU 121           HA       LEU 121  -3.656   2.557   2.557
  969   1HB   LEU 121          2HB       LEU 121  -3.502   3.693   3.693
  970   2HB   LEU 121          1HB       LEU 121  -1.809   4.061   4.061
  971    HG   LEU 121           HG       LEU 121  -2.193   1.253   1.253
  972   1HD1  LEU 121          3HD1      LEU 121  -4.186   1.846   1.846
  973   2HD1  LEU 121          2HD1      LEU 121  -2.932   1.961   1.961
  974   3HD1  LEU 121          1HD1      LEU 121  -3.177   0.447   0.447
  975   1HD2  LEU 121          2HD2      LEU 121  -0.226   2.803   2.803
  976   2HD2  LEU 121          1HD2      LEU 121  -0.311   1.089   1.089
  977   3HD2  LEU 121          3HD2      LEU 121  -0.881   2.300   2.300
  978    H    THR 122           H        THR 122  -2.337   1.073   1.073
  979    HA   THR 122           HA       THR 122   0.370   2.003   2.003
  980    HB   THR 122           HB       THR 122  -0.425  -0.425  -0.425
  981    HG1  THR 122           HG1      THR 122  -2.277   0.229   0.229
  982   1HG2  THR 122          3HG2      THR 122   0.351   2.376   2.376
  983   2HG2  THR 122          2HG2      THR 122  -0.359   1.371   1.371
  984   3HG2  THR 122          1HG2      THR 122   1.118   0.853   0.853
  985    H    MET 123           H        MET 123   1.913   0.019   0.019
  986    HA   MET 123           HA       MET 123   1.329  -2.020  -2.020
  987   1HB   MET 123          2HB       MET 123   3.751  -0.206  -0.206
  988   2HB   MET 123          1HB       MET 123   3.307  -1.498  -1.498
  989   1HG   MET 123          2HG       MET 123   1.131  -0.247  -0.247
  990   2HG   MET 123          1HG       MET 123   1.839   1.104   1.104
  991   1HE   MET 123          1HE       MET 123   1.357  -0.921  -0.921
  992   2HE   MET 123          3HE       MET 123   1.221   0.541   0.541
  993   3HE   MET 123          2HE       MET 123   2.537  -0.597  -0.597
  994    H    THR 124           H        THR 124   3.078  -3.672  -3.672
  995    HA   THR 124           HA       THR 124   4.867  -3.689  -3.689
  996    HB   THR 124           HB       THR 124   3.078  -6.045  -6.045
  997    HG1  THR 124           HG1      THR 124   1.552  -4.905  -4.905
  998   1HG2  THR 124          1HG2      THR 124   5.220  -6.341  -6.341
  999   2HG2  THR 124          3HG2      THR 124   4.662  -5.151  -5.151
 1000   3HG2  THR 124          2HG2      THR 124   3.803  -6.679  -6.679
 1001    H    ALA 125           H        ALA 125   6.560  -5.209  -5.209
 1002    HA   ALA 125           HA       ALA 125   6.725  -6.915  -6.915
 1003   1HB   ALA 125          2HB       ALA 125   7.342  -4.621  -4.621
 1004   2HB   ALA 125          1HB       ALA 125   8.700  -4.638  -4.638
 1005   3HB   ALA 125          3HB       ALA 125   8.625  -5.817  -5.817
 1006    H    ASP 126           H        ASP 126   7.183  -8.627  -8.627
 1007    HA   ASP 126           HA       ASP 126   8.618 -10.104 -10.104
 1008   1HB   ASP 126          2HB       ASP 126  10.423  -8.222  -8.222
 1009   2HB   ASP 126          1HB       ASP 126  10.894  -8.416  -8.416
 1010    H    ASP 127           H        ASP 127   9.794  -7.073  -7.073
 1011    HA   ASP 127           HA       ASP 127   8.055  -7.503  -7.503
 1012   1HB   ASP 127          2HB       ASP 127  10.471  -8.684  -8.684
 1013   2HB   ASP 127          1HB       ASP 127  10.926  -7.062  -7.062
 1014    H    VAL 128           H        VAL 128   8.560  -5.500  -5.500
 1015    HA   VAL 128           HA       VAL 128   9.032  -3.124  -3.124
 1016    HB   VAL 128           HB       VAL 128   9.827  -1.939  -1.939
 1017   1HG1  VAL 128          1HG1      VAL 128  11.400  -3.380  -3.380
 1018   2HG1  VAL 128          3HG1      VAL 128  11.197  -4.638  -4.638
 1019   3HG1  VAL 128          2HG1      VAL 128  11.922  -3.091  -3.091
 1020   1HG2  VAL 128          3HG2      VAL 128   8.680  -4.307  -4.307
 1021   2HG2  VAL 128          2HG2      VAL 128   8.915  -2.672  -2.672
 1022   3HG2  VAL 128          1HG2      VAL 128  10.254  -3.819  -3.819
 1023    H    VAL 129           H        VAL 129   7.898  -1.156  -1.156
 1024    HA   VAL 129           HA       VAL 129   5.414  -1.958  -1.958
 1025    HB   VAL 129           HB       VAL 129   5.537  -1.170  -1.170
 1026   1HG1  VAL 129          1HG1      VAL 129   3.508  -0.095  -0.095
 1027   2HG1  VAL 129          3HG1      VAL 129   2.965  -0.591  -0.591
 1028   3HG1  VAL 129          2HG1      VAL 129   4.190   0.667   0.667
 1029   1HG2  VAL 129          2HG2      VAL 129   4.115  -3.113  -3.113
 1030   2HG2  VAL 129          1HG2      VAL 129   4.907  -3.369  -3.369
 1031   3HG2  VAL 129          3HG2      VAL 129   3.313  -2.618  -2.618
 1032    H    CYS 130           H        CYS 130   5.209  -0.517  -0.517
 1033    HA   CYS 130           HA       CYS 130   6.297   2.232   2.232
 1034   1HB   CYS 130          2HB       CYS 130   6.734   0.636   0.636
 1035   2HB   CYS 130          1HB       CYS 130   5.156   1.219   1.219
 1036    HG   CYS 130           HG       CYS 130   6.237   3.712   3.712
 1037    H    THR 131           H        THR 131   4.853   3.738   3.738
 1038    HA   THR 131           HA       THR 131   1.977   3.339   3.339
 1039    HB   THR 131           HB       THR 131   3.212   4.933   4.933
 1040    HG1  THR 131           HG1      THR 131   2.514   3.261   3.261
 1041   1HG2  THR 131          1HG2      THR 131   0.335   4.359   4.359
 1042   2HG2  THR 131          3HG2      THR 131   0.833   5.024   5.024
 1043   3HG2  THR 131          2HG2      THR 131   1.117   5.937   5.937
 1044    H    ARG 132           H        ARG 132   0.813   5.122   5.122
 1045    HA   ARG 132           HA       ARG 132   2.146   7.682   7.682
 1046   1HB   ARG 132          2HB       ARG 132   1.120   5.880   5.880
 1047   2HB   ARG 132          1HB       ARG 132   1.545   7.577   7.577
 1048   1HG   ARG 132          2HG       ARG 132   3.843   7.015   7.015
 1049   2HG   ARG 132          1HG       ARG 132   3.384   5.315   5.315
 1050   1HD   ARG 132          2HD       ARG 132   2.710   6.521   6.521
 1051   2HD   ARG 132          1HD       ARG 132   4.364   6.985   6.985
 1052    HE   ARG 132           HE       ARG 132   3.720   4.122   4.122
 1053   1HH1  ARG 132          2HH1      ARG 132   6.362   4.053   4.053
 1054   2HH1  ARG 132          1HH1      ARG 132   6.757   4.175   4.175
 1055   1HH2  ARG 132          1HH2      ARG 132   3.650   5.419   5.419
 1056   2HH2  ARG 132          2HH2      ARG 132   5.221   4.949   4.949
 1057    H    VAL 133           H        VAL 133   0.537   9.131   9.131
 1058    HA   VAL 133           HA       VAL 133  -2.268   8.252   8.252
 1059    HB   VAL 133           HB       VAL 133  -1.057  10.955  10.955
 1060   1HG1  VAL 133          3HG1      VAL 133  -3.554  10.830  10.830
 1061   2HG1  VAL 133          2HG1      VAL 133  -3.705   9.816   9.816
 1062   3HG1  VAL 133          1HG1      VAL 133  -3.137  11.479  11.479
 1063   1HG2  VAL 133          2HG2      VAL 133  -0.403   8.785   8.785
 1064   2HG2  VAL 133          1HG2      VAL 133  -0.808  10.268  10.268
 1065   3HG2  VAL 133          3HG2      VAL 133  -2.008   8.986   8.986
 1066    H    TYR 134           H        TYR 134  -3.852   8.867   8.867
 1067    HA   TYR 134           HA       TYR 134  -2.923  10.715  10.715
 1068   1HB   TYR 134          2HB       TYR 134  -4.302   8.057   8.057
 1069   2HB   TYR 134          1HB       TYR 134  -4.572   9.280   9.280
 1070    HD1  TYR 134           HD2      TYR 134  -2.726  10.100  10.100
 1071    HD2  TYR 134           HD1      TYR 134  -2.138   6.988   6.988
 1072    HE1  TYR 134           HE2      TYR 134  -0.569   9.504   9.504
 1073    HE2  TYR 134           HE1      TYR 134   0.015   6.387   6.387
 1074    HH   TYR 134           HH       TYR 134   1.772   7.866   7.866
 1075    H    VAL 135           H        VAL 135  -4.198  12.423  12.423
 1076    HA   VAL 135           HA       VAL 135  -7.002  12.233  12.233
 1077    HB   VAL 135           HB       VAL 135  -5.007  14.123  14.123
 1078   1HG1  VAL 135          1HG1      VAL 135  -5.503  15.157  15.157
 1079   2HG1  VAL 135          3HG1      VAL 135  -7.116  15.522  15.522
 1080   3HG1  VAL 135          2HG1      VAL 135  -5.699  16.239  16.239
 1081   1HG2  VAL 135          1HG2      VAL 135  -8.016  14.283  14.283
 1082   2HG2  VAL 135          3HG2      VAL 135  -6.899  13.544  13.544
 1083   3HG2  VAL 135          2HG2      VAL 135  -6.875  15.289  15.289
 1084    H    ARG 136           H        ARG 136  -8.678  12.723  12.723
 1085    HA   ARG 136           HA       ARG 136  -8.270  12.191  12.191
 1086   1HB   ARG 136          2HB       ARG 136 -10.443  13.141  13.141
 1087   2HB   ARG 136          1HB       ARG 136 -10.418  14.019  14.019
 1088   1HG   ARG 136          2HG       ARG 136 -10.733  12.120  12.120
 1089   2HG   ARG 136          1HG       ARG 136 -10.025  11.058  11.058
 1090   1HD   ARG 136          2HD       ARG 136 -12.760  12.365  12.365
 1091   2HD   ARG 136          1HD       ARG 136 -12.406  10.641  10.641
 1092    HE   ARG 136           HE       ARG 136 -11.172  11.476  11.476
 1093   1HH1  ARG 136          1HH2      ARG 136 -13.694   9.669   9.669
 1094   2HH1  ARG 136          2HH2      ARG 136 -14.797  10.422  10.422
 1095   1HH2  ARG 136          2HH1      ARG 136 -12.867  13.277  13.277
 1096   2HH2  ARG 136          1HH1      ARG 136 -14.328  12.467  12.467
 1097    H    GLU 137           HN       GLU 137  -7.382  13.210  13.210
 1098    HA   GLU 137           HA       GLU 137  -6.151  14.831  14.831
 1099   1HB   GLU 137          2HB       GLU 137  -8.687  15.258  15.258
 1100   2HB   GLU 137          1HB       GLU 137  -8.391  16.672  16.672
 1101   1HG   GLU 137          2HG       GLU 137  -6.560  17.340  17.340
 1102   2HG   GLU 137          1HG       GLU 137  -7.054  16.009  16.009

  Start of MODEL   29
    1   1H    PRO   1          1H        PRO   1 -15.523   8.980   8.980
    2   2H    PRO   1          2H        PRO   1 -14.884   8.211   8.211
    3    HA   PRO   1           HA       PRO   1 -14.780   6.275   6.275
    4   1HB   PRO   1          2HB       PRO   1 -17.396   5.995   5.995
    5   2HB   PRO   1          1HB       PRO   1 -16.747   5.211   5.211
    6   1HG   PRO   1          2HG       PRO   1 -18.682   7.321   7.321
    7   2HG   PRO   1          1HG       PRO   1 -18.039   6.523   6.523
    8   1HD   PRO   1          1HD       PRO   1 -17.489   9.171   9.171
    9   2HD   PRO   1          2HD       PRO   1 -16.830   8.359   8.359
   10    H    ASN   2           H        ASN   2 -15.836   5.249   5.249
   11    HA   ASN   2           HA       ASN   2 -15.584   5.314   5.314
   12   1HB   ASN   2          2HB       ASN   2 -16.460   8.054   8.054
   13   2HB   ASN   2          1HB       ASN   2 -15.662   7.899   7.899
   14   1HD2  ASN   2          2HD2      ASN   2 -18.910   7.034   7.034
   15   2HD2  ASN   2          1HD2      ASN   2 -17.732   8.255   8.255
   16    H    PHE   3           H        PHE   3 -13.705   4.964   4.964
   17    HA   PHE   3           HA       PHE   3 -11.315   6.556   6.556
   18   1HB   PHE   3          2HB       PHE   3 -11.654   3.948   3.948
   19   2HB   PHE   3          1HB       PHE   3 -10.111   4.724   4.724
   20    HD1  PHE   3           HD1      PHE   3 -13.139   3.865   3.865
   21    HD2  PHE   3           HD2      PHE   3  -8.861   3.725   3.725
   22    HE1  PHE   3           HE1      PHE   3 -12.964   2.697   2.697
   23    HE2  PHE   3           HE2      PHE   3  -8.697   2.542   2.542
   24    HZ   PHE   3           HZ       PHE   3 -10.750   2.022   2.022
   25    H    SER   4           H        SER   4 -13.696   6.619   6.619
   26    HA   SER   4           HA       SER   4 -12.119   6.886   6.886
   27   1HB   SER   4          2HB       SER   4 -14.487   6.281   6.281
   28   2HB   SER   4          1HB       SER   4 -14.927   7.842   7.842
   29    HG   SER   4           HG       SER   4 -15.061   8.246   8.246
   30    H    GLY   5           H        GLY   5 -10.857   8.521   8.521
   31   1HA   GLY   5          2HA       GLY   5 -11.451  11.170  11.170
   32   2HA   GLY   5          1HA       GLY   5 -10.944  11.100  11.100
   33    H    ASN   6           H        ASN   6  -9.197  12.550  12.550
   34    HA   ASN   6           HA       ASN   6  -7.058  10.911  10.911
   35   1HB   ASN   6          2HB       ASN   6  -7.570  13.875  13.875
   36   2HB   ASN   6          1HB       ASN   6  -5.929  13.298  13.298
   37   1HD2  ASN   6          2HD2      ASN   6  -7.005  11.789  11.789
   38   2HD2  ASN   6          1HD2      ASN   6  -6.238  11.247  11.247
   39    H    TRP   7           H        TRP   7  -4.793  11.412  11.412
   40    HA   TRP   7           HA       TRP   7  -5.039  11.931  11.931
   41   1HB   TRP   7          2HB       TRP   7  -4.158   9.293   9.293
   42   2HB   TRP   7          1HB       TRP   7  -3.944   9.734   9.734
   43    HD1  TRP   7           HD1      TRP   7  -6.477   8.437   8.437
   44    HE1  TRP   7           HE1      TRP   7  -8.789   8.236   8.236
   45    HE3  TRP   7           HE3      TRP   7  -5.482  10.963  10.963
   46    HZ2  TRP   7           HZ2      TRP   7 -10.034   9.087   9.087
   47    HZ3  TRP   7           HZ3      TRP   7  -7.240  11.297  11.297
   48    HH2  TRP   7           HH2      TRP   7  -9.493  10.358  10.358
   49    H    LYS   8           H        LYS   8  -3.412  13.185  13.185
   50    HA   LYS   8           HA       LYS   8  -0.783  12.878  12.878
   51   1HB   LYS   8          2HB       LYS   8  -2.199  15.293  15.293
   52   2HB   LYS   8          1HB       LYS   8  -0.443  15.276  15.276
   53   1HG   LYS   8          2HG       LYS   8  -0.857  14.533  14.533
   54   2HG   LYS   8          1HG       LYS   8  -2.522  15.059  15.059
   55   1HD   LYS   8          2HD       LYS   8  -1.894  17.301  17.301
   56   2HD   LYS   8          1HD       LYS   8  -0.218  16.876  16.876
   57   1HE   LYS   8          2HE       LYS   8  -0.327  15.913  15.913
   58   2HE   LYS   8          1HE       LYS   8  -1.608  17.117  17.117
   59   1HZ   LYS   8          1HZ       LYS   8   0.133  18.641  18.641
   60   2HZ   LYS   8          3HZ       LYS   8   1.250  17.505  17.505
   61   3HZ   LYS   8          2HZ       LYS   8   0.243  18.337  18.337
   62    H    ILE   9           H        ILE   9   0.579  11.837  11.837
   63    HA   ILE   9           HA       ILE   9   0.179  11.165  11.165
   64    HB   ILE   9           HB       ILE   9   1.721   9.989   9.989
   65   1HG1  ILE   9          2HG1      ILE   9   3.197  11.327  11.327
   66   2HG1  ILE   9          1HG1      ILE   9   2.187   9.888   9.888
   67   1HG2  ILE   9          3HG2      ILE   9   2.742  12.680  12.680
   68   2HG2  ILE   9          2HG2      ILE   9   4.045  11.555  11.555
   69   3HG2  ILE   9          1HG2      ILE   9   2.954  11.220  11.220
   70   1HD1  ILE   9          1HD1      ILE   9   3.943   9.223   9.223
   71   2HD1  ILE   9          3HD1      ILE   9   4.960  10.149  10.149
   72   3HD1  ILE   9          2HD1      ILE   9   4.101   8.721   8.721
   73    H    ILE  10           H        ILE  10   1.266  11.841  11.841
   74    HA   ILE  10           HA       ILE  10   2.305  14.633  14.633
   75    HB   ILE  10           HB       ILE  10   1.067  15.069  15.069
   76   1HG1  ILE  10          2HG1      ILE  10  -0.944  13.227  13.227
   77   2HG1  ILE  10          1HG1      ILE  10   0.399  12.199  12.199
   78   1HG2  ILE  10          3HG2      ILE  10   0.133  15.375  15.375
   79   2HG2  ILE  10          2HG2      ILE  10  -0.972  14.083  14.083
   80   3HG2  ILE  10          1HG2      ILE  10  -0.943  15.593  15.593
   81   1HD1  ILE  10          1HD1      ILE  10   1.727  13.428  13.428
   82   2HD1  ILE  10          3HD1      ILE  10   0.133  13.873  13.873
   83   3HD1  ILE  10          2HD1      ILE  10   0.578  12.173  12.173
   84    H    ARG  11           H        ARG  11   2.246  11.432  11.432
   85    HA   ARG  11           HA       ARG  11   4.926  12.001  12.001
   86   1HB   ARG  11          2HB       ARG  11   2.444  11.428  11.428
   87   2HB   ARG  11          1HB       ARG  11   3.883  10.538  10.538
   88   1HG   ARG  11          2HG       ARG  11   5.083  12.828  12.828
   89   2HG   ARG  11          1HG       ARG  11   3.463  13.525  13.525
   90   1HD   ARG  11          2HD       ARG  11   3.359  11.591  11.591
   91   2HD   ARG  11          1HD       ARG  11   4.931  12.365  12.365
   92    HE   ARG  11           HE       ARG  11   2.723  14.251  14.251
   93   1HH1  ARG  11          2HH1      ARG  11   4.572  15.541  15.541
   94   2HH1  ARG  11          1HH1      ARG  11   4.265  15.153  15.153
   95   1HH2  ARG  11          1HH2      ARG  11   2.332  12.369  12.369
   96   2HH2  ARG  11          2HH2      ARG  11   2.997  13.357  13.357
   97    H    SER  12           H        SER  12   5.899   9.833   9.833
   98    HA   SER  12           HA       SER  12   4.805   7.327   7.327
   99   1HB   SER  12          2HB       SER  12   6.144   6.891   6.891
  100   2HB   SER  12          1HB       SER  12   5.181   8.341   8.341
  101    HG   SER  12           HG       SER  12   7.893   8.021   8.021
  102    H    GLU  13           H        GLU  13   6.127   5.630   5.630
  103    HA   GLU  13           HA       GLU  13   8.878   6.268   6.268
  104   1HB   GLU  13          2HB       GLU  13   8.356   4.954   4.954
  105   2HB   GLU  13          1HB       GLU  13   7.636   6.559   6.559
  106   1HG   GLU  13          2HG       GLU  13   5.970   4.419   4.419
  107   2HG   GLU  13          1HG       GLU  13   6.243   4.256   4.256
  108    H    ASN  14           H        ASN  14  10.078   4.201   4.201
  109    HA   ASN  14           HA       ASN  14  10.845   2.075   2.075
  110   1HB   ASN  14          2HB       ASN  14   7.963   1.403   1.403
  111   2HB   ASN  14          1HB       ASN  14   9.258   0.311   0.311
  112   1HD2  ASN  14          2HD2      ASN  14   7.047   1.905   1.905
  113   2HD2  ASN  14          1HD2      ASN  14   6.591   1.858   1.858
  114    H    PHE  15           H        PHE  15  10.167   4.257   4.257
  115    HA   PHE  15           HA       PHE  15   9.254   2.949   2.949
  116   1HB   PHE  15          2HB       PHE  15   9.449   5.468   5.468
  117   2HB   PHE  15          1HB       PHE  15  11.171   5.283   5.283
  118    HD1  PHE  15           HD2      PHE  15  10.134   2.895   2.895
  119    HD2  PHE  15           HD1      PHE  15   9.732   7.138   7.138
  120    HE1  PHE  15           HE2      PHE  15   9.840   3.154   3.154
  121    HE2  PHE  15           HE1      PHE  15   9.422   7.381   7.381
  122    HZ   PHE  15           HZ       PHE  15   9.471   5.374   5.374
  123    H    GLU  16           H        GLU  16  12.602   3.991   3.991
  124    HA   GLU  16           HA       GLU  16  13.859   2.464   2.464
  125   1HB   GLU  16          2HB       GLU  16  14.909   4.283   4.283
  126   2HB   GLU  16          1HB       GLU  16  15.067   3.072   3.072
  127   1HG   GLU  16          2HG       GLU  16  16.391   1.644   1.644
  128   2HG   GLU  16          1HG       GLU  16  16.239   2.857   2.857
  129    H    GLU  17           H        GLU  17  12.700   1.542   1.542
  130    HA   GLU  17           HA       GLU  17  14.131  -0.908  -0.908
  131   1HB   GLU  17          2HB       GLU  17  11.425  -0.102  -0.102
  132   2HB   GLU  17          1HB       GLU  17  12.387  -1.461  -1.461
  133   1HG   GLU  17          2HG       GLU  17  14.269   0.375   0.375
  134   2HG   GLU  17          1HG       GLU  17  12.891   1.472   1.472
  135    H    LEU  18           H        LEU  18  11.134  -0.069  -0.069
  136    HA   LEU  18           HA       LEU  18  10.462  -2.840  -2.840
  137   1HB   LEU  18          2HB       LEU  18   8.853  -0.774  -0.774
  138   2HB   LEU  18          1HB       LEU  18   9.252  -0.486  -0.486
  139    HG   LEU  18           HG       LEU  18   8.599  -2.851  -2.851
  140   1HD1  LEU  18          1HD1      LEU  18   7.925  -2.749  -2.749
  141   2HD1  LEU  18          3HD1      LEU  18   7.092  -3.860  -3.860
  142   3HD1  LEU  18          2HD1      LEU  18   8.837  -3.974  -3.974
  143   1HD2  LEU  18          1HD2      LEU  18   7.023  -0.652  -0.652
  144   2HD2  LEU  18          3HD2      LEU  18   6.418  -2.223  -2.223
  145   3HD2  LEU  18          2HD2      LEU  18   6.199  -1.708  -1.708
  146    H    LEU  19           H        LEU  19  12.399  -0.366  -0.366
  147    HA   LEU  19           HA       LEU  19  12.206  -1.683  -1.683
  148   1HB   LEU  19          2HB       LEU  19  14.089   0.576   0.576
  149   2HB   LEU  19          1HB       LEU  19  13.444   0.145   0.145
  150    HG   LEU  19           HG       LEU  19  12.030   1.510   1.510
  151   1HD1  LEU  19          1HD1      LEU  19  13.311   2.440   2.440
  152   2HD1  LEU  19          3HD1      LEU  19  11.598   2.497   2.497
  153   3HD1  LEU  19          2HD1      LEU  19  12.186   3.339   3.339
  154   1HD2  LEU  19          1HD2      LEU  19  10.556  -0.337  -0.337
  155   2HD2  LEU  19          3HD2      LEU  19   9.904   1.280   1.280
  156   3HD2  LEU  19          2HD2      LEU  19  10.672   0.428   0.428
  157    H    LYS  20           H        LYS  20  14.113  -1.816  -1.816
  158    HA   LYS  20           HA       LYS  20  16.459  -2.963  -2.963
  159   1HB   LYS  20          2HB       LYS  20  15.887  -2.859  -2.859
  160   2HB   LYS  20          1HB       LYS  20  17.449  -3.117  -3.117
  161   1HG   LYS  20          2HG       LYS  20  16.168  -0.652  -0.652
  162   2HG   LYS  20          1HG       LYS  20  16.402  -0.660  -0.660
  163   1HD   LYS  20          2HD       LYS  20  18.565  -1.255  -1.255
  164   2HD   LYS  20          1HD       LYS  20  18.363   0.281   0.281
  165   1HE   LYS  20          2HE       LYS  20  18.374  -1.445  -1.445
  166   2HE   LYS  20          1HE       LYS  20  19.452  -2.285  -2.285
  167   1HZ   LYS  20          3HZ       LYS  20  19.775   0.602   0.602
  168   2HZ   LYS  20          2HZ       LYS  20  20.417  -0.524  -0.524
  169   3HZ   LYS  20          1HZ       LYS  20  20.925  -0.530  -0.530
  170    H    VAL  21           H        VAL  21  13.568  -3.939  -3.939
  171    HA   VAL  21           HA       VAL  21  14.341  -6.734  -6.734
  172    HB   VAL  21           HB       VAL  21  12.673  -5.607  -5.607
  173   1HG1  VAL  21          2HG1      VAL  21  11.623  -4.213  -4.213
  174   2HG1  VAL  21          1HG1      VAL  21  10.853  -5.659  -5.659
  175   3HG1  VAL  21          3HG1      VAL  21  10.455  -5.090  -5.090
  176   1HG2  VAL  21          2HG2      VAL  21  11.603  -7.904  -7.904
  177   2HG2  VAL  21          1HG2      VAL  21  12.647  -8.051  -8.051
  178   3HG2  VAL  21          3HG2      VAL  21  11.001  -7.442  -7.442
  179    H    LEU  22           H        LEU  22  12.405  -4.776  -4.776
  180    HA   LEU  22           HA       LEU  22  11.441  -6.861  -6.861
  181   1HB   LEU  22          2HB       LEU  22  11.639  -3.906  -3.906
  182   2HB   LEU  22          1HB       LEU  22  11.626  -4.615  -4.615
  183    HG   LEU  22           HG       LEU  22   9.510  -5.709  -5.709
  184   1HD1  LEU  22          2HD1      LEU  22   9.996  -6.217  -6.217
  185   2HD1  LEU  22          1HD1      LEU  22   9.610  -4.539  -4.539
  186   3HD1  LEU  22          3HD1      LEU  22   8.372  -5.600  -5.600
  187   1HD2  LEU  22          2HD2      LEU  22   9.751  -3.115  -3.115
  188   2HD2  LEU  22          1HD2      LEU  22   8.171  -3.797  -3.797
  189   3HD2  LEU  22          3HD2      LEU  22   9.117  -2.998  -2.998
  190    H    GLY  23           H        GLY  23  14.120  -4.577  -4.577
  191   1HA   GLY  23          2HA       GLY  23  15.333  -6.211  -6.211
  192   2HA   GLY  23          1HA       GLY  23  15.760  -4.540  -4.540
  193    H    VAL  24           H        VAL  24  17.963  -4.866  -4.866
  194    HA   VAL  24           HA       VAL  24  18.653  -6.064  -6.064
  195    HB   VAL  24           HB       VAL  24  20.471  -7.475  -7.475
  196   1HG1  VAL  24          2HG1      VAL  24  18.121  -8.301  -8.301
  197   2HG1  VAL  24          1HG1      VAL  24  17.768  -8.261  -8.261
  198   3HG1  VAL  24          3HG1      VAL  24  19.042  -9.313  -9.313
  199   1HG2  VAL  24          2HG2      VAL  24  19.048  -6.635  -6.635
  200   2HG2  VAL  24          1HG2      VAL  24  20.755  -6.436  -6.436
  201   3HG2  VAL  24          3HG2      VAL  24  20.104  -8.045  -8.045
  202    H    ASN  25           H        ASN  25  19.872  -4.566  -4.566
  203    HA   ASN  25           HA       ASN  25  22.333  -3.601  -3.601
  204   1HB   ASN  25          2HB       ASN  25  21.200  -3.580  -3.580
  205   2HB   ASN  25          1HB       ASN  25  20.925  -1.911  -1.911
  206   1HD2  ASN  25          2HD2      ASN  25  24.310  -0.998  -0.998
  207   2HD2  ASN  25          1HD2      ASN  25  22.727  -0.490  -0.490
  208    H    VAL  26           H        VAL  26  22.458  -0.922  -0.922
  209    HA   VAL  26           HA       VAL  26  20.371   0.091   0.091
  210    HB   VAL  26           HB       VAL  26  22.275   1.565   1.565
  211   1HG1  VAL  26          1HG1      VAL  26  21.211  -0.636  -0.636
  212   2HG1  VAL  26          3HG1      VAL  26  22.788  -1.328  -1.328
  213   3HG1  VAL  26          2HG1      VAL  26  22.668   0.036   0.036
  214   1HG2  VAL  26          3HG2      VAL  26  23.882  -0.571  -0.571
  215   2HG2  VAL  26          2HG2      VAL  26  23.940   1.167   1.167
  216   3HG2  VAL  26          1HG2      VAL  26  24.543   0.509   0.509
  217    H    MET  27           H        MET  27  22.802   0.947   0.947
  218    HA   MET  27           HA       MET  27  22.006   3.678   3.678
  219   1HB   MET  27          2HB       MET  27  24.054   2.353   2.353
  220   2HB   MET  27          1HB       MET  27  22.949   2.019   2.019
  221   1HG   MET  27          2HG       MET  27  22.800   4.254   4.254
  222   2HG   MET  27          1HG       MET  27  23.200   4.835   4.835
  223   1HE   MET  27          3HE       MET  27  24.257   4.795   4.795
  224   2HE   MET  27          2HE       MET  27  24.463   6.228   6.228
  225   3HE   MET  27          1HE       MET  27  25.865   5.496   5.496
  226    H    LEU  28           H        LEU  28  20.577   0.680   0.680
  227    HA   LEU  28           HA       LEU  28  18.870   1.792   1.792
  228   1HB   LEU  28          2HB       LEU  28  19.316  -0.821  -0.821
  229   2HB   LEU  28          1HB       LEU  28  17.733  -0.571  -0.571
  230    HG   LEU  28           HG       LEU  28  19.274  -1.644  -1.644
  231   1HD1  LEU  28          1HD1      LEU  28  17.552   0.280   0.280
  232   2HD1  LEU  28          3HD1      LEU  28  19.022   1.154   1.154
  233   3HD1  LEU  28          2HD1      LEU  28  18.638  -0.373  -0.373
  234   1HD2  LEU  28          2HD2      LEU  28  21.289  -0.396  -0.396
  235   2HD2  LEU  28          1HD2      LEU  28  21.340  -0.727  -0.727
  236   3HD2  LEU  28          3HD2      LEU  28  20.909   0.883   0.883
  237    H    ARG  29           H        ARG  29  18.515   0.880   0.880
  238    HA   ARG  29           HA       ARG  29  15.685   1.293   1.293
  239   1HB   ARG  29          2HB       ARG  29  17.920   1.183   1.183
  240   2HB   ARG  29          1HB       ARG  29  16.289   1.628   1.628
  241   1HG   ARG  29          2HG       ARG  29  16.483  -0.757  -0.757
  242   2HG   ARG  29          1HG       ARG  29  15.473  -0.494  -0.494
  243   1HD   ARG  29          2HD       ARG  29  18.414  -0.726  -0.726
  244   2HD   ARG  29          1HD       ARG  29  17.528  -2.198  -2.198
  245    HE   ARG  29           HE       ARG  29  16.386  -0.552  -0.552
  246   1HH1  ARG  29          1HH2      ARG  29  19.150  -2.372  -2.372
  247   2HH1  ARG  29          2HH2      ARG  29  18.683  -3.572  -3.572
  248   1HH2  ARG  29          2HH1      ARG  29  15.403  -2.467  -2.467
  249   2HH2  ARG  29          1HH1      ARG  29  16.561  -3.627  -3.627
  250    H    LYS  30           H        LYS  30  18.462   3.431   3.431
  251    HA   LYS  30           HA       LYS  30  16.992   5.661   5.661
  252   1HB   LYS  30          2HB       LYS  30  19.470   5.392   5.392
  253   2HB   LYS  30          1HB       LYS  30  19.595   5.713   5.713
  254   1HG   LYS  30          2HG       LYS  30  19.170   7.945   7.945
  255   2HG   LYS  30          1HG       LYS  30  18.019   7.687   7.687
  256   1HD   LYS  30          2HD       LYS  30  20.812   6.986   6.986
  257   2HD   LYS  30          1HD       LYS  30  20.544   8.698   8.698
  258   1HE   LYS  30          2HE       LYS  30  20.008   8.663   8.663
  259   2HE   LYS  30          1HE       LYS  30  18.424   8.286   8.286
  260   1HZ   LYS  30          3HZ       LYS  30  20.294   6.092   6.092
  261   2HZ   LYS  30          2HZ       LYS  30  19.456   6.798   6.798
  262   3HZ   LYS  30          1HZ       LYS  30  18.598   6.092   6.092
  263    H    ILE  31           H        ILE  31  17.041   4.335   4.335
  264    HA   ILE  31           HA       ILE  31  16.492   6.905   6.905
  265    HB   ILE  31           HB       ILE  31  16.410   4.044   4.044
  266   1HG1  ILE  31          2HG1      ILE  31  18.659   4.872   4.872
  267   2HG1  ILE  31          1HG1      ILE  31  18.506   4.677   4.677
  268   1HG2  ILE  31          1HG2      ILE  31  15.761   6.689   6.689
  269   2HG2  ILE  31          3HG2      ILE  31  16.565   5.468   5.468
  270   3HG2  ILE  31          2HG2      ILE  31  15.002   5.117   5.117
  271   1HD1  ILE  31          2HD1      ILE  31  17.908   7.161   7.161
  272   2HD1  ILE  31          1HD1      ILE  31  18.424   7.251   7.251
  273   3HD1  ILE  31          3HD1      ILE  31  19.578   6.793   6.793
  274    H    ALA  32           H        ALA  32  14.768   4.170   4.170
  275    HA   ALA  32           HA       ALA  32  12.185   4.978   4.978
  276   1HB   ALA  32          2HB       ALA  32  13.065   2.862   2.862
  277   2HB   ALA  32          1HB       ALA  32  11.361   3.191   3.191
  278   3HB   ALA  32          3HB       ALA  32  12.406   2.634   2.634
  279    H    VAL  33           H        VAL  33  14.073   5.487   5.487
  280    HA   VAL  33           HA       VAL  33  11.865   6.533   6.533
  281    HB   VAL  33           HB       VAL  33  14.765   7.110   7.110
  282   1HG1  VAL  33          1HG1      VAL  33  12.773   8.009   8.009
  283   2HG1  VAL  33          3HG1      VAL  33  12.531   6.349   6.349
  284   3HG1  VAL  33          2HG1      VAL  33  14.035   7.189   7.189
  285   1HG2  VAL  33          2HG2      VAL  33  13.748   4.474   4.474
  286   2HG2  VAL  33          1HG2      VAL  33  15.303   4.934   4.934
  287   3HG2  VAL  33          3HG2      VAL  33  13.913   4.698   4.698
  288    H    ALA  34           H        ALA  34  14.650   7.840   7.840
  289    HA   ALA  34           HA       ALA  34  14.053  10.596  10.596
  290   1HB   ALA  34          3HB       ALA  34  15.714   9.157   9.157
  291   2HB   ALA  34          2HB       ALA  34  15.499  10.907  10.907
  292   3HB   ALA  34          1HB       ALA  34  16.265  10.164  10.164
  293    H    ALA  35           H        ALA  35  13.211   8.326   8.326
  294    HA   ALA  35           HA       ALA  35  11.890  10.129  10.129
  295   1HB   ALA  35          1HB       ALA  35  11.318   7.201   7.201
  296   2HB   ALA  35          3HB       ALA  35  10.680   8.093   8.093
  297   3HB   ALA  35          2HB       ALA  35  12.415   7.816   7.816
  298    H    ALA  36           H        ALA  36  10.652   8.159   8.159
  299    HA   ALA  36           HA       ALA  36   7.980   9.340   9.340
  300   1HB   ALA  36          2HB       ALA  36   9.299   7.212   7.212
  301   2HB   ALA  36          1HB       ALA  36   7.894   7.980   7.980
  302   3HB   ALA  36          3HB       ALA  36   7.751   7.186   7.186
  303    H    SER  37           H        SER  37   9.975  11.384  11.384
  304    HA   SER  37           HA       SER  37  10.222  12.036  12.036
  305   1HB   SER  37          2HB       SER  37  10.618  14.333  14.333
  306   2HB   SER  37          1HB       SER  37  11.443  13.209  13.209
  307    HG   SER  37           HG       SER  37   9.569  15.015  15.015
  308    H    LYS  38           H        LYS  38   7.573  12.269  12.269
  309    HA   LYS  38           HA       LYS  38   5.576  12.558  12.558
  310   1HB   LYS  38          2HB       LYS  38   4.814  14.880  14.880
  311   2HB   LYS  38          1HB       LYS  38   6.354  14.850  14.850
  312   1HG   LYS  38          2HG       LYS  38   7.263  16.012  16.012
  313   2HG   LYS  38          1HG       LYS  38   7.012  14.609  14.609
  314   1HD   LYS  38          2HD       LYS  38   5.231  15.551  15.551
  315   2HD   LYS  38          1HD       LYS  38   4.584  16.225  16.225
  316   1HE   LYS  38          2HE       LYS  38   5.458  18.247  18.247
  317   2HE   LYS  38          1HE       LYS  38   7.063  17.554  17.554
  318   1HZ   LYS  38          2HZ       LYS  38   4.952  17.340  17.340
  319   2HZ   LYS  38          1HZ       LYS  38   5.992  18.682  18.682
  320   3HZ   LYS  38          3HZ       LYS  38   6.629  17.131  17.131
  321    HA   PRO  39           HA       PRO  39   4.542  11.203  11.203
  322   1HB   PRO  39          2HB       PRO  39   3.521   8.754   8.754
  323   2HB   PRO  39          1HB       PRO  39   5.223   9.036   9.036
  324   1HG   PRO  39          2HG       PRO  39   3.968   8.634   8.634
  325   2HG   PRO  39          1HG       PRO  39   5.613   8.256   8.256
  326   1HD   PRO  39          2HD       PRO  39   4.889  10.485  10.485
  327   2HD   PRO  39          1HD       PRO  39   6.409  10.307  10.307
  328    H    ALA  40           H        ALA  40   2.240   9.812   9.812
  329    HA   ALA  40           HA       ALA  40   0.120  11.165  11.165
  330   1HB   ALA  40          2HB       ALA  40   0.788  12.304  12.304
  331   2HB   ALA  40          1HB       ALA  40  -0.150  10.982  10.982
  332   3HB   ALA  40          3HB       ALA  40  -0.912  12.111  12.111
  333    H    VAL  41           H        VAL  41  -2.081  10.212  10.212
  334    HA   VAL  41           HA       VAL  41  -1.996   7.487   7.487
  335    HB   VAL  41           HB       VAL  41  -2.642   8.106   8.106
  336   1HG1  VAL  41          1HG1      VAL  41  -3.276   5.643   5.643
  337   2HG1  VAL  41          3HG1      VAL  41  -3.258   5.655   5.655
  338   3HG1  VAL  41          2HG1      VAL  41  -4.411   6.661   6.661
  339   1HG2  VAL  41          1HG2      VAL  41  -0.685   6.269   6.269
  340   2HG2  VAL  41          3HG2      VAL  41  -0.311   7.642   7.642
  341   3HG2  VAL  41          2HG2      VAL  41  -1.033   6.185   6.185
  342    H    GLU  42           H        GLU  42  -4.278   6.661   6.661
  343    HA   GLU  42           HA       GLU  42  -6.413   8.672   8.672
  344   1HB   GLU  42          2HB       GLU  42  -5.538   9.248   9.248
  345   2HB   GLU  42          1HB       GLU  42  -5.689   7.573   7.573
  346   1HG   GLU  42          2HG       GLU  42  -8.157   7.725   7.725
  347   2HG   GLU  42          1HG       GLU  42  -7.950   9.435   9.435
  348    H    ILE  43           H        ILE  43  -7.828   7.456   7.456
  349    HA   ILE  43           HA       ILE  43  -8.094   4.576   4.576
  350    HB   ILE  43           HB       ILE  43  -8.943   6.227   6.227
  351   1HG1  ILE  43          2HG1      ILE  43  -7.322   3.861   3.861
  352   2HG1  ILE  43          1HG1      ILE  43  -6.546   4.894   4.894
  353   1HG2  ILE  43          2HG2      ILE  43  -9.781   3.499   3.499
  354   2HG2  ILE  43          1HG2      ILE  43  -9.369   3.713   3.713
  355   3HG2  ILE  43          3HG2      ILE  43 -10.645   4.688   4.688
  356   1HD1  ILE  43          3HD1      ILE  43  -7.664   6.420   6.420
  357   2HD1  ILE  43          2HD1      ILE  43  -6.449   5.252   5.252
  358   3HD1  ILE  43          1HD1      ILE  43  -6.044   6.467   6.467
  359    H    LYS  44           H        LYS  44  -9.890   3.767   3.767
  360    HA   LYS  44           HA       LYS  44 -12.215   5.602   5.602
  361   1HB   LYS  44          2HB       LYS  44 -12.200   3.270   3.270
  362   2HB   LYS  44          1HB       LYS  44 -12.347   4.973   4.973
  363   1HG   LYS  44          2HG       LYS  44  -9.944   5.241   5.241
  364   2HG   LYS  44          1HG       LYS  44  -9.692   3.654   3.654
  365   1HD   LYS  44          2HD       LYS  44 -10.205   2.540   2.540
  366   2HD   LYS  44          1HD       LYS  44 -11.282   3.816   3.816
  367   1HE   LYS  44          2HE       LYS  44  -9.180   5.272   5.272
  368   2HE   LYS  44          1HE       LYS  44  -8.261   3.779   3.779
  369   1HZ   LYS  44          1HZ       LYS  44  -9.457   2.850   2.850
  370   2HZ   LYS  44          3HZ       LYS  44 -10.332   4.292   4.292
  371   3HZ   LYS  44          2HZ       LYS  44  -8.653   4.280   4.280
  372    H    GLN  45           H        GLN  45 -13.804   5.013   5.013
  373    HA   GLN  45           HA       GLN  45 -13.930   2.169   2.169
  374   1HB   GLN  45          2HB       GLN  45 -13.875   3.880   3.880
  375   2HB   GLN  45          1HB       GLN  45 -15.345   4.606   4.606
  376   1HG   GLN  45          2HG       GLN  45 -16.584   2.523   2.523
  377   2HG   GLN  45          1HG       GLN  45 -15.120   1.759   1.759
  378   1HE2  GLN  45          2HE2      GLN  45 -16.129   2.819   2.819
  379   2HE2  GLN  45          1HE2      GLN  45 -15.770   1.509   1.509
  380    H    GLU  46           H        GLU  46 -15.333   0.852   0.852
  381    HA   GLU  46           HA       GLU  46 -17.908   2.004   2.004
  382   1HB   GLU  46          2HB       GLU  46 -16.323  -0.322  -0.322
  383   2HB   GLU  46          1HB       GLU  46 -17.885   0.239   0.239
  384   1HG   GLU  46          2HG       GLU  46 -16.590   2.573   2.573
  385   2HG   GLU  46          1HG       GLU  46 -15.193   1.506   1.506
  386    H    GLY  47           H        GLY  47 -17.935   1.313   1.313
  387   1HA   GLY  47          2HA       GLY  47 -19.435   0.016   0.016
  388   2HA   GLY  47          1HA       GLY  47 -19.531  -1.181  -1.181
  389    H    ASP  48           H        ASP  48 -18.653  -3.079  -3.079
  390    HA   ASP  48           HA       ASP  48 -16.579  -3.137  -3.137
  391   1HB   ASP  48          2HB       ASP  48 -16.538  -5.623  -5.623
  392   2HB   ASP  48          1HB       ASP  48 -18.051  -5.011  -5.011
  393    H    THR  49           H        THR  49 -16.398  -2.408  -2.408
  394    HA   THR  49           HA       THR  49 -13.872  -3.875  -3.875
  395    HB   THR  49           HB       THR  49 -15.742  -2.274  -2.274
  396    HG1  THR  49           HG1      THR  49 -16.055  -4.202  -4.202
  397   1HG2  THR  49          2HG2      THR  49 -12.860  -2.844  -2.844
  398   2HG2  THR  49          1HG2      THR  49 -13.928  -3.203  -3.203
  399   3HG2  THR  49          3HG2      THR  49 -13.872  -1.573  -1.573
  400    H    PHE  50           H        PHE  50 -11.905  -2.802  -2.802
  401    HA   PHE  50           HA       PHE  50 -11.929   0.151   0.151
  402   1HB   PHE  50          2HB       PHE  50 -10.359  -1.789  -1.789
  403   2HB   PHE  50          1HB       PHE  50 -10.127  -0.039  -0.039
  404    HD1  PHE  50           HD2      PHE  50 -11.852   1.464   1.464
  405    HD2  PHE  50           HD1      PHE  50 -12.377  -2.791  -2.791
  406    HE1  PHE  50           HE2      PHE  50 -13.792   1.710   1.710
  407    HE2  PHE  50           HE1      PHE  50 -14.324  -2.549  -2.549
  408    HZ   PHE  50           HZ       PHE  50 -15.038  -0.301  -0.301
  409    H    TYR  51           H        TYR  51 -10.809   0.903   0.903
  410    HA   TYR  51           HA       TYR  51  -8.578  -0.684  -0.684
  411   1HB   TYR  51          2HB       TYR  51 -10.424   0.077   0.077
  412   2HB   TYR  51          1HB       TYR  51 -10.051   1.742   1.742
  413    HD1  TYR  51           HD1      TYR  51  -7.570   2.474   2.474
  414    HD2  TYR  51           HD2      TYR  51  -9.353  -0.912  -0.912
  415    HE1  TYR  51           HE1      TYR  51  -5.823   2.536   2.536
  416    HE2  TYR  51           HE2      TYR  51  -7.603  -0.843  -0.843
  417    HH   TYR  51           HH       TYR  51  -6.050   0.932   0.932
  418    H    ILE  52           H        ILE  52  -6.477   0.353   0.353
  419    HA   ILE  52           HA       ILE  52  -6.275   2.997   2.997
  420    HB   ILE  52           HB       ILE  52  -4.316   0.873   0.873
  421   1HG1  ILE  52          2HG1      ILE  52  -7.129   1.199   1.199
  422   2HG1  ILE  52          1HG1      ILE  52  -6.468  -0.239  -0.239
  423   1HG2  ILE  52          1HG2      ILE  52  -4.360   3.447   3.447
  424   2HG2  ILE  52          3HG2      ILE  52  -5.576   2.971   2.971
  425   3HG2  ILE  52          2HG2      ILE  52  -3.953   2.287   2.287
  426   1HD1  ILE  52          1HD1      ILE  52  -4.668   0.312   0.312
  427   2HD1  ILE  52          3HD1      ILE  52  -6.252   0.633   0.633
  428   3HD1  ILE  52          2HD1      ILE  52  -5.904  -0.945  -0.945
  429    H    LYS  53           H        LYS  53  -5.371   4.178   4.178
  430    HA   LYS  53           HA       LYS  53  -3.091   3.020   3.020
  431   1HB   LYS  53          2HB       LYS  53  -4.968   4.152   4.152
  432   2HB   LYS  53          1HB       LYS  53  -4.550   5.651   5.651
  433   1HG   LYS  53          2HG       LYS  53  -2.178   4.439   4.439
  434   2HG   LYS  53          1HG       LYS  53  -3.426   4.633   4.633
  435   1HD   LYS  53          2HD       LYS  53  -3.635   7.031   7.031
  436   2HD   LYS  53          1HD       LYS  53  -1.925   6.700   6.700
  437   1HE   LYS  53          2HE       LYS  53  -1.401   6.790   6.790
  438   2HE   LYS  53          1HE       LYS  53  -2.986   6.203   6.203
  439   1HZ   LYS  53          2HZ       LYS  53  -2.622   8.865   8.865
  440   2HZ   LYS  53          1HZ       LYS  53  -2.467   8.628   8.628
  441   3HZ   LYS  53          3HZ       LYS  53  -3.941   8.294   8.294
  442    H    THR  54           H        THR  54  -1.176   3.395   3.395
  443    HA   THR  54           HA       THR  54  -0.830   6.007   6.007
  444    HB   THR  54           HB       THR  54   0.881   3.501   3.501
  445    HG1  THR  54           HG1      THR  54  -0.585   2.837   2.837
  446   1HG2  THR  54          3HG2      THR  54   1.050   6.227   6.227
  447   2HG2  THR  54          2HG2      THR  54   1.362   4.900   4.900
  448   3HG2  THR  54          1HG2      THR  54   2.333   5.067   5.067
  449    H    SER  55           H        SER  55   0.835   7.414   7.414
  450    HA   SER  55           HA       SER  55   2.703   6.500   6.500
  451   1HB   SER  55          2HB       SER  55   2.039   8.757   8.757
  452   2HB   SER  55          1HB       SER  55   1.119   7.282   7.282
  453    HG   SER  55           HG       SER  55  -0.514   8.395   8.395
  454    H    THR  56           H        THR  56   4.684   7.313   7.313
  455    HA   THR  56           HA       THR  56   4.847   9.588   9.588
  456    HB   THR  56           HB       THR  56   6.992   7.695   7.695
  457    HG1  THR  56           HG1      THR  56   5.901   6.406   6.406
  458   1HG2  THR  56          3HG2      THR  56   6.905   9.743   9.743
  459   2HG2  THR  56          2HG2      THR  56   8.168   8.521   8.521
  460   3HG2  THR  56          1HG2      THR  56   7.954   9.740   9.740
  461    H    THR  57           H        THR  57   6.766   8.505   8.505
  462    HA   THR  57           HA       THR  57   6.419  10.914  10.914
  463    HB   THR  57           HB       THR  57   7.757  11.945  11.945
  464    HG1  THR  57           HG1      THR  57   8.204  12.494  12.494
  465   1HG2  THR  57          1HG2      THR  57   8.811   9.611   9.611
  466   2HG2  THR  57          3HG2      THR  57  10.041  10.098  10.098
  467   3HG2  THR  57          2HG2      THR  57   9.752  11.077  11.077
  468    H    VAL  58           H        VAL  58   8.613   8.275   8.275
  469    HA   VAL  58           HA       VAL  58   9.164   7.858   7.858
  470    HB   VAL  58           HB       VAL  58  10.699   6.749   6.749
  471   1HG1  VAL  58          2HG1      VAL  58  11.110   6.787   6.787
  472   2HG1  VAL  58          1HG1      VAL  58  12.446   6.505   6.505
  473   3HG1  VAL  58          3HG1      VAL  58  11.078   5.392   5.392
  474   1HG2  VAL  58          2HG2      VAL  58  10.768   9.388   9.388
  475   2HG2  VAL  58          1HG2      VAL  58  11.472   8.871   8.871
  476   3HG2  VAL  58          3HG2      VAL  58  12.337   8.583   8.583
  477    H    ARG  59           H        ARG  59   7.580   6.576   6.576
  478    HA   ARG  59           HA       ARG  59   7.110   4.027   4.027
  479   1HB   ARG  59          2HB       ARG  59   8.490   3.678   3.678
  480   2HB   ARG  59          1HB       ARG  59   7.207   4.405   4.405
  481   1HG   ARG  59          2HG       ARG  59   5.717   2.640   2.640
  482   2HG   ARG  59          1HG       ARG  59   6.620   2.090   2.090
  483   1HD   ARG  59          2HD       ARG  59   7.612   1.949   1.949
  484   2HD   ARG  59          1HD       ARG  59   6.971   0.587   0.587
  485    HE   ARG  59           HE       ARG  59   8.927   0.814   0.814
  486   1HH1  ARG  59          1HH2      ARG  59  10.651   2.631   2.631
  487   2HH1  ARG  59          2HH2      ARG  59  11.612   2.785   2.785
  488   1HH2  ARG  59          1HH1      ARG  59  10.916   1.845   1.845
  489   2HH2  ARG  59          2HH1      ARG  59   9.422   0.970   0.970
  490    H    THR  60           H        THR  60   4.972   3.045   3.045
  491    HA   THR  60           HA       THR  60   2.917   4.707   4.707
  492    HB   THR  60           HB       THR  60   2.825   4.195   4.195
  493    HG1  THR  60           HG1      THR  60   3.086   6.642   6.642
  494   1HG2  THR  60          3HG2      THR  60   0.885   5.200   5.200
  495   2HG2  THR  60          2HG2      THR  60   0.922   6.043   6.043
  496   3HG2  THR  60          1HG2      THR  60   0.591   4.312   4.312
  497    H    THR  61           H        THR  61   2.133   2.990   2.990
  498    HA   THR  61           HA       THR  61   1.712   0.375   0.375
  499    HB   THR  61           HB       THR  61   1.111  -0.388  -0.388
  500    HG1  THR  61           HG1      THR  61   1.277   1.041   1.041
  501   1HG2  THR  61          3HG2      THR  61   3.735   1.074   1.074
  502   2HG2  THR  61          2HG2      THR  61   3.420  -0.046  -0.046
  503   3HG2  THR  61          1HG2      THR  61   3.404  -0.625  -0.625
  504    H    GLU  62           H        GLU  62  -0.421  -0.748  -0.748
  505    HA   GLU  62           HA       GLU  62  -2.767   0.944   0.944
  506   1HB   GLU  62          2HB       GLU  62  -1.869   0.271   0.271
  507   2HB   GLU  62          1HB       GLU  62  -3.541  -0.185  -0.185
  508   1HG   GLU  62          2HG       GLU  62  -4.079   2.081   2.081
  509   2HG   GLU  62          1HG       GLU  62  -2.390   2.564   2.564
  510    H    ILE  63           H        ILE  63  -4.119  -0.370  -0.370
  511    HA   ILE  63           HA       ILE  63  -4.052  -3.312  -3.312
  512    HB   ILE  63           HB       ILE  63  -4.531  -3.667  -3.667
  513   1HG1  ILE  63          2HG1      ILE  63  -3.870  -0.712  -0.712
  514   2HG1  ILE  63          1HG1      ILE  63  -5.495  -1.381  -1.381
  515   1HG2  ILE  63          3HG2      ILE  63  -2.185  -3.574  -3.574
  516   2HG2  ILE  63          2HG2      ILE  63  -2.028  -2.008  -2.008
  517   3HG2  ILE  63          1HG2      ILE  63  -2.270  -3.466  -3.466
  518   1HD1  ILE  63          3HD1      ILE  63  -3.410  -2.659  -2.659
  519   2HD1  ILE  63          2HD1      ILE  63  -3.838  -1.005  -1.005
  520   3HD1  ILE  63          1HD1      ILE  63  -5.081  -2.255  -2.255
  521    H    ASN  64           H        ASN  64  -6.161  -4.392  -4.392
  522    HA   ASN  64           HA       ASN  64  -8.510  -2.682  -2.682
  523   1HB   ASN  64          2HB       ASN  64  -9.639  -3.553  -3.553
  524   2HB   ASN  64          1HB       ASN  64  -8.260  -2.521  -2.521
  525   1HD2  ASN  64          2HD2      ASN  64  -6.192  -5.233  -5.233
  526   2HD2  ASN  64          1HD2      ASN  64  -6.109  -3.773  -3.773
  527    H    PHE  65           H        PHE  65  -9.973  -3.880  -3.880
  528    HA   PHE  65           HA       PHE  65 -10.250  -6.772  -6.772
  529   1HB   PHE  65          2HB       PHE  65  -9.435  -7.474  -7.474
  530   2HB   PHE  65          1HB       PHE  65  -8.162  -6.617  -6.617
  531    HD1  PHE  65           HD2      PHE  65  -7.542  -4.292  -4.292
  532    HD2  PHE  65           HD1      PHE  65 -10.486  -6.541  -6.541
  533    HE1  PHE  65           HE2      PHE  65  -7.426  -2.653  -2.653
  534    HE2  PHE  65           HE1      PHE  65 -10.379  -4.909  -4.909
  535    HZ   PHE  65           HZ       PHE  65  -8.855  -2.962  -2.962
  536    H    LYS  66           H        LYS  66 -11.400  -7.668  -7.668
  537    HA   LYS  66           HA       LYS  66 -13.578  -5.784  -5.784
  538   1HB   LYS  66          2HB       LYS  66 -15.109  -7.839  -7.839
  539   2HB   LYS  66          1HB       LYS  66 -14.657  -7.189  -7.189
  540   1HG   LYS  66          2HG       LYS  66 -12.752  -8.887  -8.887
  541   2HG   LYS  66          1HG       LYS  66 -13.524  -9.626  -9.626
  542   1HD   LYS  66          2HD       LYS  66 -14.457 -10.839 -10.839
  543   2HD   LYS  66          1HD       LYS  66 -15.676  -9.601  -9.601
  544   1HE   LYS  66          2HE       LYS  66 -14.752  -8.222  -8.222
  545   2HE   LYS  66          1HE       LYS  66 -13.472  -9.405  -9.405
  546   1HZ   LYS  66          3HZ       LYS  66 -15.276 -11.055 -11.055
  547   2HZ   LYS  66          2HZ       LYS  66 -16.386  -9.770  -9.770
  548   3HZ   LYS  66          1HZ       LYS  66 -15.161  -9.821  -9.821
  549    H    VAL  67           H        VAL  67 -14.444  -6.285  -6.285
  550    HA   VAL  67           HA       VAL  67 -12.358  -7.468  -7.468
  551    HB   VAL  67           HB       VAL  67 -14.924  -6.757  -6.757
  552   1HG1  VAL  67          2HG1      VAL  67 -11.973  -6.334  -6.334
  553   2HG1  VAL  67          1HG1      VAL  67 -13.136  -5.380  -5.380
  554   3HG1  VAL  67          3HG1      VAL  67 -13.135  -7.138  -7.138
  555   1HG2  VAL  67          1HG2      VAL  67 -13.433  -4.823  -4.823
  556   2HG2  VAL  67          3HG2      VAL  67 -15.152  -4.888  -4.888
  557   3HG2  VAL  67          2HG2      VAL  67 -14.010  -4.256  -4.256
  558    H    GLY  68           H        GLY  68 -12.368  -9.704  -9.704
  559   1HA   GLY  68          2HA       GLY  68 -13.661 -11.498 -11.498
  560   2HA   GLY  68          1HA       GLY  68 -14.944 -11.146 -11.146
  561    H    GLU  69           H        GLU  69 -13.111 -10.806 -10.806
  562    HA   GLU  69           HA       GLU  69 -12.427 -13.696 -13.696
  563   1HB   GLU  69          2HB       GLU  69 -12.963 -11.617 -11.617
  564   2HB   GLU  69          1HB       GLU  69 -12.822 -13.360 -13.360
  565   1HG   GLU  69          2HG       GLU  69 -14.786 -13.398 -13.398
  566   2HG   GLU  69          1HG       GLU  69 -15.077 -11.777 -11.777
  567    H    GLU  70           H        GLU  70 -10.453 -14.191 -14.191
  568    HA   GLU  70           HA       GLU  70  -8.308 -12.261 -12.261
  569   1HB   GLU  70          2HB       GLU  70  -6.846 -14.129 -14.129
  570   2HB   GLU  70          1HB       GLU  70  -7.886 -14.595 -14.595
  571   1HG   GLU  70          2HG       GLU  70  -9.117 -14.993 -14.993
  572   2HG   GLU  70          1HG       GLU  70  -7.668 -15.964 -15.964
  573    H    PHE  71           H        PHE  71  -6.634 -11.920 -11.920
  574    HA   PHE  71           HA       PHE  71  -7.605 -12.112 -12.112
  575   1HB   PHE  71          2HB       PHE  71  -7.569  -9.622  -9.622
  576   2HB   PHE  71          1HB       PHE  71  -8.883 -10.166 -10.166
  577    HD1  PHE  71           HD2      PHE  71  -8.548 -10.070 -10.070
  578    HD2  PHE  71           HD1      PHE  71  -5.933  -8.106  -8.106
  579    HE1  PHE  71           HE2      PHE  71  -7.679  -8.636  -8.636
  580    HE2  PHE  71           HE1      PHE  71  -5.063  -6.674  -6.674
  581    HZ   PHE  71           HZ       PHE  71  -5.932  -6.938  -6.938
  582    H    GLU  72           H        GLU  72  -6.036 -10.810 -10.810
  583    HA   GLU  72           HA       GLU  72  -3.295 -11.149 -11.149
  584   1HB   GLU  72          2HB       GLU  72  -3.809 -10.710 -10.710
  585   2HB   GLU  72          1HB       GLU  72  -2.478 -11.550 -11.550
  586   1HG   GLU  72          2HG       GLU  72  -4.103 -13.331 -13.331
  587   2HG   GLU  72          1HG       GLU  72  -5.330 -12.539 -12.539
  588    H    GLU  73           H        GLU  73  -1.877  -9.408  -9.408
  589    HA   GLU  73           HA       GLU  73  -2.557  -6.902  -6.902
  590   1HB   GLU  73          2HB       GLU  73  -2.599  -5.579  -5.579
  591   2HB   GLU  73          1HB       GLU  73  -3.990  -6.648  -6.648
  592   1HG   GLU  73          2HG       GLU  73  -3.337  -8.015  -8.015
  593   2HG   GLU  73          1HG       GLU  73  -1.621  -7.817  -7.817
  594    H    GLN  74           H        GLN  74  -0.914  -5.159  -5.159
  595    HA   GLN  74           HA       GLN  74   1.744  -6.535  -6.535
  596   1HB   GLN  74          2HB       GLN  74   0.790  -3.738  -3.738
  597   2HB   GLN  74          1HB       GLN  74   2.489  -4.017  -4.017
  598   1HG   GLN  74          2HG       GLN  74   2.405  -5.878  -5.878
  599   2HG   GLN  74          1HG       GLN  74   0.880  -5.153  -5.153
  600   1HE2  GLN  74          2HE2      GLN  74   4.254  -2.812  -2.812
  601   2HE2  GLN  74          1HE2      GLN  74   4.127  -3.866  -3.866
  602    H    THR  75           H        THR  75   3.401  -5.895  -5.895
  603    HA   THR  75           HA       THR  75   2.221  -5.328  -5.328
  604    HB   THR  75           HB       THR  75   3.794  -7.269  -7.269
  605    HG1  THR  75           HG1      THR  75   4.155  -7.100  -7.100
  606   1HG2  THR  75          2HG2      THR  75   5.433  -5.199  -5.199
  607   2HG2  THR  75          1HG2      THR  75   6.246  -5.849  -5.849
  608   3HG2  THR  75          3HG2      THR  75   5.784  -6.922  -6.922
  609    H    VAL  76           H        VAL  76   5.048  -4.230  -4.230
  610    HA   VAL  76           HA       VAL  76   4.485  -1.460  -1.460
  611    HB   VAL  76           HB       VAL  76   6.003  -2.348  -2.348
  612   1HG1  VAL  76          3HG1      VAL  76   5.123   0.295   0.295
  613   2HG1  VAL  76          2HG1      VAL  76   5.303   0.099   0.099
  614   3HG1  VAL  76          1HG1      VAL  76   6.687  -0.155  -0.155
  615   1HG2  VAL  76          3HG2      VAL  76   3.112  -1.535  -1.535
  616   2HG2  VAL  76          2HG2      VAL  76   3.716  -3.056  -3.056
  617   3HG2  VAL  76          1HG2      VAL  76   3.903  -1.563  -1.563
  618    H    ASP  77           H        ASP  77   6.886  -3.973  -3.973
  619    HA   ASP  77           HA       ASP  77   9.066  -2.108  -2.108
  620   1HB   ASP  77          2HB       ASP  77   9.068  -4.509  -4.509
  621   2HB   ASP  77          1HB       ASP  77   9.468  -5.014  -5.014
  622    H    GLY  78           H        GLY  78   7.093  -4.574  -4.574
  623   1HA   GLY  78          2HA       GLY  78   6.533  -3.793  -3.793
  624   2HA   GLY  78          1HA       GLY  78   8.284  -3.822  -3.822
  625    H    ARG  79           H        ARG  79   6.168  -6.095  -6.095
  626    HA   ARG  79           HA       ARG  79   7.018  -8.231  -8.231
  627   1HB   ARG  79          2HB       ARG  79   7.221  -8.071  -8.071
  628   2HB   ARG  79          1HB       ARG  79   6.806  -9.628  -9.628
  629   1HG   ARG  79          2HG       ARG  79   9.001  -8.320  -8.320
  630   2HG   ARG  79          1HG       ARG  79   9.377  -8.586  -8.586
  631   1HD   ARG  79          2HD       ARG  79   8.099 -10.837 -10.837
  632   2HD   ARG  79          1HD       ARG  79   9.788 -10.483 -10.483
  633    HE   ARG  79           HE       ARG  79   8.783 -11.158 -11.158
  634   1HH1  ARG  79          2HH1      ARG  79  11.511  -9.909  -9.909
  635   2HH1  ARG  79          1HH1      ARG  79  12.577 -11.195 -11.195
  636   1HH2  ARG  79          1HH2      ARG  79  10.024 -13.297 -13.297
  637   2HH2  ARG  79          2HH2      ARG  79  11.736 -13.112 -13.112
  638    HA   PRO  80           HA       PRO  80   2.660  -9.089  -9.089
  639   1HB   PRO  80          2HB       PRO  80   2.707 -11.685 -11.685
  640   2HB   PRO  80          1HB       PRO  80   2.975 -10.274 -10.274
  641   1HG   PRO  80          2HG       PRO  80   4.952 -12.252 -12.252
  642   2HG   PRO  80          1HG       PRO  80   5.021 -11.252 -11.252
  643   1HD   PRO  80          2HD       PRO  80   6.396 -10.753 -10.753
  644   2HD   PRO  80          1HD       PRO  80   6.202  -9.611  -9.611
  645    H    CYS  81           H        CYS  81   1.185  -9.935  -9.935
  646    HA   CYS  81           HA       CYS  81   1.746 -12.326 -12.326
  647   1HB   CYS  81          2HB       CYS  81   1.542 -11.081 -11.081
  648   2HB   CYS  81          1HB       CYS  81   3.061 -10.823 -10.823
  649    HG   CYS  81           HG       CYS  81   2.018  -8.511  -8.511
  650    H    LYS  82           H        LYS  82  -0.157 -13.165 -13.165
  651    HA   LYS  82           HA       LYS  82  -2.652 -11.782 -11.782
  652   1HB   LYS  82          2HB       LYS  82  -2.373 -14.193 -14.193
  653   2HB   LYS  82          1HB       LYS  82  -2.218 -14.537 -14.537
  654   1HG   LYS  82          2HG       LYS  82  -4.500 -13.287 -13.287
  655   2HG   LYS  82          1HG       LYS  82  -4.628 -13.639 -13.639
  656   1HD   LYS  82          2HD       LYS  82  -4.076 -15.727 -15.727
  657   2HD   LYS  82          1HD       LYS  82  -5.671 -15.403 -15.403
  658   1HE   LYS  82          2HE       LYS  82  -3.364 -15.971 -15.971
  659   2HE   LYS  82          1HE       LYS  82  -4.189 -17.308 -17.308
  660   1HZ   LYS  82          3HZ       LYS  82  -6.304 -16.347 -16.347
  661   2HZ   LYS  82          2HZ       LYS  82  -5.378 -15.270 -15.270
  662   3HZ   LYS  82          1HZ       LYS  82  -5.264 -16.944 -16.944
  663    H    SER  83           H        SER  83  -3.439 -10.394 -10.394
  664    HA   SER  83           HA       SER  83  -2.821 -10.859 -10.859
  665   1HB   SER  83          2HB       SER  83  -2.473  -8.641  -8.641
  666   2HB   SER  83          1HB       SER  83  -4.171  -8.402  -8.402
  667    HG   SER  83           HG       SER  83  -2.486  -7.607  -7.607
  668    H    LEU  84           H        LEU  84  -4.713  -9.920  -9.920
  669    HA   LEU  84           HA       LEU  84  -7.399 -10.523 -10.523
  670   1HB   LEU  84          2HB       LEU  84  -6.639 -12.755 -12.755
  671   2HB   LEU  84          1HB       LEU  84  -6.185 -12.099 -12.099
  672    HG   LEU  84           HG       LEU  84  -8.537 -11.503 -11.503
  673   1HD1  LEU  84          2HD1      LEU  84  -9.188 -11.205 -11.205
  674   2HD1  LEU  84          1HD1      LEU  84  -9.131 -12.954 -12.954
  675   3HD1  LEU  84          3HD1      LEU  84 -10.306 -12.223 -12.223
  676   1HD2  LEU  84          2HD2      LEU  84  -7.952 -14.352 -14.352
  677   2HD2  LEU  84          1HD2      LEU  84  -7.856 -13.651 -13.651
  678   3HD2  LEU  84          3HD2      LEU  84  -9.427 -13.885 -13.885
  679    H    VAL  85           H        VAL  85  -9.028  -9.600  -9.600
  680    HA   VAL  85           HA       VAL  85  -7.895  -8.007  -8.007
  681    HB   VAL  85           HB       VAL  85  -9.806  -6.781  -6.781
  682   1HG1  VAL  85          1HG1      VAL  85  -9.551  -5.753  -5.753
  683   2HG1  VAL  85          3HG1      VAL  85  -7.819  -5.593  -5.593
  684   3HG1  VAL  85          2HG1      VAL  85  -8.965  -4.698  -4.698
  685   1HG2  VAL  85          3HG2      VAL  85  -6.849  -7.115  -7.115
  686   2HG2  VAL  85          2HG2      VAL  85  -8.049  -7.031  -7.031
  687   3HG2  VAL  85          1HG2      VAL  85  -7.523  -5.558  -5.558
  688    H    LYS  86           H        LYS  86  -9.152  -8.050  -8.050
  689    HA   LYS  86           HA       LYS  86 -12.054  -8.662  -8.662
  690   1HB   LYS  86          2HB       LYS  86 -11.649  -9.623  -9.623
  691   2HB   LYS  86          1HB       LYS  86 -11.408 -10.640 -10.640
  692   1HG   LYS  86          2HG       LYS  86  -8.996 -10.185 -10.185
  693   2HG   LYS  86          1HG       LYS  86  -9.223  -9.089  -9.089
  694   1HD   LYS  86          2HD       LYS  86 -10.149 -11.956 -11.956
  695   2HD   LYS  86          1HD       LYS  86  -8.483 -11.518 -11.518
  696   1HE   LYS  86          2HE       LYS  86  -9.343  -9.858  -9.858
  697   2HE   LYS  86          1HE       LYS  86 -10.978 -10.437 -10.437
  698   1HZ   LYS  86          3HZ       LYS  86  -8.836 -12.315 -12.315
  699   2HZ   LYS  86          2HZ       LYS  86  -9.685 -11.443 -11.443
  700   3HZ   LYS  86          1HZ       LYS  86 -10.516 -12.499 -12.499
  701    H    TRP  87           H        TRP  87 -13.312  -7.744  -7.744
  702    HA   TRP  87           HA       TRP  87 -12.247  -5.074  -5.074
  703   1HB   TRP  87          2HB       TRP  87 -14.887  -6.451  -6.451
  704   2HB   TRP  87          1HB       TRP  87 -14.519  -4.879  -4.879
  705    HD1  TRP  87           HD1      TRP  87 -15.715  -6.526  -6.526
  706    HE1  TRP  87           HE1      TRP  87 -15.967  -4.830  -4.830
  707    HE3  TRP  87           HE3      TRP  87 -13.241  -2.564  -2.564
  708    HZ2  TRP  87           HZ2      TRP  87 -15.212  -2.136  -2.136
  709    HZ3  TRP  87           HZ3      TRP  87 -12.995  -0.449  -0.449
  710    HH2  TRP  87           HH2      TRP  87 -13.977  -0.238  -0.238
  711    H    GLU  88           H        GLU  88 -12.515  -4.282  -4.282
  712    HA   GLU  88           HA       GLU  88 -11.924  -6.373  -6.373
  713   1HB   GLU  88          2HB       GLU  88  -9.900  -4.969  -4.969
  714   2HB   GLU  88          1HB       GLU  88 -10.642  -3.646  -3.646
  715   1HG   GLU  88          2HG       GLU  88  -9.215  -4.574  -4.574
  716   2HG   GLU  88          1HG       GLU  88 -10.761  -5.337  -5.337
  717    H    SER  89           H        SER  89 -12.826  -3.035  -3.035
  718    HA   SER  89           HA       SER  89 -14.807  -3.133  -3.133
  719   1HB   SER  89          2HB       SER  89 -14.224  -0.889  -0.889
  720   2HB   SER  89          1HB       SER  89 -12.715  -1.793  -1.793
  721    HG   SER  89           HG       SER  89 -13.339   0.410   0.410
  722    H    GLU  90           H        GLU  90 -15.690  -0.401  -0.401
  723    HA   GLU  90           HA       GLU  90 -17.348  -1.108  -1.108
  724   1HB   GLU  90          2HB       GLU  90 -17.131   1.620   1.620
  725   2HB   GLU  90          1HB       GLU  90 -18.492   0.968   0.968
  726   1HG   GLU  90          2HG       GLU  90 -18.258  -0.926  -0.926
  727   2HG   GLU  90          1HG       GLU  90 -17.704   0.497   0.497
  728    H    ASN  91           H        ASN  91 -14.387   0.684   0.684
  729    HA   ASN  91           HA       ASN  91 -14.297   1.132   1.132
  730   1HB   ASN  91          2HB       ASN  91 -13.557   3.319   3.319
  731   2HB   ASN  91          1HB       ASN  91 -13.675   3.431   3.431
  732   1HD2  ASN  91          2HD2      ASN  91 -16.884   4.373   4.373
  733   2HD2  ASN  91          1HD2      ASN  91 -15.282   4.436   4.436
  734    H    LYS  92           H        LYS  92 -12.835  -0.676  -0.676
  735    HA   LYS  92           HA       LYS  92 -10.104   0.233   0.233
  736   1HB   LYS  92          2HB       LYS  92 -10.414   0.705   0.705
  737   2HB   LYS  92          1HB       LYS  92 -10.890  -0.971  -0.971
  738   1HG   LYS  92          2HG       LYS  92  -8.627  -1.630  -1.630
  739   2HG   LYS  92          1HG       LYS  92  -8.185   0.071   0.071
  740   1HD   LYS  92          2HD       LYS  92  -8.654   0.012   0.012
  741   2HD   LYS  92          1HD       LYS  92  -9.100  -1.689  -1.689
  742   1HE   LYS  92          2HE       LYS  92  -6.926  -2.384  -2.384
  743   2HE   LYS  92          1HE       LYS  92  -6.446  -0.929  -0.929
  744   1HZ   LYS  92          3HZ       LYS  92  -7.181  -0.772  -0.772
  745   2HZ   LYS  92          2HZ       LYS  92  -5.623  -1.279  -1.279
  746   3HZ   LYS  92          1HZ       LYS  92  -6.183   0.258   0.258
  747    H    MET  93           H        MET  93  -9.658  -1.268  -1.268
  748    HA   MET  93           HA       MET  93 -10.318  -4.120  -4.120
  749   1HB   MET  93          2HB       MET  93  -9.950  -4.352  -4.352
  750   2HB   MET  93          1HB       MET  93 -11.485  -3.762  -3.762
  751   1HG   MET  93          2HG       MET  93 -11.087  -1.591  -1.591
  752   2HG   MET  93          1HG       MET  93  -9.340  -1.766  -1.766
  753   1HE   MET  93          1HE       MET  93 -12.182  -3.643  -3.643
  754   2HE   MET  93          3HE       MET  93 -12.507  -2.427  -2.427
  755   3HE   MET  93          2HE       MET  93 -11.874  -4.006  -4.006
  756    H    VAL  94           H        VAL  94  -8.784  -5.718  -5.718
  757    HA   VAL  94           HA       VAL  94  -5.970  -4.740  -4.740
  758    HB   VAL  94           HB       VAL  94  -6.826  -7.533  -7.533
  759   1HG1  VAL  94          3HG1      VAL  94  -4.393  -5.930  -5.930
  760   2HG1  VAL  94          2HG1      VAL  94  -4.754  -6.674  -6.674
  761   3HG1  VAL  94          1HG1      VAL  94  -4.591  -7.677  -7.677
  762   1HG2  VAL  94          2HG2      VAL  94  -7.202  -5.031  -5.031
  763   2HG2  VAL  94          1HG2      VAL  94  -8.147  -6.519  -6.519
  764   3HG2  VAL  94          3HG2      VAL  94  -6.599  -6.448  -6.448
  765    H    CYS  95           H        CYS  95  -4.444  -6.450  -6.450
  766    HA   CYS  95           HA       CYS  95  -5.763  -7.811  -7.811
  767   1HB   CYS  95          2HB       CYS  95  -5.314  -5.470  -5.470
  768   2HB   CYS  95          1HB       CYS  95  -3.609  -5.718  -5.718
  769    HG   CYS  95           HG       CYS  95  -3.535  -7.522  -7.522
  770    H    GLU  96           H        GLU  96  -4.747  -9.698  -9.698
  771    HA   GLU  96           HA       GLU  96  -2.008 -10.115 -10.115
  772   1HB   GLU  96          2HB       GLU  96  -2.507 -12.565 -12.565
  773   2HB   GLU  96          1HB       GLU  96  -3.523 -11.833 -11.833
  774   1HG   GLU  96          2HG       GLU  96  -5.376 -11.655 -11.655
  775   2HG   GLU  96          1HG       GLU  96  -4.376 -11.910 -11.910
  776    H    GLN  97           H        GLN  97  -0.497 -11.390 -11.390
  777    HA   GLN  97           HA       GLN  97  -1.197 -11.203 -11.203
  778   1HB   GLN  97          2HB       GLN  97  -0.448  -8.881  -8.881
  779   2HB   GLN  97          1HB       GLN  97   1.161  -9.577  -9.577
  780   1HG   GLN  97          2HG       GLN  97   0.439 -10.217 -10.217
  781   2HG   GLN  97          1HG       GLN  97  -0.839  -9.026  -9.026
  782   1HE2  GLN  97          2HE2      GLN  97   1.317  -6.253  -6.253
  783   2HE2  GLN  97          1HE2      GLN  97  -0.270  -6.802  -6.802
  784    H    LYS  98           H        LYS  98   0.104 -12.445 -12.445
  785    HA   LYS  98           HA       LYS  98   2.675 -13.481 -13.481
  786   1HB   LYS  98          2HB       LYS  98   1.990 -15.827 -15.827
  787   2HB   LYS  98          1HB       LYS  98   1.034 -15.129 -15.129
  788   1HG   LYS  98          2HG       LYS  98  -0.725 -14.525 -14.525
  789   2HG   LYS  98          1HG       LYS  98   0.203 -15.405 -15.405
  790   1HD   LYS  98          2HD       LYS  98  -0.015 -17.474 -17.474
  791   2HD   LYS  98          1HD       LYS  98  -0.810 -16.623 -16.623
  792   1HE   LYS  98          2HE       LYS  98  -1.937 -16.542 -16.542
  793   2HE   LYS  98          1HE       LYS  98  -2.315 -17.872 -17.872
  794   1HZ   LYS  98          2HZ       LYS  98  -3.096 -16.247 -16.247
  795   2HZ   LYS  98          1HZ       LYS  98  -2.775 -14.986 -14.986
  796   3HZ   LYS  98          3HZ       LYS  98  -3.968 -16.137 -16.137
  797    H    LEU  99           H        LEU  99   4.041 -14.177 -14.177
  798    HA   LEU  99           HA       LEU  99   3.665 -12.798 -12.798
  799   1HB   LEU  99          2HB       LEU  99   5.339 -15.222 -15.222
  800   2HB   LEU  99          1HB       LEU  99   5.437 -14.361 -14.361
  801    HG   LEU  99           HG       LEU  99   5.644 -12.724 -12.724
  802   1HD1  LEU  99          1HD1      LEU  99   7.845 -14.541 -14.541
  803   2HD1  LEU  99          3HD1      LEU  99   8.073 -13.257 -13.257
  804   3HD1  LEU  99          2HD1      LEU  99   7.061 -14.648 -14.648
  805   1HD2  LEU  99          1HD2      LEU  99   5.765 -12.020 -12.020
  806   2HD2  LEU  99          3HD2      LEU  99   6.942 -11.340 -11.340
  807   3HD2  LEU  99          2HD2      LEU  99   7.400 -12.677 -12.677
  808    H    LEU 100           H        LEU 100   3.581 -13.871 -13.871
  809    HA   LEU 100           HA       LEU 100   1.403 -15.879 -15.879
  810   1HB   LEU 100          2HB       LEU 100   2.521 -13.946 -13.946
  811   2HB   LEU 100          1HB       LEU 100   1.431 -15.255 -15.255
  812    HG   LEU 100           HG       LEU 100   0.716 -13.365 -13.365
  813   1HD1  LEU 100          2HD1      LEU 100   0.700 -12.891 -12.891
  814   2HD1  LEU 100          1HD1      LEU 100  -0.716 -12.365 -12.365
  815   3HD1  LEU 100          3HD1      LEU 100   0.878 -11.738 -11.738
  816   1HD2  LEU 100          1HD2      LEU 100  -0.664 -15.364 -15.364
  817   2HD2  LEU 100          3HD2      LEU 100  -0.795 -15.138 -15.138
  818   3HD2  LEU 100          2HD2      LEU 100  -1.595 -14.013 -14.013
  819    H    LYS 101           H        LYS 101   4.791 -15.701 -15.701
  820    HA   LYS 101           HA       LYS 101   4.919 -18.436 -18.436
  821   1HB   LYS 101          2HB       LYS 101   5.142 -16.694 -16.694
  822   2HB   LYS 101          1HB       LYS 101   6.724 -16.350 -16.350
  823   1HG   LYS 101          2HG       LYS 101   6.052 -19.220 -19.220
  824   2HG   LYS 101          1HG       LYS 101   6.348 -18.268 -18.268
  825   1HD   LYS 101          2HD       LYS 101   8.243 -18.094 -18.094
  826   2HD   LYS 101          1HD       LYS 101   8.376 -19.419 -19.419
  827   1HE   LYS 101          2HE       LYS 101   8.331 -16.494 -16.494
  828   2HE   LYS 101          1HE       LYS 101   9.809 -17.430 -17.430
  829   1HZ   LYS 101          1HZ       LYS 101   8.722 -19.055 -19.055
  830   2HZ   LYS 101          3HZ       LYS 101   7.696 -17.766 -17.766
  831   3HZ   LYS 101          2HZ       LYS 101   9.374 -17.614 -17.614
  832    H    GLY 102           H        GLY 102   6.675 -19.552 -19.552
  833   1HA   GLY 102          2HA       GLY 102   8.483 -19.958 -19.958
  834   2HA   GLY 102          1HA       GLY 102   9.028 -18.319 -18.319
  835    H    GLU 103           H        GLU 103   9.591 -18.186 -18.186
  836    HA   GLU 103           HA       GLU 103   7.605 -16.805 -16.805
  837   1HB   GLU 103          2HB       GLU 103   6.715 -19.140 -19.140
  838   2HB   GLU 103          1HB       GLU 103   8.225 -19.589 -19.589
  839   1HG   GLU 103          2HG       GLU 103   7.816 -18.163 -18.163
  840   2HG   GLU 103          1HG       GLU 103   6.565 -17.271 -17.271
  841    H    GLY 104           H        GLY 104   8.577 -15.696 -15.696
  842   1HA   GLY 104          2HA       GLY 104  11.130 -16.586 -16.586
  843   2HA   GLY 104          1HA       GLY 104  11.206 -15.094 -15.094
  844    HA   PRO 105           HA       PRO 105   9.690 -13.063 -13.063
  845   1HB   PRO 105          2HB       PRO 105   8.895 -10.686 -10.686
  846   2HB   PRO 105          1HB       PRO 105  10.595 -11.117 -11.117
  847   1HG   PRO 105          2HG       PRO 105   9.069 -10.986 -10.986
  848   2HG   PRO 105          1HG       PRO 105  10.818 -10.898 -10.898
  849   1HD   PRO 105          2HD       PRO 105   9.322 -13.176 -13.176
  850   2HD   PRO 105          1HD       PRO 105  11.050 -13.122 -13.122
  851    H    LYS 106           H        LYS 106   7.592 -11.581 -11.581
  852    HA   LYS 106           HA       LYS 106   5.206 -12.681 -12.681
  853   1HB   LYS 106          2HB       LYS 106   5.569 -14.019 -14.019
  854   2HB   LYS 106          1HB       LYS 106   5.648 -12.542 -12.542
  855   1HG   LYS 106          2HG       LYS 106   3.384 -12.150 -12.150
  856   2HG   LYS 106          1HG       LYS 106   3.245 -12.965 -12.965
  857   1HD   LYS 106          2HD       LYS 106   3.487 -15.146 -15.146
  858   2HD   LYS 106          1HD       LYS 106   3.748 -14.374 -14.374
  859   1HE   LYS 106          2HE       LYS 106   1.220 -14.261 -14.261
  860   2HE   LYS 106          1HE       LYS 106   1.430 -15.098 -15.098
  861   1HZ   LYS 106          1HZ       LYS 106   2.118 -12.780 -12.780
  862   2HZ   LYS 106          3HZ       LYS 106   1.312 -12.204 -12.204
  863   3HZ   LYS 106          2HZ       LYS 106   0.467 -13.116 -13.116
  864    H    THR 107           H        THR 107   3.582 -11.099 -11.099
  865    HA   THR 107           HA       THR 107   4.149  -8.469  -8.469
  866    HB   THR 107           HB       THR 107   2.715  -7.796  -7.796
  867    HG1  THR 107           HG1      THR 107   3.055 -10.051 -10.051
  868   1HG2  THR 107          1HG2      THR 107   5.631  -7.884  -7.884
  869   2HG2  THR 107          3HG2      THR 107   5.130  -7.340  -7.340
  870   3HG2  THR 107          2HG2      THR 107   4.563  -6.490  -6.490
  871    H    SER 108           H        SER 108   2.439  -7.284  -7.284
  872    HA   SER 108           HA       SER 108  -0.342  -8.042  -8.042
  873   1HB   SER 108          2HB       SER 108  -0.630  -8.333  -8.333
  874   2HB   SER 108          1HB       SER 108  -0.038  -9.706  -9.706
  875    HG   SER 108           HG       SER 108   1.152  -9.023  -9.023
  876    H    TRP 109           H        TRP 109  -1.480  -6.093  -6.093
  877    HA   TRP 109           HA       TRP 109  -0.299  -4.002  -4.002
  878   1HB   TRP 109          2HB       TRP 109  -0.980  -2.304  -2.304
  879   2HB   TRP 109          1HB       TRP 109   0.421  -3.298  -3.298
  880    HD1  TRP 109           HD1      TRP 109   0.212  -5.045  -5.045
  881    HE1  TRP 109           HE1      TRP 109  -1.545  -5.404  -5.404
  882    HE3  TRP 109           HE3      TRP 109  -3.588  -2.149  -2.149
  883    HZ2  TRP 109           HZ2      TRP 109  -4.206  -4.571  -4.571
  884    HZ3  TRP 109           HZ3      TRP 109  -5.716  -1.951  -1.951
  885    HH2  TRP 109           HH2      TRP 109  -6.033  -3.157  -3.157
  886    H    THR 110           H        THR 110  -1.836  -2.208  -2.208
  887    HA   THR 110           HA       THR 110  -4.683  -3.135  -3.135
  888    HB   THR 110           HB       THR 110  -5.008  -2.469  -2.469
  889    HG1  THR 110           HG1      THR 110  -3.891  -0.643  -0.643
  890   1HG2  THR 110          2HG2      THR 110  -3.094  -4.433  -4.433
  891   2HG2  THR 110          1HG2      THR 110  -2.423  -3.550  -3.550
  892   3HG2  THR 110          3HG2      THR 110  -4.011  -4.303  -4.303
  893    H    MET 111           H        MET 111  -6.134  -1.188  -1.188
  894    HA   MET 111           HA       MET 111  -5.132   1.481   1.481
  895   1HB   MET 111          2HB       MET 111  -6.749   1.786   1.786
  896   2HB   MET 111          1HB       MET 111  -5.376   0.743   0.743
  897   1HG   MET 111          2HG       MET 111  -6.667  -1.134  -1.134
  898   2HG   MET 111          1HG       MET 111  -7.772  -0.614  -0.614
  899   1HE   MET 111          3HE       MET 111  -7.743  -1.731  -1.731
  900   2HE   MET 111          2HE       MET 111  -8.306  -0.488  -0.488
  901   3HE   MET 111          1HE       MET 111  -6.700  -0.360  -0.360
  902    H    GLU 112           H        GLU 112  -6.235   2.775   2.775
  903    HA   GLU 112           HA       GLU 112  -8.983   1.909   1.909
  904   1HB   GLU 112          2HB       GLU 112  -7.251   1.826   1.826
  905   2HB   GLU 112          1HB       GLU 112  -7.010   3.561   3.561
  906   1HG   GLU 112          2HG       GLU 112  -9.096   4.094   4.094
  907   2HG   GLU 112          1HG       GLU 112  -9.791   2.533   2.533
  908    H    LEU 113           H        LEU 113 -10.529   3.586   3.586
  909    HA   LEU 113           HA       LEU 113  -9.911   6.138   6.138
  910   1HB   LEU 113          2HB       LEU 113 -11.824   4.244   4.244
  911   2HB   LEU 113          1HB       LEU 113 -12.737   5.340   5.340
  912    HG   LEU 113           HG       LEU 113 -12.854   5.842   5.842
  913   1HD1  LEU 113          1HD1      LEU 113 -13.220   7.533   7.533
  914   2HD1  LEU 113          3HD1      LEU 113 -11.571   8.073   8.073
  915   3HD1  LEU 113          2HD1      LEU 113 -12.765   8.203   8.203
  916   1HD2  LEU 113          3HD2      LEU 113 -10.342   5.307   5.307
  917   2HD2  LEU 113          2HD2      LEU 113 -10.998   6.684   6.684
  918   3HD2  LEU 113          1HD2      LEU 113 -10.068   6.947   6.947
  919    H    THR 114           H        THR 114 -10.502   8.056   8.056
  920    HA   THR 114           HA       THR 114 -11.104   7.599   7.599
  921    HB   THR 114           HB       THR 114 -10.468   9.967   9.967
  922    HG1  THR 114           HG1      THR 114  -9.923   9.896   9.896
  923   1HG2  THR 114          3HG2      THR 114  -8.608   8.173   8.173
  924   2HG2  THR 114          2HG2      THR 114  -8.078   9.714   9.714
  925   3HG2  THR 114          1HG2      THR 114  -8.659   8.438   8.438
  926    H    ASN 115           H        ASN 115 -12.709   8.994   8.994
  927    HA   ASN 115           HA       ASN 115 -15.258   8.898   8.898
  928   1HB   ASN 115          2HB       ASN 115 -14.189  10.334  10.334
  929   2HB   ASN 115          1HB       ASN 115 -15.857  10.567  10.567
  930   1HD2  ASN 115          2HD2      ASN 115 -16.823   7.637   7.637
  931   2HD2  ASN 115          1HD2      ASN 115 -17.164   9.251   9.251
  932    H    ASP 116           H        ASP 116 -12.752  11.319  11.319
  933    HA   ASP 116           HA       ASP 116 -14.540  13.441  13.441
  934   1HB   ASP 116          2HB       ASP 116 -12.145  13.562  13.562
  935   2HB   ASP 116          1HB       ASP 116 -11.594  13.556  13.556
  936    H    GLY 117           H        GLY 117 -12.469  10.956  10.956
  937   1HA   GLY 117          2HA       GLY 117 -13.328  10.208  10.208
  938   2HA   GLY 117          1HA       GLY 117 -13.223  11.906  11.906
  939    H    GLU 118           H        GLU 118 -10.637  11.661  11.661
  940    HA   GLU 118           HA       GLU 118  -8.699  11.721  11.721
  941   1HB   GLU 118          2HB       GLU 118  -8.216  10.887  10.887
  942   2HB   GLU 118          1HB       GLU 118  -7.036  11.568  11.568
  943   1HG   GLU 118          2HG       GLU 118  -8.625  13.594  13.594
  944   2HG   GLU 118          1HG       GLU 118  -9.401  12.937  12.937
  945    H    LEU 119           H        LEU 119  -6.834  10.028  10.028
  946    HA   LEU 119           HA       LEU 119  -7.860   7.263   7.263
  947   1HB   LEU 119          2HB       LEU 119  -8.499   8.050   8.050
  948   2HB   LEU 119          1HB       LEU 119  -6.792   8.256   8.256
  949    HG   LEU 119           HG       LEU 119  -7.923   5.612   5.612
  950   1HD1  LEU 119          2HD1      LEU 119  -7.987   6.921   6.921
  951   2HD1  LEU 119          1HD1      LEU 119  -7.714   5.181   5.181
  952   3HD1  LEU 119          3HD1      LEU 119  -9.186   5.878   5.878
  953   1HD2  LEU 119          3HD2      LEU 119  -5.368   6.624   6.624
  954   2HD2  LEU 119          2HD2      LEU 119  -5.607   5.413   5.413
  955   3HD2  LEU 119          1HD2      LEU 119  -5.894   4.996   4.996
  956    H    ILE 120           H        ILE 120  -6.288   6.320   6.320
  957    HA   ILE 120           HA       ILE 120  -3.446   7.008   7.008
  958    HB   ILE 120           HB       ILE 120  -4.026   7.406   7.406
  959   1HG1  ILE 120          2HG1      ILE 120  -2.457   4.817   4.817
  960   2HG1  ILE 120          1HG1      ILE 120  -1.784   6.388   6.388
  961   1HG2  ILE 120          3HG2      ILE 120  -5.220   4.677   4.677
  962   2HG2  ILE 120          2HG2      ILE 120  -4.560   5.141   5.141
  963   3HG2  ILE 120          1HG2      ILE 120  -5.848   6.097   6.097
  964   1HD1  ILE 120          1HD1      ILE 120  -2.304   7.229   7.229
  965   2HD1  ILE 120          3HD1      ILE 120  -2.940   5.642   5.642
  966   3HD1  ILE 120          2HD1      ILE 120  -1.227   5.834   5.834
  967    H    LEU 121           H        LEU 121  -1.958   5.207   5.207
  968    HA   LEU 121           HA       LEU 121  -3.280   2.579   2.579
  969   1HB   LEU 121          2HB       LEU 121  -3.042   3.768   3.768
  970   2HB   LEU 121          1HB       LEU 121  -1.315   3.944   3.944
  971    HG   LEU 121           HG       LEU 121  -1.987   1.175   1.175
  972   1HD1  LEU 121          2HD1      LEU 121  -3.961   1.866   1.866
  973   2HD1  LEU 121          1HD1      LEU 121  -2.787   2.208   2.208
  974   3HD1  LEU 121          3HD1      LEU 121  -2.951   0.569   0.569
  975   1HD2  LEU 121          2HD2      LEU 121   0.118   2.544   2.544
  976   2HD2  LEU 121          1HD2      LEU 121  -0.155   0.866   0.866
  977   3HD2  LEU 121          3HD2      LEU 121  -0.614   2.172   2.172
  978    H    THR 122           H        THR 122  -2.114   0.911   0.911
  979    HA   THR 122           HA       THR 122   0.701   1.496   1.496
  980    HB   THR 122           HB       THR 122  -0.308  -0.837  -0.837
  981    HG1  THR 122           HG1      THR 122  -2.063   0.012   0.012
  982   1HG2  THR 122          2HG2      THR 122   0.566   1.937   1.937
  983   2HG2  THR 122          1HG2      THR 122   0.033   0.765   0.765
  984   3HG2  THR 122          3HG2      THR 122   1.433   0.413   0.413
  985    H    MET 123           H        MET 123   2.010  -0.643  -0.643
  986    HA   MET 123           HA       MET 123   1.130  -2.573  -2.573
  987   1HB   MET 123          2HB       MET 123   3.721  -1.018  -1.018
  988   2HB   MET 123          1HB       MET 123   3.116  -2.248  -2.248
  989   1HG   MET 123          2HG       MET 123   1.054  -0.768  -0.768
  990   2HG   MET 123          1HG       MET 123   1.965   0.496   0.496
  991   1HE   MET 123          2HE       MET 123   1.047  -1.406  -1.406
  992   2HE   MET 123          1HE       MET 123   1.826  -0.717  -0.717
  993   3HE   MET 123          3HE       MET 123   2.577  -2.071  -2.071
  994    H    THR 124           H        THR 124   2.713  -4.387  -4.387
  995    HA   THR 124           HA       THR 124   4.565  -4.656  -4.656
  996    HB   THR 124           HB       THR 124   2.557  -6.822  -6.822
  997    HG1  THR 124           HG1      THR 124   1.254  -5.947  -5.947
  998   1HG2  THR 124          1HG2      THR 124   4.703  -7.350  -7.350
  999   2HG2  THR 124          3HG2      THR 124   4.283  -6.171  -6.171
 1000   3HG2  THR 124          2HG2      THR 124   3.291  -7.613  -7.613
 1001    H    ALA 125           H        ALA 125   6.111  -6.305  -6.305
 1002    HA   ALA 125           HA       ALA 125   6.037  -7.915  -7.915
 1003   1HB   ALA 125          1HB       ALA 125   8.082  -5.706  -5.706
 1004   2HB   ALA 125          3HB       ALA 125   8.157  -6.963  -6.963
 1005   3HB   ALA 125          2HB       ALA 125   6.837  -5.794  -5.794
 1006    H    ASP 126           H        ASP 126   6.372  -9.723  -9.723
 1007    HA   ASP 126           HA       ASP 126   7.688 -11.374 -11.374
 1008   1HB   ASP 126          2HB       ASP 126   9.633  -9.625  -9.625
 1009   2HB   ASP 126          1HB       ASP 126  10.136  -9.945  -9.945
 1010    H    ASP 127           H        ASP 127   9.217  -8.544  -8.544
 1011    HA   ASP 127           HA       ASP 127   7.514  -8.900  -8.900
 1012   1HB   ASP 127          2HB       ASP 127   9.512  -9.016  -9.016
 1013   2HB   ASP 127          1HB       ASP 127   9.366 -10.427 -10.427
 1014    H    VAL 128           H        VAL 128   8.124  -6.859  -6.859
 1015    HA   VAL 128           HA       VAL 128   8.864  -4.611  -4.611
 1016    HB   VAL 128           HB       VAL 128   9.701  -3.414  -3.414
 1017   1HG1  VAL 128          3HG1      VAL 128  10.752  -6.109  -6.109
 1018   2HG1  VAL 128          2HG1      VAL 128  11.445  -5.330  -5.330
 1019   3HG1  VAL 128          1HG1      VAL 128  11.517  -4.526  -4.526
 1020   1HG2  VAL 128          3HG2      VAL 128   8.327  -5.625  -5.625
 1021   2HG2  VAL 128          2HG2      VAL 128   8.696  -3.998  -3.998
 1022   3HG2  VAL 128          1HG2      VAL 128   9.925  -5.258  -5.258
 1023    H    VAL 129           H        VAL 129   7.898  -2.495  -2.495
 1024    HA   VAL 129           HA       VAL 129   5.302  -3.007  -3.007
 1025    HB   VAL 129           HB       VAL 129   5.611  -2.317  -2.317
 1026   1HG1  VAL 129          2HG1      VAL 129   3.657  -0.968  -0.968
 1027   2HG1  VAL 129          1HG1      VAL 129   3.084  -1.488  -1.488
 1028   3HG1  VAL 129          3HG1      VAL 129   4.428  -0.352  -0.352
 1029   1HG2  VAL 129          1HG2      VAL 129   3.933  -4.055  -4.055
 1030   2HG2  VAL 129          3HG2      VAL 129   4.764  -4.438  -4.438
 1031   3HG2  VAL 129          2HG2      VAL 129   3.250  -3.533  -3.533
 1032    H    CYS 130           H        CYS 130   5.202  -1.511  -1.511
 1033    HA   CYS 130           HA       CYS 130   6.563   1.108   1.108
 1034   1HB   CYS 130          2HB       CYS 130   6.946  -0.340  -0.340
 1035   2HB   CYS 130          1HB       CYS 130   5.301   0.085   0.085
 1036    HG   CYS 130           HG       CYS 130   6.341   2.127   2.127
 1037    H    THR 131           H        THR 131   5.313   2.770   2.770
 1038    HA   THR 131           HA       THR 131   2.392   2.691   2.691
 1039    HB   THR 131           HB       THR 131   3.813   4.016   4.016
 1040    HG1  THR 131           HG1      THR 131   3.740   1.940   1.940
 1041   1HG2  THR 131          3HG2      THR 131   0.968   3.988   3.988
 1042   2HG2  THR 131          2HG2      THR 131   1.304   4.083   4.083
 1043   3HG2  THR 131          1HG2      THR 131   1.915   5.331   5.331
 1044    H    ARG 132           H        ARG 132   1.427   4.638   4.638
 1045    HA   ARG 132           HA       ARG 132   3.020   7.069   7.069
 1046   1HB   ARG 132          2HB       ARG 132   1.703   5.696   5.696
 1047   2HB   ARG 132          1HB       ARG 132   2.584   7.223   7.223
 1048   1HG   ARG 132          2HG       ARG 132   4.583   5.892   5.892
 1049   2HG   ARG 132          1HG       ARG 132   3.676   4.448   4.448
 1050   1HD   ARG 132          2HD       ARG 132   3.416   5.746   5.746
 1051   2HD   ARG 132          1HD       ARG 132   4.882   6.556   6.556
 1052    HE   ARG 132           HE       ARG 132   5.327   3.797   3.797
 1053   1HH1  ARG 132          2HH1      ARG 132   6.130   6.238   6.238
 1054   2HH1  ARG 132          1HH1      ARG 132   6.315   5.266   5.266
 1055   1HH2  ARG 132          1HH2      ARG 132   4.919   2.435   2.435
 1056   2HH2  ARG 132          2HH2      ARG 132   5.630   3.114   3.114
 1057    H    VAL 133           H        VAL 133   1.592   8.627   8.627
 1058    HA   VAL 133           HA       VAL 133  -1.280   8.049   8.049
 1059    HB   VAL 133           HB       VAL 133   0.207  10.596  10.596
 1060   1HG1  VAL 133          3HG1      VAL 133  -2.577   9.606   9.606
 1061   2HG1  VAL 133          2HG1      VAL 133  -1.829  11.022  11.022
 1062   3HG1  VAL 133          1HG1      VAL 133  -2.167  11.004  11.004
 1063   1HG2  VAL 133          2HG2      VAL 133  -0.649   8.263   8.263
 1064   2HG2  VAL 133          1HG2      VAL 133   1.011   8.722   8.722
 1065   3HG2  VAL 133          3HG2      VAL 133   0.009   9.780   9.780
 1066    H    TYR 134           H        TYR 134  -2.843   8.891   8.891
 1067    HA   TYR 134           HA       TYR 134  -1.834  10.720  10.720
 1068   1HB   TYR 134          2HB       TYR 134  -3.481   8.222   8.222
 1069   2HB   TYR 134          1HB       TYR 134  -3.710   9.516   9.516
 1070    HD1  TYR 134           HD2      TYR 134  -1.890  10.231  10.231
 1071    HD2  TYR 134           HD1      TYR 134  -1.404   6.953   6.953
 1072    HE1  TYR 134           HE2      TYR 134   0.137   9.501   9.501
 1073    HE2  TYR 134           HE1      TYR 134   0.620   6.218   6.218
 1074    HH   TYR 134           HH       TYR 134   1.468   6.532   6.532
 1075    H    VAL 135           H        VAL 135  -2.936  12.565  12.565
 1076    HA   VAL 135           HA       VAL 135  -5.674  12.612  12.612
 1077    HB   VAL 135           HB       VAL 135  -3.442  14.284  14.284
 1078   1HG1  VAL 135          1HG1      VAL 135  -4.092  15.468  15.468
 1079   2HG1  VAL 135          3HG1      VAL 135  -5.594  15.927  15.927
 1080   3HG1  VAL 135          2HG1      VAL 135  -4.048  16.491  16.491
 1081   1HG2  VAL 135          3HG2      VAL 135  -6.342  14.259  14.259
 1082   2HG2  VAL 135          2HG2      VAL 135  -4.931  14.064  14.064
 1083   3HG2  VAL 135          1HG2      VAL 135  -5.382  15.666  15.666
 1084    H    ARG 136           H        ARG 136  -7.401  13.293  13.293
 1085    HA   ARG 136           HA       ARG 136  -7.251  12.845  12.845
 1086   1HB   ARG 136          2HB       ARG 136  -9.194  13.929  13.929
 1087   2HB   ARG 136          1HB       ARG 136  -9.189  14.875  14.875
 1088   1HG   ARG 136          2HG       ARG 136  -9.783  13.079  13.079
 1089   2HG   ARG 136          1HG       ARG 136  -9.109  11.896  11.896
 1090   1HD   ARG 136          2HD       ARG 136 -11.679  13.469  13.469
 1091   2HD   ARG 136          1HD       ARG 136 -11.517  11.725  11.725
 1092    HE   ARG 136           HE       ARG 136 -10.046  12.308  12.308
 1093   1HH1  ARG 136          2HH1      ARG 136 -12.765  10.799  10.799
 1094   2HH1  ARG 136          1HH1      ARG 136 -13.707  11.623  11.623
 1095   1HH2  ARG 136          1HH2      ARG 136 -11.469  14.253  14.253
 1096   2HH2  ARG 136          2HH2      ARG 136 -12.973  13.581  13.581
 1097    H    GLU 137           HN       GLU 137  -6.379  13.838  13.838
 1098    HA   GLU 137           HA       GLU 137  -5.077  15.379  15.379
 1099   1HB   GLU 137          2HB       GLU 137  -7.574  16.043  16.043
 1100   2HB   GLU 137          1HB       GLU 137  -7.086  17.387  17.387
 1101   1HG   GLU 137          2HG       GLU 137  -5.312  17.953  17.953
 1102   2HG   GLU 137          1HG       GLU 137  -5.982  16.703  16.703

  Start of MODEL   30
    1   1H    PRO   1          1H        PRO   1  16.313   6.797   6.797
    2   2H    PRO   1          2H        PRO   1  15.861   5.871   5.871
    3    HA   PRO   1           HA       PRO   1  16.547   4.011   4.011
    4   1HB   PRO   1          2HB       PRO   1  19.193   4.665   4.665
    5   2HB   PRO   1          1HB       PRO   1  18.727   3.722   3.722
    6   1HG   PRO   1          2HG       PRO   1  19.797   6.380   6.380
    7   2HG   PRO   1          1HG       PRO   1  19.342   5.427   5.427
    8   1HD   PRO   1          1HD       PRO   1  17.983   7.692   7.692
    9   2HD   PRO   1          2HD       PRO   1  17.522   6.720   6.720
   10    H    ASN   2           H        ASN   2  15.148   5.816   5.816
   11    HA   ASN   2           HA       ASN   2  15.836   4.745   4.745
   12   1HB   ASN   2          2HB       ASN   2  16.632   7.519   7.519
   13   2HB   ASN   2          1HB       ASN   2  15.918   7.294   7.294
   14   1HD2  ASN   2          2HD2      ASN   2  19.712   6.590   6.590
   15   2HD2  ASN   2          1HD2      ASN   2  18.824   7.817   7.817
   16    H    PHE   3           H        PHE   3  13.921   4.435   4.435
   17    HA   PHE   3           HA       PHE   3  11.563   6.002   6.002
   18   1HB   PHE   3          2HB       PHE   3  11.827   3.465   3.465
   19   2HB   PHE   3          1HB       PHE   3  10.303   4.228   4.228
   20    HD1  PHE   3           HD1      PHE   3  13.446   3.151   3.151
   21    HD2  PHE   3           HD2      PHE   3   9.150   3.294   3.294
   22    HE1  PHE   3           HE1      PHE   3  13.402   1.909   1.909
   23    HE2  PHE   3           HE2      PHE   3   9.117   2.045   2.045
   24    HZ   PHE   3           HZ       PHE   3  11.242   1.343   1.343
   25    H    SER   4           H        SER   4  13.839   5.925   5.925
   26    HA   SER   4           HA       SER   4  12.153   6.461   6.461
   27   1HB   SER   4          2HB       SER   4  14.166   7.006   7.006
   28   2HB   SER   4          1HB       SER   4  14.572   5.709   5.709
   29    HG   SER   4           HG       SER   4  15.381   8.339   8.339
   30    H    GLY   5           H        GLY   5  10.943   8.192   8.192
   31   1HA   GLY   5          2HA       GLY   5  11.696  10.821  10.821
   32   2HA   GLY   5          1HA       GLY   5  11.303  10.693  10.693
   33    H    ASN   6           H        ASN   6   9.551  12.310  12.310
   34    HA   ASN   6           HA       ASN   6   7.264  10.757  10.757
   35   1HB   ASN   6          2HB       ASN   6   7.865  13.713  13.713
   36   2HB   ASN   6          1HB       ASN   6   6.211  13.145  13.145
   37   1HD2  ASN   6          2HD2      ASN   6   7.140  11.625  11.625
   38   2HD2  ASN   6          1HD2      ASN   6   6.406  11.112  11.112
   39    H    TRP   7           H        TRP   7   5.110  11.434  11.434
   40    HA   TRP   7           HA       TRP   7   5.618  11.839  11.839
   41   1HB   TRP   7          2HB       TRP   7   4.472   9.300   9.300
   42   2HB   TRP   7          1HB       TRP   7   4.421   9.701   9.701
   43    HD1  TRP   7           HD1      TRP   7   6.662   8.315   8.315
   44    HE1  TRP   7           HE1      TRP   7   9.027   7.886   7.886
   45    HE3  TRP   7           HE3      TRP   7   6.189  10.724  10.724
   46    HZ2  TRP   7           HZ2      TRP   7  10.513   8.533   8.533
   47    HZ3  TRP   7           HZ3      TRP   7   8.084  10.847  10.847
   48    HH2  TRP   7           HH2      TRP   7  10.230   9.751   9.751
   49    H    LYS   8           H        LYS   8   4.091  13.086  13.086
   50    HA   LYS   8           HA       LYS   8   1.359  12.987  12.987
   51   1HB   LYS   8          2HB       LYS   8   3.013  15.287  15.287
   52   2HB   LYS   8          1HB       LYS   8   1.256  15.370  15.370
   53   1HG   LYS   8          2HG       LYS   8   1.180  14.742  14.742
   54   2HG   LYS   8          1HG       LYS   8   2.914  15.064  15.064
   55   1HD   LYS   8          2HD       LYS   8   1.888  17.112  17.112
   56   2HD   LYS   8          1HD       LYS   8   2.353  17.345  17.345
   57   1HE   LYS   8          2HE       LYS   8   0.177  17.309  17.309
   58   2HE   LYS   8          1HE       LYS   8  -0.355  16.212  16.212
   59   1HZ   LYS   8          3HZ       LYS   8   0.019  18.122  18.122
   60   2HZ   LYS   8          2HZ       LYS   8   0.170  19.119  19.119
   61   3HZ   LYS   8          1HZ       LYS   8  -1.285  18.295  18.295
   62    H    ILE   9           H        ILE   9   0.000  12.018  12.018
   63    HA   ILE   9           HA       ILE   9   0.667  11.298  11.298
   64    HB   ILE   9           HB       ILE   9  -0.988  10.096  10.096
   65   1HG1  ILE   9          2HG1      ILE   9  -2.275  11.331  11.331
   66   2HG1  ILE   9          1HG1      ILE   9  -1.108  10.010  10.010
   67   1HG2  ILE   9          1HG2      ILE   9  -1.924  12.528  12.528
   68   2HG2  ILE   9          3HG2      ILE   9  -3.119  12.102  12.102
   69   3HG2  ILE   9          2HG2      ILE   9  -2.858  11.041  11.041
   70   1HD1  ILE   9          3HD1      ILE   9  -2.982   9.134   9.134
   71   2HD1  ILE   9          2HD1      ILE   9  -3.966   9.946   9.946
   72   3HD1  ILE   9          1HD1      ILE   9  -2.892   8.631   8.631
   73    H    ILE  10           H        ILE  10  -0.135  12.018  12.018
   74    HA   ILE  10           HA       ILE  10  -1.197  14.808  14.808
   75    HB   ILE  10           HB       ILE  10   0.139  15.213  15.213
   76   1HG1  ILE  10          2HG1      ILE  10   2.076  13.270  13.270
   77   2HG1  ILE  10          1HG1      ILE  10   0.651  12.311  12.311
   78   1HG2  ILE  10          3HG2      ILE  10   1.029  15.606  15.606
   79   2HG2  ILE  10          2HG2      ILE  10   1.938  14.107  14.107
   80   3HG2  ILE  10          1HG2      ILE  10   2.248  15.472  15.472
   81   1HD1  ILE  10          1HD1      ILE  10  -0.509  13.638  13.638
   82   2HD1  ILE  10          3HD1      ILE  10   1.130  14.056  14.056
   83   3HD1  ILE  10          2HD1      ILE  10   0.628  12.366  12.366
   84    H    ARG  11           H        ARG  11  -1.191  11.588  11.588
   85    HA   ARG  11           HA       ARG  11  -3.783  12.256  12.256
   86   1HB   ARG  11          2HB       ARG  11  -1.263  11.485  11.485
   87   2HB   ARG  11          1HB       ARG  11  -2.711  10.628  10.628
   88   1HG   ARG  11          2HG       ARG  11  -2.865  13.599  13.599
   89   2HG   ARG  11          1HG       ARG  11  -2.036  12.956  12.956
   90   1HD   ARG  11          2HD       ARG  11  -4.837  12.158  12.158
   91   2HD   ARG  11          1HD       ARG  11  -4.477  13.367  13.367
   92    HE   ARG  11           HE       ARG  11  -3.108  10.916  10.916
   93   1HH1  ARG  11          1HH2      ARG  11  -5.156  12.910  12.910
   94   2HH1  ARG  11          2HH2      ARG  11  -6.270  11.728  11.728
   95   1HH2  ARG  11          2HH1      ARG  11  -5.001   9.153   9.153
   96   2HH2  ARG  11          1HH1      ARG  11  -6.183   9.601   9.601
   97    H    SER  12           H        SER  12  -4.790  10.090  10.090
   98    HA   SER  12           HA       SER  12  -3.942   7.573   7.573
   99   1HB   SER  12          2HB       SER  12  -4.312   8.396   8.396
  100   2HB   SER  12          1HB       SER  12  -5.835   9.148   9.148
  101    HG   SER  12           HG       SER  12  -6.688   7.322   7.322
  102    H    GLU  13           H        GLU  13  -5.344   5.940   5.940
  103    HA   GLU  13           HA       GLU  13  -7.978   6.734   6.734
  104   1HB   GLU  13          2HB       GLU  13  -7.432   5.354   5.354
  105   2HB   GLU  13          1HB       GLU  13  -6.565   6.884   6.884
  106   1HG   GLU  13          2HG       GLU  13  -5.220   4.586   4.586
  107   2HG   GLU  13          1HG       GLU  13  -5.356   4.474   4.474
  108    H    ASN  14           H        ASN  14  -9.321   4.796   4.796
  109    HA   ASN  14           HA       ASN  14 -10.264   2.745   2.745
  110   1HB   ASN  14          2HB       ASN  14  -7.497   1.854   1.854
  111   2HB   ASN  14          1HB       ASN  14  -8.836   0.857   0.857
  112   1HD2  ASN  14          2HD2      ASN  14  -6.300   2.143   2.143
  113   2HD2  ASN  14          1HD2      ASN  14  -5.967   2.123   2.123
  114    H    PHE  15           H        PHE  15  -9.952   4.871   4.871
  115    HA   PHE  15           HA       PHE  15  -9.205   3.646   3.646
  116   1HB   PHE  15          2HB       PHE  15  -9.219   6.151   6.151
  117   2HB   PHE  15          1HB       PHE  15 -10.965   6.068   6.068
  118    HD1  PHE  15           HD2      PHE  15 -10.114   3.712   3.712
  119    HD2  PHE  15           HD1      PHE  15  -9.748   7.940   7.940
  120    HE1  PHE  15           HE2      PHE  15  -9.990   4.049   4.049
  121    HE2  PHE  15           HE1      PHE  15  -9.609   8.267   8.267
  122    HZ   PHE  15           HZ       PHE  15  -9.732   6.307   6.307
  123    H    GLU  16           H        GLU  16 -12.401   4.832   4.832
  124    HA   GLU  16           HA       GLU  16 -13.899   3.579   3.579
  125   1HB   GLU  16          2HB       GLU  16 -14.641   5.346   5.346
  126   2HB   GLU  16          1HB       GLU  16 -14.945   3.984   3.984
  127   1HG   GLU  16          2HG       GLU  16 -16.514   3.011   3.011
  128   2HG   GLU  16          1HG       GLU  16 -16.107   4.212   4.212
  129    H    GLU  17           H        GLU  17 -12.829   2.296   2.296
  130    HA   GLU  17           HA       GLU  17 -14.472  -0.044  -0.044
  131   1HB   GLU  17          2HB       GLU  17 -13.028  -0.957  -0.957
  132   2HB   GLU  17          1HB       GLU  17 -13.481   0.710   0.710
  133   1HG   GLU  17          2HG       GLU  17 -11.278   1.087   1.087
  134   2HG   GLU  17          1HG       GLU  17 -11.172   1.020   1.020
  135    H    LEU  18           H        LEU  18 -11.336   0.751   0.751
  136    HA   LEU  18           HA       LEU  18 -10.690  -2.000  -2.000
  137   1HB   LEU  18          2HB       LEU  18  -8.983  -0.123  -0.123
  138   2HB   LEU  18          1HB       LEU  18  -9.558   0.514   0.514
  139    HG   LEU  18           HG       LEU  18  -9.107  -1.761  -1.761
  140   1HD1  LEU  18          1HD1      LEU  18  -8.144  -2.171  -2.171
  141   2HD1  LEU  18          3HD1      LEU  18  -7.259  -2.956  -2.956
  142   3HD1  LEU  18          2HD1      LEU  18  -8.974  -3.294  -3.294
  143   1HD2  LEU  18          3HD2      LEU  18  -7.233   0.319   0.319
  144   2HD2  LEU  18          2HD2      LEU  18  -7.282  -0.644  -0.644
  145   3HD2  LEU  18          1HD2      LEU  18  -6.414  -1.241  -1.241
  146    H    LEU  19           H        LEU  19 -12.576   0.551   0.551
  147    HA   LEU  19           HA       LEU  19 -12.510  -0.748  -0.748
  148   1HB   LEU  19          2HB       LEU  19 -14.310   1.551   1.551
  149   2HB   LEU  19          1HB       LEU  19 -13.676   1.145   1.145
  150    HG   LEU  19           HG       LEU  19 -12.220   2.393   2.393
  151   1HD1  LEU  19          1HD1      LEU  19 -13.506   3.462   3.462
  152   2HD1  LEU  19          3HD1      LEU  19 -11.801   3.494   3.494
  153   3HD1  LEU  19          2HD1      LEU  19 -12.339   4.284   4.284
  154   1HD2  LEU  19          2HD2      LEU  19 -11.108   0.568   0.568
  155   2HD2  LEU  19          1HD2      LEU  19 -10.309   1.345   1.345
  156   3HD2  LEU  19          3HD2      LEU  19 -10.405   2.169   2.169
  157    H    LYS  20           H        LYS  20 -14.337  -0.891  -0.891
  158    HA   LYS  20           HA       LYS  20 -16.768  -1.911  -1.911
  159   1HB   LYS  20          2HB       LYS  20 -16.146  -1.991  -1.991
  160   2HB   LYS  20          1HB       LYS  20 -17.728  -2.039  -2.039
  161   1HG   LYS  20          2HG       LYS  20 -16.329   0.354   0.354
  162   2HG   LYS  20          1HG       LYS  20 -16.327   0.244   0.244
  163   1HD   LYS  20          2HD       LYS  20 -18.783   0.016   0.016
  164   2HD   LYS  20          1HD       LYS  20 -18.322   1.446   1.446
  165   1HE   LYS  20          2HE       LYS  20 -18.412  -1.027  -1.027
  166   2HE   LYS  20          1HE       LYS  20 -19.972  -0.537  -0.537
  167   1HZ   LYS  20          3HZ       LYS  20 -19.287   1.779   1.779
  168   2HZ   LYS  20          2HZ       LYS  20 -18.192   0.930   0.930
  169   3HZ   LYS  20          1HZ       LYS  20 -19.860   0.637   0.637
  170    H    VAL  21           H        VAL  21 -13.891  -3.027  -3.027
  171    HA   VAL  21           HA       VAL  21 -14.733  -5.797  -5.797
  172    HB   VAL  21           HB       VAL  21 -12.975  -4.744  -4.744
  173   1HG1  VAL  21          1HG1      VAL  21 -11.951  -3.337  -3.337
  174   2HG1  VAL  21          3HG1      VAL  21 -11.292  -4.774  -4.774
  175   3HG1  VAL  21          2HG1      VAL  21 -10.757  -4.311  -4.311
  176   1HG2  VAL  21          2HG2      VAL  21 -13.089  -7.282  -7.282
  177   2HG2  VAL  21          1HG2      VAL  21 -11.799  -6.719  -6.719
  178   3HG2  VAL  21          3HG2      VAL  21 -11.517  -6.851  -6.851
  179    H    LEU  22           H        LEU  22 -12.878  -3.848  -3.848
  180    HA   LEU  22           HA       LEU  22 -12.033  -5.944  -5.944
  181   1HB   LEU  22          2HB       LEU  22 -12.079  -2.988  -2.988
  182   2HB   LEU  22          1HB       LEU  22 -12.155  -3.651  -3.651
  183    HG   LEU  22           HG       LEU  22 -10.090  -4.873  -4.873
  184   1HD1  LEU  22          1HD1      LEU  22 -10.517  -5.402  -5.402
  185   2HD1  LEU  22          3HD1      LEU  22 -10.048  -3.750  -3.750
  186   3HD1  LEU  22          2HD1      LEU  22  -8.877  -4.850  -4.850
  187   1HD2  LEU  22          2HD2      LEU  22 -10.249  -1.963  -1.963
  188   2HD2  LEU  22          1HD2      LEU  22  -9.405  -2.790  -2.790
  189   3HD2  LEU  22          3HD2      LEU  22  -8.698  -2.743  -2.743
  190    H    GLY  23           H        GLY  23 -14.691  -3.619  -3.619
  191   1HA   GLY  23          2HA       GLY  23 -15.904  -5.015  -5.015
  192   2HA   GLY  23          1HA       GLY  23 -16.345  -3.406  -3.406
  193    H    VAL  24           H        VAL  24 -18.553  -4.236  -4.236
  194    HA   VAL  24           HA       VAL  24 -19.407  -5.442  -5.442
  195    HB   VAL  24           HB       VAL  24 -20.971  -6.982  -6.982
  196   1HG1  VAL  24          3HG1      VAL  24 -18.785  -7.737  -7.737
  197   2HG1  VAL  24          2HG1      VAL  24 -18.028  -7.392  -7.392
  198   3HG1  VAL  24          1HG1      VAL  24 -19.256  -8.652  -8.652
  199   1HG2  VAL  24          3HG2      VAL  24 -19.324  -5.994  -5.994
  200   2HG2  VAL  24          2HG2      VAL  24 -21.077  -5.930  -5.930
  201   3HG2  VAL  24          1HG2      VAL  24 -20.270  -7.481  -7.481
  202    H    ASN  25           H        ASN  25 -20.309  -3.794  -3.794
  203    HA   ASN  25           HA       ASN  25 -23.019  -3.196  -3.196
  204   1HB   ASN  25          2HB       ASN  25 -21.492  -2.847  -2.847
  205   2HB   ASN  25          1HB       ASN  25 -21.393  -1.220  -1.220
  206   1HD2  ASN  25          2HD2      ASN  25 -24.582  -0.366  -0.366
  207   2HD2  ASN  25          1HD2      ASN  25 -23.051   0.146   0.146
  208    H    VAL  26           H        VAL  26 -22.792  -0.206  -0.206
  209    HA   VAL  26           HA       VAL  26 -21.685   0.471   0.471
  210    HB   VAL  26           HB       VAL  26 -23.657   2.118   2.118
  211   1HG1  VAL  26          2HG1      VAL  26 -23.872  -0.871  -0.871
  212   2HG1  VAL  26          1HG1      VAL  26 -25.230   0.169   0.169
  213   3HG1  VAL  26          3HG1      VAL  26 -23.688   0.341   0.341
  214   1HG2  VAL  26          3HG2      VAL  26 -24.622   0.280   0.280
  215   2HG2  VAL  26          2HG2      VAL  26 -24.539   2.041   2.041
  216   3HG2  VAL  26          1HG2      VAL  26 -25.720   1.227   1.227
  217    H    MET  27           H        MET  27 -22.861   1.772   1.772
  218    HA   MET  27           HA       MET  27 -21.491   4.312   4.312
  219   1HB   MET  27          2HB       MET  27 -23.483   3.667   3.667
  220   2HB   MET  27          1HB       MET  27 -22.205   3.138   3.138
  221   1HG   MET  27          2HG       MET  27 -21.215   5.334   5.334
  222   2HG   MET  27          1HG       MET  27 -22.277   5.887   5.887
  223   1HE   MET  27          2HE       MET  27 -24.317   6.809   6.809
  224   2HE   MET  27          1HE       MET  27 -25.095   7.398   7.398
  225   3HE   MET  27          3HE       MET  27 -23.469   7.950   7.950
  226    H    LEU  28           H        LEU  28 -20.648   1.150   1.150
  227    HA   LEU  28           HA       LEU  28 -18.404   1.723   1.723
  228   1HB   LEU  28          2HB       LEU  28 -19.595  -0.543  -0.543
  229   2HB   LEU  28          1HB       LEU  28 -17.840  -0.649  -0.649
  230    HG   LEU  28           HG       LEU  28 -18.814  -1.733  -1.733
  231   1HD1  LEU  28          3HD1      LEU  28 -16.640  -0.253  -0.253
  232   2HD1  LEU  28          2HD1      LEU  28 -17.609   0.814   0.814
  233   3HD1  LEU  28          1HD1      LEU  28 -17.304  -0.848  -0.848
  234   1HD2  LEU  28          2HD2      LEU  28 -20.867  -0.319  -0.319
  235   2HD2  LEU  28          1HD2      LEU  28 -20.058  -0.435  -0.435
  236   3HD2  LEU  28          3HD2      LEU  28 -19.884   1.023   1.023
  237    H    ARG  29           H        ARG  29 -18.762   2.048   2.048
  238    HA   ARG  29           HA       ARG  29 -15.827   2.000   2.000
  239   1HB   ARG  29          2HB       ARG  29 -18.089   2.374   2.374
  240   2HB   ARG  29          1HB       ARG  29 -16.383   2.193   2.193
  241   1HG   ARG  29          2HG       ARG  29 -16.780  -0.032  -0.032
  242   2HG   ARG  29          1HG       ARG  29 -16.878   0.007   0.007
  243   1HD   ARG  29          2HD       ARG  29 -19.306   0.446   0.446
  244   2HD   ARG  29          1HD       ARG  29 -19.205   0.393   0.393
  245    HE   ARG  29           HE       ARG  29 -18.787  -1.949  -1.949
  246   1HH1  ARG  29          2HH1      ARG  29 -20.555  -0.802  -0.802
  247   2HH1  ARG  29          1HH1      ARG  29 -20.320  -2.186  -2.186
  248   1HH2  ARG  29          1HH2      ARG  29 -17.983  -3.655  -3.655
  249   2HH2  ARG  29          2HH2      ARG  29 -18.866  -3.800  -3.800
  250    H    LYS  30           H        LYS  30 -18.589   4.208   4.208
  251    HA   LYS  30           HA       LYS  30 -17.050   6.451   6.451
  252   1HB   LYS  30          2HB       LYS  30 -19.704   5.947   5.947
  253   2HB   LYS  30          1HB       LYS  30 -19.508   6.985   6.985
  254   1HG   LYS  30          2HG       LYS  30 -18.099   7.947   7.947
  255   2HG   LYS  30          1HG       LYS  30 -19.854   7.898   7.898
  256   1HD   LYS  30          2HD       LYS  30 -19.835   9.043   9.043
  257   2HD   LYS  30          1HD       LYS  30 -18.178   9.474   9.474
  258   1HE   LYS  30          2HE       LYS  30 -20.227   9.951   9.951
  259   2HE   LYS  30          1HE       LYS  30 -20.310  10.995  10.995
  260   1HZ   LYS  30          1HZ       LYS  30 -17.897  10.534  10.534
  261   2HZ   LYS  30          3HZ       LYS  30 -18.868  11.923  11.923
  262   3HZ   LYS  30          2HZ       LYS  30 -17.981  11.543  11.543
  263    H    ILE  31           H        ILE  31 -17.508   5.082   5.082
  264    HA   ILE  31           HA       ILE  31 -16.806   7.535   7.535
  265    HB   ILE  31           HB       ILE  31 -16.861   4.643   4.643
  266   1HG1  ILE  31          2HG1      ILE  31 -18.833   6.815   6.815
  267   2HG1  ILE  31          1HG1      ILE  31 -19.024   5.875   5.875
  268   1HG2  ILE  31          3HG2      ILE  31 -16.453   7.276   7.276
  269   2HG2  ILE  31          2HG2      ILE  31 -17.026   5.837   5.837
  270   3HG2  ILE  31          1HG2      ILE  31 -15.442   5.833   5.833
  271   1HD1  ILE  31          2HD1      ILE  31 -18.657   4.582   4.582
  272   2HD1  ILE  31          1HD1      ILE  31 -20.246   4.970   4.970
  273   3HD1  ILE  31          3HD1      ILE  31 -19.202   3.823   3.823
  274    H    ALA  32           H        ALA  32 -15.126   4.795   4.795
  275    HA   ALA  32           HA       ALA  32 -12.584   5.438   5.438
  276   1HB   ALA  32          1HB       ALA  32 -13.412   3.472   3.472
  277   2HB   ALA  32          3HB       ALA  32 -11.723   3.708   3.708
  278   3HB   ALA  32          2HB       ALA  32 -12.878   3.129   3.129
  279    H    VAL  33           H        VAL  33 -14.283   6.255   6.255
  280    HA   VAL  33           HA       VAL  33 -11.981   7.248   7.248
  281    HB   VAL  33           HB       VAL  33 -14.891   7.984   7.984
  282   1HG1  VAL  33          1HG1      VAL  33 -12.428   7.915   7.915
  283   2HG1  VAL  33          3HG1      VAL  33 -14.061   8.076   8.076
  284   3HG1  VAL  33          2HG1      VAL  33 -13.412   9.316   9.316
  285   1HG2  VAL  33          1HG2      VAL  33 -13.974   5.379   5.379
  286   2HG2  VAL  33          3HG2      VAL  33 -15.362   5.939   5.939
  287   3HG2  VAL  33          2HG2      VAL  33 -13.784   5.806   5.806
  288    H    ALA  34           H        ALA  34 -14.487   8.539   8.539
  289    HA   ALA  34           HA       ALA  34 -13.600  11.301  11.301
  290   1HB   ALA  34          1HB       ALA  34 -15.695   9.837   9.837
  291   2HB   ALA  34          3HB       ALA  34 -15.113  11.340  11.340
  292   3HB   ALA  34          2HB       ALA  34 -15.816  11.348  11.348
  293    H    ALA  35           H        ALA  35 -13.054   8.593   8.593
  294    HA   ALA  35           HA       ALA  35 -11.764   9.999   9.999
  295   1HB   ALA  35          3HB       ALA  35 -11.900   7.171   7.171
  296   2HB   ALA  35          2HB       ALA  35 -10.602   7.597   7.597
  297   3HB   ALA  35          1HB       ALA  35 -12.285   7.839   7.839
  298    H    ALA  36           H        ALA  36 -10.581   8.541   8.541
  299    HA   ALA  36           HA       ALA  36  -7.797   8.855   8.855
  300   1HB   ALA  36          1HB       ALA  36  -9.521   8.237   8.237
  301   2HB   ALA  36          3HB       ALA  36  -8.235   9.329   9.329
  302   3HB   ALA  36          2HB       ALA  36  -7.834   7.791   7.791
  303    H    SER  37           H        SER  37  -9.727  10.927  10.927
  304    HA   SER  37           HA       SER  37  -9.451  13.198  13.198
  305   1HB   SER  37          2HB       SER  37  -9.642  14.687  14.687
  306   2HB   SER  37          1HB       SER  37 -10.483  13.217  13.217
  307    HG   SER  37           HG       SER  37  -9.105  13.826  13.826
  308    H    LYS  38           H        LYS  38  -7.196  11.866  11.866
  309    HA   LYS  38           HA       LYS  38  -4.923  12.190  12.190
  310   1HB   LYS  38          2HB       LYS  38  -5.267  14.912  14.912
  311   2HB   LYS  38          1HB       LYS  38  -3.985  14.421  14.421
  312   1HG   LYS  38          2HG       LYS  38  -6.806  14.139  14.139
  313   2HG   LYS  38          1HG       LYS  38  -6.123  15.762  15.762
  314   1HD   LYS  38          2HD       LYS  38  -4.151  14.922  14.922
  315   2HD   LYS  38          1HD       LYS  38  -5.003  13.390  13.390
  316   1HE   LYS  38          2HE       LYS  38  -6.745  14.399  14.399
  317   2HE   LYS  38          1HE       LYS  38  -6.260  16.024  16.024
  318   1HZ   LYS  38          3HZ       LYS  38  -4.073  15.456  15.456
  319   2HZ   LYS  38          2HZ       LYS  38  -4.930  14.185  14.185
  320   3HZ   LYS  38          1HZ       LYS  38  -5.416  15.795  15.795
  321    HA   PRO  39           HA       PRO  39  -4.222  11.175  11.175
  322   1HB   PRO  39          2HB       PRO  39  -3.424   8.578   8.578
  323   2HB   PRO  39          1HB       PRO  39  -5.096   9.065   9.065
  324   1HG   PRO  39          2HG       PRO  39  -3.830   8.263   8.263
  325   2HG   PRO  39          1HG       PRO  39  -5.520   8.122   8.122
  326   1HD   PRO  39          2HD       PRO  39  -4.510  10.089  10.089
  327   2HD   PRO  39          1HD       PRO  39  -6.070  10.160  10.160
  328    H    ALA  40           H        ALA  40  -2.129  10.715  10.715
  329    HA   ALA  40           HA       ALA  40   0.158  11.348  11.348
  330   1HB   ALA  40          3HB       ALA  40  -0.276  12.889  12.889
  331   2HB   ALA  40          2HB       ALA  40  -0.046  11.540  11.540
  332   3HB   ALA  40          1HB       ALA  40   1.299  12.105  12.105
  333    H    VAL  41           H        VAL  41   2.290  10.372  10.372
  334    HA   VAL  41           HA       VAL  41   2.018   7.722   7.722
  335    HB   VAL  41           HB       VAL  41   2.875   8.147   8.147
  336   1HG1  VAL  41          1HG1      VAL  41   3.212   5.712   5.712
  337   2HG1  VAL  41          3HG1      VAL  41   3.392   5.693   5.693
  338   3HG1  VAL  41          2HG1      VAL  41   4.495   6.648   6.648
  339   1HG2  VAL  41          2HG2      VAL  41   0.728   6.501   6.501
  340   2HG2  VAL  41          1HG2      VAL  41   0.504   7.838   7.838
  341   3HG2  VAL  41          3HG2      VAL  41   1.178   6.310   6.310
  342    H    GLU  42           H        GLU  42   4.243   6.789   6.789
  343    HA   GLU  42           HA       GLU  42   6.503   8.666   8.666
  344   1HB   GLU  42          2HB       GLU  42   5.479   9.365   9.365
  345   2HB   GLU  42          1HB       GLU  42   5.594   7.714   7.714
  346   1HG   GLU  42          2HG       GLU  42   8.076   7.829   7.829
  347   2HG   GLU  42          1HG       GLU  42   7.907   9.519   9.519
  348    H    ILE  43           H        ILE  43   7.915   7.290   7.290
  349    HA   ILE  43           HA       ILE  43   7.976   4.454   4.454
  350    HB   ILE  43           HB       ILE  43   9.033   5.905   5.905
  351   1HG1  ILE  43          2HG1      ILE  43   7.540   3.692   3.692
  352   2HG1  ILE  43          1HG1      ILE  43   6.705   4.241   4.241
  353   1HG2  ILE  43          3HG2      ILE  43   9.682   3.143   3.143
  354   2HG2  ILE  43          2HG2      ILE  43   9.614   3.464   3.464
  355   3HG2  ILE  43          1HG2      ILE  43  10.756   4.344   4.344
  356   1HD1  ILE  43          3HD1      ILE  43   7.507   6.187   6.187
  357   2HD1  ILE  43          2HD1      ILE  43   6.001   5.276   5.276
  358   3HD1  ILE  43          1HD1      ILE  43   6.272   6.370   6.370
  359    H    LYS  44           H        LYS  44   9.753   3.529   3.529
  360    HA   LYS  44           HA       LYS  44  12.110   5.289   5.289
  361   1HB   LYS  44          2HB       LYS  44  11.813   3.013   3.013
  362   2HB   LYS  44          1HB       LYS  44  12.111   4.707   4.707
  363   1HG   LYS  44          2HG       LYS  44   9.736   5.213   5.213
  364   2HG   LYS  44          1HG       LYS  44   9.378   3.607   3.607
  365   1HD   LYS  44          2HD       LYS  44   9.631   2.609   2.609
  366   2HD   LYS  44          1HD       LYS  44  10.860   3.760   3.760
  367   1HE   LYS  44          2HE       LYS  44   8.021   4.664   4.664
  368   2HE   LYS  44          1HE       LYS  44   8.494   3.880   3.880
  369   1HZ   LYS  44          2HZ       LYS  44  10.058   6.127   6.127
  370   2HZ   LYS  44          1HZ       LYS  44   8.677   6.410   6.410
  371   3HZ   LYS  44          3HZ       LYS  44   9.992   5.559   5.559
  372    H    GLN  45           H        GLN  45  13.727   4.550   4.550
  373    HA   GLN  45           HA       GLN  45  13.731   1.667   1.667
  374   1HB   GLN  45          2HB       GLN  45  13.861   3.308   3.308
  375   2HB   GLN  45          1HB       GLN  45  15.352   3.956   3.956
  376   1HG   GLN  45          2HG       GLN  45  16.462   1.793   1.793
  377   2HG   GLN  45          1HG       GLN  45  14.969   1.083   1.083
  378   1HE2  GLN  45          2HE2      GLN  45  16.344   1.873   1.873
  379   2HE2  GLN  45          1HE2      GLN  45  16.061   0.623   0.623
  380    H    GLU  46           H        GLU  46  15.022   0.308   0.308
  381    HA   GLU  46           HA       GLU  46  17.605   1.353   1.353
  382   1HB   GLU  46          2HB       GLU  46  15.637  -0.621  -0.621
  383   2HB   GLU  46          1HB       GLU  46  17.322  -0.572  -0.572
  384   1HG   GLU  46          2HG       GLU  46  15.845   2.019   2.019
  385   2HG   GLU  46          1HG       GLU  46  15.435   0.902   0.902
  386    H    GLY  47           H        GLY  47  17.701   0.534   0.534
  387   1HA   GLY  47          2HA       GLY  47  19.202  -0.906  -0.906
  388   2HA   GLY  47          1HA       GLY  47  19.152  -2.046  -2.046
  389    H    ASP  48           H        ASP  48  18.222  -3.922  -3.922
  390    HA   ASP  48           HA       ASP  48  16.266  -3.958  -3.958
  391   1HB   ASP  48          2HB       ASP  48  16.041  -6.410  -6.410
  392   2HB   ASP  48          1HB       ASP  48  17.614  -5.914  -5.914
  393    H    THR  49           H        THR  49  15.937  -3.083  -3.083
  394    HA   THR  49           HA       THR  49  13.305  -4.379  -4.379
  395    HB   THR  49           HB       THR  49  15.177  -2.856  -2.856
  396    HG1  THR  49           HG1      THR  49  15.639  -4.853  -4.853
  397   1HG2  THR  49          3HG2      THR  49  12.305  -3.621  -3.621
  398   2HG2  THR  49          2HG2      THR  49  13.478  -3.094  -3.094
  399   3HG2  THR  49          1HG2      THR  49  12.961  -1.985  -1.985
  400    H    PHE  50           H        PHE  50  11.410  -3.196  -3.196
  401    HA   PHE  50           HA       PHE  50  11.652  -0.256  -0.256
  402   1HB   PHE  50          2HB       PHE  50  10.047  -2.159  -2.159
  403   2HB   PHE  50          1HB       PHE  50   9.938  -0.398  -0.398
  404    HD1  PHE  50           HD2      PHE  50  11.836   0.952   0.952
  405    HD2  PHE  50           HD1      PHE  50  12.020  -3.331  -3.331
  406    HE1  PHE  50           HE2      PHE  50  13.876   1.005   1.005
  407    HE2  PHE  50           HE1      PHE  50  14.062  -3.281  -3.281
  408    HZ   PHE  50           HZ       PHE  50  14.998  -1.117  -1.117
  409    H    TYR  51           H        TYR  51  10.475   0.668   0.668
  410    HA   TYR  51           HA       TYR  51   8.108  -0.727  -0.727
  411   1HB   TYR  51          2HB       TYR  51   9.955   0.012   0.012
  412   2HB   TYR  51          1HB       TYR  51   9.664   1.671   1.671
  413    HD1  TYR  51           HD1      TYR  51   7.213   2.520   2.520
  414    HD2  TYR  51           HD2      TYR  51   8.790  -0.856  -0.856
  415    HE1  TYR  51           HE1      TYR  51   5.434   2.742   2.742
  416    HE2  TYR  51           HE2      TYR  51   7.010  -0.626  -0.626
  417    HH   TYR  51           HH       TYR  51   5.424   1.808   1.808
  418    H    ILE  52           H        ILE  52   6.066   0.449   0.449
  419    HA   ILE  52           HA       ILE  52   6.069   3.036   3.036
  420    HB   ILE  52           HB       ILE  52   4.068   0.969   0.969
  421   1HG1  ILE  52          2HG1      ILE  52   6.941   1.144   1.144
  422   2HG1  ILE  52          1HG1      ILE  52   6.209  -0.226  -0.226
  423   1HG2  ILE  52          1HG2      ILE  52   4.476   3.580   3.580
  424   2HG2  ILE  52          3HG2      ILE  52   5.446   2.784   2.784
  425   3HG2  ILE  52          2HG2      ILE  52   3.730   2.408   2.408
  426   1HD1  ILE  52          1HD1      ILE  52   4.516   0.299   0.299
  427   2HD1  ILE  52          3HD1      ILE  52   6.155   0.444   0.444
  428   3HD1  ILE  52          2HD1      ILE  52   5.648  -1.044  -1.044
  429    H    LYS  53           H        LYS  53   5.130   4.305   4.305
  430    HA   LYS  53           HA       LYS  53   2.683   3.320   3.320
  431   1HB   LYS  53          2HB       LYS  53   4.461   4.298   4.298
  432   2HB   LYS  53          1HB       LYS  53   4.385   5.793   5.793
  433   1HG   LYS  53          2HG       LYS  53   1.764   4.917   4.917
  434   2HG   LYS  53          1HG       LYS  53   2.927   5.235   5.235
  435   1HD   LYS  53          2HD       LYS  53   3.438   7.435   7.435
  436   2HD   LYS  53          1HD       LYS  53   1.965   7.123   7.123
  437   1HE   LYS  53          2HE       LYS  53   1.034   8.318   8.318
  438   2HE   LYS  53          1HE       LYS  53   0.992   6.716   6.716
  439   1HZ   LYS  53          3HZ       LYS  53   3.377   8.417   8.417
  440   2HZ   LYS  53          2HZ       LYS  53   2.031   8.661   8.661
  441   3HZ   LYS  53          1HZ       LYS  53   2.830   7.161   7.161
  442    H    THR  54           H        THR  54   0.827   3.842   3.842
  443    HA   THR  54           HA       THR  54   0.732   6.422   6.422
  444    HB   THR  54           HB       THR  54  -1.167   4.054   4.054
  445    HG1  THR  54           HG1      THR  54   0.240   3.225   3.225
  446   1HG2  THR  54          2HG2      THR  54  -1.349   6.748   6.748
  447   2HG2  THR  54          1HG2      THR  54  -1.148   5.686   5.686
  448   3HG2  THR  54          3HG2      THR  54  -2.475   5.417   5.417
  449    H    SER  55           H        SER  55  -0.837   7.961   7.961
  450    HA   SER  55           HA       SER  55  -2.682   7.219   7.219
  451   1HB   SER  55          2HB       SER  55  -2.037   9.735   9.735
  452   2HB   SER  55          1HB       SER  55  -1.214   8.305   8.305
  453    HG   SER  55           HG       SER  55  -0.414  10.136  10.136
  454    H    THR  56           H        THR  56  -4.635   8.317   8.317
  455    HA   THR  56           HA       THR  56  -5.118  10.099  10.099
  456    HB   THR  56           HB       THR  56  -7.600   9.256   9.256
  457    HG1  THR  56           HG1      THR  56  -5.923   7.070   7.070
  458   1HG2  THR  56          3HG2      THR  56  -5.497   7.841   7.841
  459   2HG2  THR  56          2HG2      THR  56  -7.201   7.387   7.387
  460   3HG2  THR  56          1HG2      THR  56  -6.707   8.996   8.996
  461    H    THR  57           H        THR  57  -6.710   9.341   9.341
  462    HA   THR  57           HA       THR  57  -6.339  11.832  11.832
  463    HB   THR  57           HB       THR  57  -7.685  12.840  12.840
  464    HG1  THR  57           HG1      THR  57  -9.180  13.736  13.736
  465   1HG2  THR  57          1HG2      THR  57  -8.724  10.669  10.669
  466   2HG2  THR  57          3HG2      THR  57  -9.820  10.796  10.796
  467   3HG2  THR  57          2HG2      THR  57  -9.861  12.013  12.013
  468    H    VAL  58           H        VAL  58  -8.587   9.227   9.227
  469    HA   VAL  58           HA       VAL  58  -9.035   8.838   8.838
  470    HB   VAL  58           HB       VAL  58 -10.782   7.940   7.940
  471   1HG1  VAL  58          1HG1      VAL  58 -10.903   7.657   7.657
  472   2HG1  VAL  58          3HG1      VAL  58 -12.402   7.742   7.742
  473   3HG1  VAL  58          2HG1      VAL  58 -11.240   6.453   6.453
  474   1HG2  VAL  58          1HG2      VAL  58 -10.512  10.514  10.514
  475   2HG2  VAL  58          3HG2      VAL  58 -12.029   9.848   9.848
  476   3HG2  VAL  58          2HG2      VAL  58 -11.740   9.950   9.950
  477    H    ARG  59           H        ARG  59  -7.532   7.567   7.567
  478    HA   ARG  59           HA       ARG  59  -7.280   4.905   4.905
  479   1HB   ARG  59          2HB       ARG  59  -8.617   4.821   4.821
  480   2HB   ARG  59          1HB       ARG  59  -7.221   5.471   5.471
  481   1HG   ARG  59          2HG       ARG  59  -5.938   3.545   3.545
  482   2HG   ARG  59          1HG       ARG  59  -6.912   3.027   3.027
  483   1HD   ARG  59          2HD       ARG  59  -7.875   3.096   3.096
  484   2HD   ARG  59          1HD       ARG  59  -7.357   1.644   1.644
  485    HE   ARG  59           HE       ARG  59  -9.776   3.248   3.248
  486   1HH1  ARG  59          2HH1      ARG  59  -8.184   1.293   1.293
  487   2HH1  ARG  59          1HH1      ARG  59  -9.246  -0.074  -0.074
  488   1HH2  ARG  59          1HH2      ARG  59 -11.023   1.091   1.091
  489   2HH2  ARG  59          2HH2      ARG  59 -10.853  -0.189  -0.189
  490    H    THR  60           H        THR  60  -5.168   3.823   3.823
  491    HA   THR  60           HA       THR  60  -3.015   5.494   5.494
  492    HB   THR  60           HB       THR  60  -2.914   4.673   4.673
  493    HG1  THR  60           HG1      THR  60  -3.419   6.752   6.752
  494   1HG2  THR  60          1HG2      THR  60  -0.761   4.910   4.910
  495   2HG2  THR  60          3HG2      THR  60  -1.197   6.585   6.585
  496   3HG2  THR  60          2HG2      THR  60  -0.922   6.062   6.062
  497    H    THR  61           H        THR  61  -2.554   3.726   3.726
  498    HA   THR  61           HA       THR  61  -2.226   1.031   1.031
  499    HB   THR  61           HB       THR  61  -1.052   1.571   1.571
  500    HG1  THR  61           HG1      THR  61  -3.764   2.169   2.169
  501   1HG2  THR  61          1HG2      THR  61  -1.767  -0.645  -0.645
  502   2HG2  THR  61          3HG2      THR  61  -3.416  -0.156  -0.156
  503   3HG2  THR  61          2HG2      THR  61  -2.232  -0.384  -0.384
  504    H    GLU  62           H        GLU  62  -0.127  -0.158  -0.158
  505    HA   GLU  62           HA       GLU  62   2.358   1.341   1.341
  506   1HB   GLU  62          2HB       GLU  62   1.150   0.893   0.893
  507   2HB   GLU  62          1HB       GLU  62   2.778   0.229   0.229
  508   1HG   GLU  62          2HG       GLU  62   3.690   2.353   2.353
  509   2HG   GLU  62          1HG       GLU  62   2.091   3.045   3.045
  510    H    ILE  63           H        ILE  63   3.620  -0.120  -0.120
  511    HA   ILE  63           HA       ILE  63   3.346  -3.013  -3.013
  512    HB   ILE  63           HB       ILE  63   3.934  -3.523  -3.523
  513   1HG1  ILE  63          2HG1      ILE  63   3.458  -0.553  -0.553
  514   2HG1  ILE  63          1HG1      ILE  63   5.048  -1.316  -1.316
  515   1HG2  ILE  63          2HG2      ILE  63   1.525  -3.104  -3.104
  516   2HG2  ILE  63          1HG2      ILE  63   1.538  -1.724  -1.724
  517   3HG2  ILE  63          3HG2      ILE  63   1.729  -3.358  -3.358
  518   1HD1  ILE  63          3HD1      ILE  63   2.995  -2.575  -2.575
  519   2HD1  ILE  63          2HD1      ILE  63   3.534  -0.970  -0.970
  520   3HD1  ILE  63          1HD1      ILE  63   4.705  -2.277  -2.277
  521    H    ASN  64           H        ASN  64   5.424  -4.257  -4.257
  522    HA   ASN  64           HA       ASN  64   7.884  -2.702  -2.702
  523   1HB   ASN  64          2HB       ASN  64   8.853  -3.552  -3.552
  524   2HB   ASN  64          1HB       ASN  64   7.551  -2.392  -2.392
  525   1HD2  ASN  64          2HD2      ASN  64   5.214  -4.843  -4.843
  526   2HD2  ASN  64          1HD2      ASN  64   5.300  -3.429  -3.429
  527    H    PHE  65           H        PHE  65   9.327  -4.050  -4.050
  528    HA   PHE  65           HA       PHE  65   9.400  -6.926  -6.926
  529   1HB   PHE  65          2HB       PHE  65   8.657  -7.687  -7.687
  530   2HB   PHE  65          1HB       PHE  65   7.396  -6.716  -6.716
  531    HD1  PHE  65           HD2      PHE  65   7.034  -4.337  -4.337
  532    HD2  PHE  65           HD1      PHE  65   9.779  -6.964  -6.964
  533    HE1  PHE  65           HE2      PHE  65   7.113  -2.784  -2.784
  534    HE2  PHE  65           HE1      PHE  65   9.866  -5.417  -5.417
  535    HZ   PHE  65           HZ       PHE  65   8.537  -3.325  -3.325
  536    H    LYS  66           H        LYS  66  10.603  -8.003  -8.003
  537    HA   LYS  66           HA       LYS  66  12.941  -6.299  -6.299
  538   1HB   LYS  66          2HB       LYS  66  14.320  -8.442  -8.442
  539   2HB   LYS  66          1HB       LYS  66  13.812  -7.725  -7.725
  540   1HG   LYS  66          2HG       LYS  66  11.822  -9.283  -9.283
  541   2HG   LYS  66          1HG       LYS  66  12.548 -10.083 -10.083
  542   1HD   LYS  66          2HD       LYS  66  14.012  -9.712  -9.712
  543   2HD   LYS  66          1HD       LYS  66  13.061 -11.151 -11.151
  544   1HE   LYS  66          2HE       LYS  66  14.553 -11.901 -11.901
  545   2HE   LYS  66          1HE       LYS  66  15.046 -10.271 -10.271
  546   1HZ   LYS  66          1HZ       LYS  66  16.091 -10.167 -10.167
  547   2HZ   LYS  66          3HZ       LYS  66  15.893 -11.850 -11.850
  548   3HZ   LYS  66          2HZ       LYS  66  16.861 -11.152 -11.152
  549    H    VAL  67           H        VAL  67  13.880  -6.948  -6.948
  550    HA   VAL  67           HA       VAL  67  11.809  -8.067  -8.067
  551    HB   VAL  67           HB       VAL  67  14.479  -7.584  -7.584
  552   1HG1  VAL  67          3HG1      VAL  67  11.587  -7.031  -7.031
  553   2HG1  VAL  67          2HG1      VAL  67  12.823  -6.114  -6.114
  554   3HG1  VAL  67          1HG1      VAL  67  12.780  -7.873  -7.873
  555   1HG2  VAL  67          3HG2      VAL  67  13.039  -5.478  -5.478
  556   2HG2  VAL  67          2HG2      VAL  67  14.769  -5.683  -5.683
  557   3HG2  VAL  67          1HG2      VAL  67  13.748  -5.023  -5.023
  558    H    GLY  68           H        GLY  68  11.695 -10.286 -10.286
  559   1HA   GLY  68          2HA       GLY  68  12.944 -12.220 -12.220
  560   2HA   GLY  68          1HA       GLY  68  14.171 -11.894 -11.894
  561    H    GLU  69           H        GLU  69  11.948 -11.282 -11.282
  562    HA   GLU  69           HA       GLU  69  11.123 -14.124 -14.124
  563   1HB   GLU  69          2HB       GLU  69  12.282 -12.066 -12.066
  564   2HB   GLU  69          1HB       GLU  69  11.220 -13.323 -13.323
  565   1HG   GLU  69          2HG       GLU  69  13.438 -14.135 -14.135
  566   2HG   GLU  69          1HG       GLU  69  13.839 -13.722 -13.722
  567    H    GLU  70           H        GLU  70   9.114 -14.393 -14.393
  568    HA   GLU  70           HA       GLU  70   7.128 -12.336 -12.336
  569   1HB   GLU  70          2HB       GLU  70   6.722 -14.980 -14.980
  570   2HB   GLU  70          1HB       GLU  70   5.480 -13.991 -13.991
  571   1HG   GLU  70          2HG       GLU  70   6.395 -14.390 -14.390
  572   2HG   GLU  70          1HG       GLU  70   7.842 -15.136 -15.136
  573    H    PHE  71           H        PHE  71   5.456 -11.774 -11.774
  574    HA   PHE  71           HA       PHE  71   6.314 -11.837 -11.837
  575   1HB   PHE  71          2HB       PHE  71   6.441  -9.336  -9.336
  576   2HB   PHE  71          1HB       PHE  71   7.747 -10.031 -10.031
  577    HD1  PHE  71           HD2      PHE  71   7.462 -10.109 -10.109
  578    HD2  PHE  71           HD1      PHE  71   4.973  -7.741  -7.741
  579    HE1  PHE  71           HE2      PHE  71   6.754  -8.735  -8.735
  580    HE2  PHE  71           HE1      PHE  71   4.266  -6.368  -6.368
  581    HZ   PHE  71           HZ       PHE  71   5.156  -6.863  -6.863
  582    H    GLU  72           H        GLU  72   4.781 -10.267 -10.267
  583    HA   GLU  72           HA       GLU  72   2.064 -10.581 -10.581
  584   1HB   GLU  72          2HB       GLU  72   2.527  -9.841  -9.841
  585   2HB   GLU  72          1HB       GLU  72   1.151 -10.660 -10.660
  586   1HG   GLU  72          2HG       GLU  72   2.581 -12.645 -12.645
  587   2HG   GLU  72          1HG       GLU  72   3.919 -11.838 -11.838
  588    H    GLU  73           H        GLU  73   0.713  -8.755  -8.755
  589    HA   GLU  73           HA       GLU  73   1.547  -6.152  -6.152
  590   1HB   GLU  73          2HB       GLU  73   1.677  -5.099  -5.099
  591   2HB   GLU  73          1HB       GLU  73   2.992  -6.232  -6.232
  592   1HG   GLU  73          2HG       GLU  73   2.192  -7.792  -7.792
  593   2HG   GLU  73          1HG       GLU  73   0.511  -7.318  -7.318
  594    H    GLN  74           H        GLN  74   0.029  -4.449  -4.449
  595    HA   GLN  74           HA       GLN  74  -2.720  -5.606  -5.606
  596   1HB   GLN  74          2HB       GLN  74  -1.610  -2.797  -2.797
  597   2HB   GLN  74          1HB       GLN  74  -3.336  -3.083  -3.083
  598   1HG   GLN  74          2HG       GLN  74  -2.021  -4.659  -4.659
  599   2HG   GLN  74          1HG       GLN  74  -2.176  -2.927  -2.927
  600   1HE2  GLN  74          2HE2      GLN  74  -5.590  -5.197  -5.197
  601   2HE2  GLN  74          1HE2      GLN  74  -4.142  -5.779  -5.779
  602    H    THR  75           H        THR  75  -4.346  -4.974  -4.974
  603    HA   THR  75           HA       THR  75  -3.094  -4.791  -4.791
  604    HB   THR  75           HB       THR  75  -4.696  -6.671  -6.671
  605    HG1  THR  75           HG1      THR  75  -5.745  -6.513  -6.513
  606   1HG2  THR  75          1HG2      THR  75  -6.350  -4.505  -4.505
  607   2HG2  THR  75          3HG2      THR  75  -7.095  -5.238  -5.238
  608   3HG2  THR  75          2HG2      THR  75  -6.753  -6.222  -6.222
  609    H    VAL  76           H        VAL  76  -5.850  -3.790  -3.790
  610    HA   VAL  76           HA       VAL  76  -5.333  -0.938  -0.938
  611    HB   VAL  76           HB       VAL  76  -6.721  -2.071  -2.071
  612   1HG1  VAL  76          1HG1      VAL  76  -7.271   0.286   0.286
  613   2HG1  VAL  76          3HG1      VAL  76  -5.556   0.676   0.676
  614   3HG1  VAL  76          2HG1      VAL  76  -6.453   0.167   0.167
  615   1HG2  VAL  76          1HG2      VAL  76  -3.846  -1.433  -1.433
  616   2HG2  VAL  76          3HG2      VAL  76  -4.521  -2.799  -2.799
  617   3HG2  VAL  76          2HG2      VAL  76  -4.468  -1.202  -1.202
  618    H    ASP  77           H        ASP  77  -7.796  -3.421  -3.421
  619    HA   ASP  77           HA       ASP  77  -9.974  -1.504  -1.504
  620   1HB   ASP  77          2HB       ASP  77 -11.316  -3.603  -3.603
  621   2HB   ASP  77          1HB       ASP  77 -10.583  -3.519  -3.519
  622    H    GLY  78           H        GLY  78  -8.118  -3.784  -3.784
  623   1HA   GLY  78          2HA       GLY  78  -7.683  -2.718  -2.718
  624   2HA   GLY  78          1HA       GLY  78  -9.441  -2.713  -2.713
  625    H    ARG  79           H        ARG  79  -7.253  -5.177  -5.177
  626    HA   ARG  79           HA       ARG  79  -8.159  -7.067  -7.067
  627   1HB   ARG  79          2HB       ARG  79  -8.339  -7.287  -7.287
  628   2HB   ARG  79          1HB       ARG  79  -8.079  -8.742  -8.742
  629   1HG   ARG  79          2HG       ARG  79 -10.197  -6.961  -6.961
  630   2HG   ARG  79          1HG       ARG  79 -10.544  -7.675  -7.675
  631   1HD   ARG  79          2HD       ARG  79  -9.496  -9.409  -9.409
  632   2HD   ARG  79          1HD       ARG  79 -11.205  -8.981  -8.981
  633    HE   ARG  79           HE       ARG  79 -10.089 -10.087 -10.087
  634   1HH1  ARG  79          1HH2      ARG  79 -12.872 -10.349 -10.349
  635   2HH1  ARG  79          2HH2      ARG  79 -13.196 -11.877 -11.877
  636   1HH2  ARG  79          1HH1      ARG  79 -11.596 -12.898 -12.898
  637   2HH2  ARG  79          2HH1      ARG  79 -10.045 -12.151 -12.151
  638    HA   PRO  80           HA       PRO  80  -3.837  -8.038  -8.038
  639   1HB   PRO  80          2HB       PRO  80  -3.919 -10.578 -10.578
  640   2HB   PRO  80          1HB       PRO  80  -4.171  -9.108  -9.108
  641   1HG   PRO  80          2HG       PRO  80  -6.169 -11.117 -11.117
  642   2HG   PRO  80          1HG       PRO  80  -6.233 -10.025 -10.025
  643   1HD   PRO  80          2HD       PRO  80  -7.583  -9.666  -9.666
  644   2HD   PRO  80          1HD       PRO  80  -7.397  -8.448  -8.448
  645    H    CYS  81           H        CYS  81  -2.314  -9.065  -9.065
  646    HA   CYS  81           HA       CYS  81  -2.932 -11.478 -11.478
  647   1HB   CYS  81          2HB       CYS  81  -2.553 -10.377 -10.377
  648   2HB   CYS  81          1HB       CYS  81  -4.064  -9.904  -9.904
  649    HG   CYS  81           HG       CYS  81  -2.572  -7.739  -7.739
  650    H    LYS  82           H        LYS  82  -1.036 -12.463 -12.463
  651    HA   LYS  82           HA       LYS  82   1.480 -11.235 -11.235
  652   1HB   LYS  82          2HB       LYS  82   1.131 -13.585 -13.585
  653   2HB   LYS  82          1HB       LYS  82   0.832 -13.962 -13.962
  654   1HG   LYS  82          2HG       LYS  82   3.020 -14.446 -14.446
  655   2HG   LYS  82          1HG       LYS  82   3.330 -12.721 -12.721
  656   1HD   LYS  82          2HD       LYS  82   4.639 -13.599 -13.599
  657   2HD   LYS  82          1HD       LYS  82   3.152 -13.166 -13.166
  658   1HE   LYS  82          2HE       LYS  82   2.376 -15.425 -15.425
  659   2HE   LYS  82          1HE       LYS  82   3.608 -15.920 -15.920
  660   1HZ   LYS  82          2HZ       LYS  82   5.264 -15.193 -15.193
  661   2HZ   LYS  82          1HZ       LYS  82   3.958 -15.177 -15.177
  662   3HZ   LYS  82          3HZ       LYS  82   4.398 -16.621 -16.621
  663    H    SER  83           H        SER  83   2.523  -9.930  -9.930
  664    HA   SER  83           HA       SER  83   2.028 -10.199 -10.199
  665   1HB   SER  83          2HB       SER  83   1.698  -7.970  -7.970
  666   2HB   SER  83          1HB       SER  83   3.035  -8.011  -8.011
  667    HG   SER  83           HG       SER  83   3.427  -6.857  -6.857
  668    H    LEU  84           H        LEU  84   3.983  -9.807  -9.807
  669    HA   LEU  84           HA       LEU  84   6.578 -10.605 -10.605
  670   1HB   LEU  84          2HB       LEU  84   5.605 -12.774 -12.774
  671   2HB   LEU  84          1HB       LEU  84   5.207 -12.157 -12.157
  672    HG   LEU  84           HG       LEU  84   7.583 -11.903 -11.903
  673   1HD1  LEU  84          3HD1      LEU  84   7.923 -11.943 -11.943
  674   2HD1  LEU  84          2HD1      LEU  84   8.728 -13.387 -13.387
  675   3HD1  LEU  84          1HD1      LEU  84   9.181 -11.802 -11.802
  676   1HD2  LEU  84          3HD2      LEU  84   6.277 -14.170 -14.170
  677   2HD2  LEU  84          2HD2      LEU  84   8.023 -14.172 -14.172
  678   3HD2  LEU  84          1HD2      LEU  84   7.355 -14.637 -14.637
  679    H    VAL  85           H        VAL  85   8.359 -10.015 -10.015
  680    HA   VAL  85           HA       VAL  85   7.469  -8.455  -8.455
  681    HB   VAL  85           HB       VAL  85   9.226  -7.261  -7.261
  682   1HG1  VAL  85          2HG1      VAL  85   8.623  -6.551  -6.551
  683   2HG1  VAL  85          1HG1      VAL  85   8.102  -5.278  -5.278
  684   3HG1  VAL  85          3HG1      VAL  85   9.778  -5.823  -5.823
  685   1HG2  VAL  85          1HG2      VAL  85   6.288  -6.986  -6.986
  686   2HG2  VAL  85          3HG2      VAL  85   7.045  -7.361  -7.361
  687   3HG2  VAL  85          2HG2      VAL  85   7.167  -5.736  -5.736
  688    H    LYS  86           H        LYS  86   8.799  -8.637  -8.637
  689    HA   LYS  86           HA       LYS  86  11.634  -9.440  -9.440
  690   1HB   LYS  86          2HB       LYS  86  11.256 -10.449 -10.449
  691   2HB   LYS  86          1HB       LYS  86  10.925 -11.402 -11.402
  692   1HG   LYS  86          2HG       LYS  86   8.524 -10.660 -10.660
  693   2HG   LYS  86          1HG       LYS  86   8.914  -9.873  -9.873
  694   1HD   LYS  86          2HD       LYS  86   9.887 -12.227 -12.227
  695   2HD   LYS  86          1HD       LYS  86   8.837 -12.804 -12.804
  696   1HE   LYS  86          2HE       LYS  86   7.068 -11.237 -11.237
  697   2HE   LYS  86          1HE       LYS  86   8.112 -11.584 -11.584
  698   1HZ   LYS  86          2HZ       LYS  86   7.125 -13.731 -13.731
  699   2HZ   LYS  86          1HZ       LYS  86   6.207 -13.179 -13.179
  700   3HZ   LYS  86          3HZ       LYS  86   7.737 -13.861 -13.861
  701    H    TRP  87           H        TRP  87  13.056  -8.642  -8.642
  702    HA   TRP  87           HA       TRP  87  12.206  -5.938  -5.938
  703   1HB   TRP  87          2HB       TRP  87  14.758  -7.516  -7.516
  704   2HB   TRP  87          1HB       TRP  87  14.540  -5.955  -5.955
  705    HD1  TRP  87           HD1      TRP  87  15.463  -7.538  -7.538
  706    HE1  TRP  87           HE1      TRP  87  15.744  -5.773  -5.773
  707    HE3  TRP  87           HE3      TRP  87  13.390  -3.516  -3.516
  708    HZ2  TRP  87           HZ2      TRP  87  15.162  -3.005  -3.005
  709    HZ3  TRP  87           HZ3      TRP  87  13.241  -1.326  -1.326
  710    HH2  TRP  87           HH2      TRP  87  14.123  -1.073  -1.073
  711    H    GLU  88           H        GLU  88  12.774  -5.262  -5.262
  712    HA   GLU  88           HA       GLU  88  12.080  -7.344  -7.344
  713   1HB   GLU  88          2HB       GLU  88  10.125  -5.785  -5.785
  714   2HB   GLU  88          1HB       GLU  88  10.988  -4.541  -4.541
  715   1HG   GLU  88          2HG       GLU  88   9.383  -5.560  -5.560
  716   2HG   GLU  88          1HG       GLU  88  11.002  -6.047  -6.047
  717    H    SER  89           H        SER  89  13.165  -4.051  -4.051
  718    HA   SER  89           HA       SER  89  15.238  -4.335  -4.335
  719   1HB   SER  89          2HB       SER  89  14.823  -2.095  -2.095
  720   2HB   SER  89          1HB       SER  89  13.248  -2.881  -2.881
  721    HG   SER  89           HG       SER  89  14.035  -0.690  -0.690
  722    H    GLU  90           H        GLU  90  16.247  -1.636  -1.636
  723    HA   GLU  90           HA       GLU  90  17.745  -2.390  -2.390
  724   1HB   GLU  90          2HB       GLU  90  17.764   0.318   0.318
  725   2HB   GLU  90          1HB       GLU  90  19.036  -0.402  -0.402
  726   1HG   GLU  90          2HG       GLU  90  18.784  -2.314  -2.314
  727   2HG   GLU  90          1HG       GLU  90  18.343  -0.887  -0.887
  728    H    ASN  91           H        ASN  91  14.928  -0.434  -0.434
  729    HA   ASN  91           HA       ASN  91  14.726   0.099   0.099
  730   1HB   ASN  91          2HB       ASN  91  14.214   2.261   2.261
  731   2HB   ASN  91          1HB       ASN  91  14.238   2.425   2.425
  732   1HD2  ASN  91          2HD2      ASN  91  17.609   3.132   3.132
  733   2HD2  ASN  91          1HD2      ASN  91  16.046   3.280   3.280
  734    H    LYS  92           H        LYS  92  13.256  -1.665  -1.665
  735    HA   LYS  92           HA       LYS  92  10.546  -0.586  -0.586
  736   1HB   LYS  92          2HB       LYS  92  11.028  -0.200  -0.200
  737   2HB   LYS  92          1HB       LYS  92  11.393  -1.912  -1.912
  738   1HG   LYS  92          2HG       LYS  92   9.006  -2.297  -2.297
  739   2HG   LYS  92          1HG       LYS  92   8.740  -0.605  -0.605
  740   1HD   LYS  92          2HD       LYS  92   9.522  -1.134  -1.134
  741   2HD   LYS  92          1HD       LYS  92   9.550  -2.837  -2.837
  742   1HE   LYS  92          2HE       LYS  92   7.024  -1.813  -1.813
  743   2HE   LYS  92          1HE       LYS  92   7.304  -1.246  -1.246
  744   1HZ   LYS  92          1HZ       LYS  92   7.555  -4.060  -4.060
  745   2HZ   LYS  92          3HZ       LYS  92   6.247  -3.424  -3.424
  746   3HZ   LYS  92          2HZ       LYS  92   7.786  -3.502  -3.502
  747    H    MET  93           H        MET  93   9.814  -2.019  -2.019
  748    HA   MET  93           HA       MET  93  10.396  -4.920  -4.920
  749   1HB   MET  93          2HB       MET  93   9.847  -5.055  -5.055
  750   2HB   MET  93          1HB       MET  93  11.443  -4.527  -4.527
  751   1HG   MET  93          2HG       MET  93  11.061  -2.326  -2.326
  752   2HG   MET  93          1HG       MET  93   9.323  -2.457  -2.457
  753   1HE   MET  93          3HE       MET  93  12.173  -4.093  -4.093
  754   2HE   MET  93          2HE       MET  93  12.200  -2.526  -2.526
  755   3HE   MET  93          1HE       MET  93  11.782  -3.972  -3.972
  756    H    VAL  94           H        VAL  94   8.744  -6.412  -6.412
  757    HA   VAL  94           HA       VAL  94   5.999  -5.284  -5.284
  758    HB   VAL  94           HB       VAL  94   6.753  -8.159  -8.159
  759   1HG1  VAL  94          1HG1      VAL  94   4.519  -6.310  -6.310
  760   2HG1  VAL  94          3HG1      VAL  94   4.847  -7.723  -7.723
  761   3HG1  VAL  94          2HG1      VAL  94   4.437  -7.921  -7.921
  762   1HG2  VAL  94          2HG2      VAL  94   7.047  -5.824  -5.824
  763   2HG2  VAL  94          1HG2      VAL  94   8.283  -6.995  -6.995
  764   3HG2  VAL  94          3HG2      VAL  94   6.927  -7.496  -7.496
  765    H    CYS  95           H        CYS  95   4.283  -6.776  -6.776
  766    HA   CYS  95           HA       CYS  95   5.367  -8.061  -8.061
  767   1HB   CYS  95          2HB       CYS  95   4.950  -5.689  -5.689
  768   2HB   CYS  95          1HB       CYS  95   3.279  -5.864  -5.864
  769    HG   CYS  95           HG       CYS  95   2.739  -7.217  -7.217
  770    H    GLU  96           H        GLU  96   4.095  -9.650  -9.650
  771    HA   GLU  96           HA       GLU  96   1.530 -10.231 -10.231
  772   1HB   GLU  96          2HB       GLU  96   3.232 -12.180 -12.180
  773   2HB   GLU  96          1HB       GLU  96   1.881 -12.564 -12.564
  774   1HG   GLU  96          2HG       GLU  96   3.986 -11.022 -11.022
  775   2HG   GLU  96          1HG       GLU  96   4.561 -12.570 -12.570
  776    H    GLN  97           H        GLN  97  -0.165 -11.228 -11.228
  777    HA   GLN  97           HA       GLN  97   0.265 -10.727 -10.727
  778   1HB   GLN  97          2HB       GLN  97  -0.388  -8.530  -8.530
  779   2HB   GLN  97          1HB       GLN  97  -2.001  -9.157  -9.157
  780   1HG   GLN  97          2HG       GLN  97  -1.192  -9.411  -9.411
  781   2HG   GLN  97          1HG       GLN  97   0.118  -8.331  -8.331
  782   1HE2  GLN  97          2HE2      GLN  97  -1.949  -5.450  -5.450
  783   2HE2  GLN  97          1HE2      GLN  97  -0.424  -6.104  -6.104
  784    H    LYS  98           H        LYS  98  -1.052 -11.965 -11.965
  785    HA   LYS  98           HA       LYS  98  -3.632 -12.931 -12.931
  786   1HB   LYS  98          2HB       LYS  98  -3.079 -15.263 -15.263
  787   2HB   LYS  98          1HB       LYS  98  -2.031 -14.694 -14.694
  788   1HG   LYS  98          2HG       LYS  98  -0.310 -14.079 -14.079
  789   2HG   LYS  98          1HG       LYS  98  -1.345 -14.742 -14.742
  790   1HD   LYS  98          2HD       LYS  98  -0.100 -16.627 -16.627
  791   2HD   LYS  98          1HD       LYS  98  -1.319 -16.852 -16.852
  792   1HE   LYS  98          2HE       LYS  98   0.285 -15.399 -15.399
  793   2HE   LYS  98          1HE       LYS  98   1.502 -15.845 -15.845
  794   1HZ   LYS  98          1HZ       LYS  98   0.571 -18.216 -18.216
  795   2HZ   LYS  98          3HZ       LYS  98   0.021 -17.559 -17.559
  796   3HZ   LYS  98          2HZ       LYS  98   1.680 -17.544 -17.544
  797    H    LEU  99           H        LEU  99  -5.138 -13.455 -13.455
  798    HA   LEU  99           HA       LEU  99  -4.844 -11.942 -11.942
  799   1HB   LEU  99          2HB       LEU  99  -6.590 -14.331 -14.331
  800   2HB   LEU  99          1HB       LEU  99  -6.741 -13.348 -13.348
  801    HG   LEU  99           HG       LEU  99  -6.716 -11.906 -11.906
  802   1HD1  LEU  99          2HD1      LEU  99  -8.807 -13.860 -13.860
  803   2HD1  LEU  99          1HD1      LEU  99  -9.330 -12.362 -12.362
  804   3HD1  LEU  99          3HD1      LEU  99  -8.262 -13.470 -13.470
  805   1HD2  LEU  99          2HD2      LEU  99  -7.870 -11.655 -11.655
  806   2HD2  LEU  99          1HD2      LEU  99  -7.031 -10.447 -10.447
  807   3HD2  LEU  99          3HD2      LEU  99  -8.712 -10.852 -10.852
  808    H    LEU 100           H        LEU 100  -4.903 -12.847 -12.847
  809    HA   LEU 100           HA       LEU 100  -2.873 -14.982 -14.982
  810   1HB   LEU 100          2HB       LEU 100  -3.919 -12.811 -12.811
  811   2HB   LEU 100          1HB       LEU 100  -2.951 -14.154 -14.154
  812    HG   LEU 100           HG       LEU 100  -2.024 -12.486 -12.486
  813   1HD1  LEU 100          3HD1      LEU 100  -2.000 -11.857 -11.857
  814   2HD1  LEU 100          2HD1      LEU 100  -0.547 -11.483 -11.483
  815   3HD1  LEU 100          1HD1      LEU 100  -2.093 -10.766 -10.766
  816   1HD2  LEU 100          3HD2      LEU 100  -0.858 -14.497 -14.497
  817   2HD2  LEU 100          2HD2      LEU 100  -0.670 -14.375 -14.375
  818   3HD2  LEU 100          1HD2      LEU 100   0.200 -13.266 -13.266
  819    H    LYS 101           H        LYS 101  -6.232 -14.590 -14.590
  820    HA   LYS 101           HA       LYS 101  -6.596 -17.186 -17.186
  821   1HB   LYS 101          2HB       LYS 101  -6.873 -15.193 -15.193
  822   2HB   LYS 101          1HB       LYS 101  -8.392 -14.914 -14.914
  823   1HG   LYS 101          2HG       LYS 101  -8.460 -17.641 -17.641
  824   2HG   LYS 101          1HG       LYS 101  -7.664 -17.059 -17.059
  825   1HD   LYS 101          2HD       LYS 101 -10.128 -15.658 -15.658
  826   2HD   LYS 101          1HD       LYS 101 -10.289 -17.164 -17.164
  827   1HE   LYS 101          2HE       LYS 101  -8.850 -16.156 -16.156
  828   2HE   LYS 101          1HE       LYS 101  -8.916 -14.627 -14.627
  829   1HZ   LYS 101          1HZ       LYS 101 -11.435 -14.974 -14.974
  830   2HZ   LYS 101          3HZ       LYS 101 -11.109 -16.096 -16.096
  831   3HZ   LYS 101          2HZ       LYS 101 -10.648 -14.472 -14.472
  832    H    GLY 102           H        GLY 102  -8.163 -18.345 -18.345
  833   1HA   GLY 102          2HA       GLY 102  -9.859 -18.830 -18.830
  834   2HA   GLY 102          1HA       GLY 102 -10.465 -17.195 -17.195
  835    H    GLU 103           H        GLU 103 -10.856 -17.185 -17.185
  836    HA   GLU 103           HA       GLU 103  -8.807 -15.766 -15.766
  837   1HB   GLU 103          2HB       GLU 103  -7.807 -18.059 -18.059
  838   2HB   GLU 103          1HB       GLU 103  -9.231 -18.609 -18.609
  839   1HG   GLU 103          2HG       GLU 103  -8.732 -17.290 -17.290
  840   2HG   GLU 103          1HG       GLU 103  -7.651 -16.239 -16.239
  841    H    GLY 104           H        GLY 104  -9.670 -14.766 -14.766
  842   1HA   GLY 104          2HA       GLY 104 -12.145 -15.779 -15.779
  843   2HA   GLY 104          1HA       GLY 104 -12.250 -14.197 -14.197
  844    HA   PRO 105           HA       PRO 105 -10.502 -12.567 -12.567
  845   1HB   PRO 105          2HB       PRO 105  -9.710 -10.104 -10.104
  846   2HB   PRO 105          1HB       PRO 105 -11.403 -10.525 -10.525
  847   1HG   PRO 105          2HG       PRO 105 -10.014 -10.172 -10.172
  848   2HG   PRO 105          1HG       PRO 105 -11.742 -10.065 -10.065
  849   1HD   PRO 105          2HD       PRO 105 -10.382 -12.276 -12.276
  850   2HD   PRO 105          1HD       PRO 105 -12.077 -12.226 -12.226
  851    H    LYS 106           H        LYS 106  -8.331 -11.184 -11.184
  852    HA   LYS 106           HA       LYS 106  -6.074 -12.304 -12.304
  853   1HB   LYS 106          2HB       LYS 106  -6.379 -13.613 -13.613
  854   2HB   LYS 106          1HB       LYS 106  -6.284 -12.125 -12.125
  855   1HG   LYS 106          2HG       LYS 106  -4.016 -11.769 -11.769
  856   2HG   LYS 106          1HG       LYS 106  -4.086 -12.965 -12.965
  857   1HD   LYS 106          2HD       LYS 106  -3.151 -14.354 -14.354
  858   2HD   LYS 106          1HD       LYS 106  -4.803 -14.493 -14.493
  859   1HE   LYS 106          2HE       LYS 106  -3.484 -13.934 -13.934
  860   2HE   LYS 106          1HE       LYS 106  -4.290 -12.436 -12.436
  861   1HZ   LYS 106          2HZ       LYS 106  -2.175 -12.095 -12.095
  862   2HZ   LYS 106          1HZ       LYS 106  -1.477 -13.216 -13.216
  863   3HZ   LYS 106          3HZ       LYS 106  -2.121 -11.765 -11.765
  864    H    THR 107           H        THR 107  -4.432 -10.785 -10.785
  865    HA   THR 107           HA       THR 107  -4.772  -8.147  -8.147
  866    HB   THR 107           HB       THR 107  -3.500  -7.503  -7.503
  867    HG1  THR 107           HG1      THR 107  -3.830  -9.067  -9.067
  868   1HG2  THR 107          3HG2      THR 107  -6.312  -7.455  -7.455
  869   2HG2  THR 107          2HG2      THR 107  -6.033  -7.049  -7.049
  870   3HG2  THR 107          1HG2      THR 107  -5.243  -6.117  -6.117
  871    H    SER 108           H        SER 108  -2.966  -7.070  -7.070
  872    HA   SER 108           HA       SER 108  -0.265  -7.932  -7.932
  873   1HB   SER 108          2HB       SER 108  -1.510  -8.630  -8.630
  874   2HB   SER 108          1HB       SER 108   0.218  -8.312  -8.312
  875    HG   SER 108           HG       SER 108  -0.548 -10.564 -10.564
  876    H    TRP 109           H        TRP 109   1.204  -6.222  -6.222
  877    HA   TRP 109           HA       TRP 109   0.141  -4.062  -4.062
  878   1HB   TRP 109          2HB       TRP 109   0.837  -2.330  -2.330
  879   2HB   TRP 109          1HB       TRP 109  -0.590  -3.263  -3.263
  880    HD1  TRP 109           HD1      TRP 109  -0.473  -4.794  -4.794
  881    HE1  TRP 109           HE1      TRP 109   1.293  -5.150  -5.150
  882    HE3  TRP 109           HE3      TRP 109   3.502  -2.369  -2.369
  883    HZ2  TRP 109           HZ2      TRP 109   4.023  -4.493  -4.493
  884    HZ3  TRP 109           HZ3      TRP 109   5.669  -2.254  -2.254
  885    HH2  TRP 109           HH2      TRP 109   5.939  -3.310  -3.310
  886    H    THR 110           H        THR 110   1.903  -2.302  -2.302
  887    HA   THR 110           HA       THR 110   4.629  -3.495  -3.495
  888    HB   THR 110           HB       THR 110   5.085  -3.045  -3.045
  889    HG1  THR 110           HG1      THR 110   2.569  -1.744  -1.744
  890   1HG2  THR 110          3HG2      THR 110   3.237  -4.895  -4.895
  891   2HG2  THR 110          2HG2      THR 110   2.275  -3.905  -3.905
  892   3HG2  THR 110          1HG2      THR 110   3.776  -4.638  -4.638
  893    H    MET 111           H        MET 111   6.290  -1.768  -1.768
  894    HA   MET 111           HA       MET 111   5.467   1.028   1.028
  895   1HB   MET 111          2HB       MET 111   6.999   1.340   1.340
  896   2HB   MET 111          1HB       MET 111   5.628   0.296   0.296
  897   1HG   MET 111          2HG       MET 111   6.946  -1.656  -1.656
  898   2HG   MET 111          1HG       MET 111   8.236  -0.861  -0.861
  899   1HE   MET 111          2HE       MET 111   5.962  -0.367  -0.367
  900   2HE   MET 111          1HE       MET 111   6.904  -0.635  -0.635
  901   3HE   MET 111          3HE       MET 111   6.739   0.996   0.996
  902    H    GLU 112           H        GLU 112   6.907   2.375   2.375
  903    HA   GLU 112           HA       GLU 112   9.510   1.193   1.193
  904   1HB   GLU 112          2HB       GLU 112   7.828   1.159   1.159
  905   2HB   GLU 112          1HB       GLU 112   7.691   2.912   2.912
  906   1HG   GLU 112          2HG       GLU 112   9.861   3.279   3.279
  907   2HG   GLU 112          1HG       GLU 112  10.398   1.656   1.656
  908    H    LEU 113           H        LEU 113  11.199   2.732   2.732
  909    HA   LEU 113           HA       LEU 113  10.659   5.383   5.383
  910   1HB   LEU 113          2HB       LEU 113  12.406   3.383   3.383
  911   2HB   LEU 113          1HB       LEU 113  13.449   4.416   4.416
  912    HG   LEU 113           HG       LEU 113  13.379   4.929   4.929
  913   1HD1  LEU 113          1HD1      LEU 113  14.152   6.574   6.574
  914   2HD1  LEU 113          3HD1      LEU 113  12.500   7.141   7.141
  915   3HD1  LEU 113          2HD1      LEU 113  13.309   7.357   7.357
  916   1HD2  LEU 113          1HD2      LEU 113  10.600   4.841   4.841
  917   2HD2  LEU 113          3HD2      LEU 113  11.437   5.325   5.325
  918   3HD2  LEU 113          2HD2      LEU 113  10.971   6.540   6.540
  919    H    THR 114           H        THR 114  11.434   7.210   7.210
  920    HA   THR 114           HA       THR 114  12.149   6.646   6.646
  921    HB   THR 114           HB       THR 114  11.650   8.933   8.933
  922    HG1  THR 114           HG1      THR 114  11.992  10.426  10.426
  923   1HG2  THR 114          1HG2      THR 114   9.678   7.520   7.520
  924   2HG2  THR 114          3HG2      THR 114   9.767   8.018   8.018
  925   3HG2  THR 114          2HG2      THR 114   9.401   9.206   9.206
  926    H    ASN 115           H        ASN 115  13.948   7.859   7.859
  927    HA   ASN 115           HA       ASN 115  16.417   7.459   7.459
  928   1HB   ASN 115          2HB       ASN 115  17.393   8.817   8.817
  929   2HB   ASN 115          1HB       ASN 115  16.321   7.534   7.534
  930   1HD2  ASN 115          2HD2      ASN 115  15.181  11.449  11.449
  931   2HD2  ASN 115          1HD2      ASN 115  16.472  11.060  11.060
  932    H    ASP 116           H        ASP 116  14.202  10.146  10.146
  933    HA   ASP 116           HA       ASP 116  16.207  12.035  12.035
  934   1HB   ASP 116          2HB       ASP 116  13.209  12.173  12.173
  935   2HB   ASP 116          1HB       ASP 116  14.128  13.474  13.474
  936    H    GLY 117           H        GLY 117  13.787   9.824   9.824
  937   1HA   GLY 117          2HA       GLY 117  14.390   9.054   9.054
  938   2HA   GLY 117          1HA       GLY 117  14.418  10.767  10.767
  939    H    GLU 118           H        GLU 118  11.987  10.743  10.743
  940    HA   GLU 118           HA       GLU 118   9.907  11.051  11.051
  941   1HB   GLU 118          2HB       GLU 118   9.650  10.225  10.225
  942   2HB   GLU 118          1HB       GLU 118   8.378  10.930  10.930
  943   1HG   GLU 118          2HG       GLU 118  10.987  12.263  12.263
  944   2HG   GLU 118          1HG       GLU 118   9.384  12.666  12.666
  945    H    LEU 119           H        LEU 119   7.844   9.562   9.562
  946    HA   LEU 119           HA       LEU 119   8.614   6.694   6.694
  947   1HB   LEU 119          2HB       LEU 119   9.147   7.494   7.494
  948   2HB   LEU 119          1HB       LEU 119   7.450   7.905   7.905
  949    HG   LEU 119           HG       LEU 119   8.338   5.110   5.110
  950   1HD1  LEU 119          2HD1      LEU 119   8.290   6.505   6.505
  951   2HD1  LEU 119          1HD1      LEU 119   7.942   4.779   4.779
  952   3HD1  LEU 119          3HD1      LEU 119   9.497   5.396   5.396
  953   1HD2  LEU 119          1HD2      LEU 119   5.836   6.453   6.453
  954   2HD2  LEU 119          3HD2      LEU 119   6.020   5.179   5.179
  955   3HD2  LEU 119          2HD2      LEU 119   6.142   4.793   4.793
  956    H    ILE 120           H        ILE 120   7.079   5.885   5.885
  957    HA   ILE 120           HA       ILE 120   4.255   6.799   6.799
  958    HB   ILE 120           HB       ILE 120   5.046   7.071   7.071
  959   1HG1  ILE 120          2HG1      ILE 120   3.299   4.601   4.601
  960   2HG1  ILE 120          1HG1      ILE 120   2.692   6.191   6.191
  961   1HG2  ILE 120          1HG2      ILE 120   5.898   4.209   4.209
  962   2HG2  ILE 120          3HG2      ILE 120   5.564   4.830   4.830
  963   3HG2  ILE 120          2HG2      ILE 120   6.830   5.566   5.566
  964   1HD1  ILE 120          3HD1      ILE 120   4.015   5.564   5.564
  965   2HD1  ILE 120          2HD1      ILE 120   2.272   5.664   5.664
  966   3HD1  ILE 120          1HD1      ILE 120   3.277   7.097   7.097
  967    H    LEU 121           H        LEU 121   2.606   5.017   5.017
  968    HA   LEU 121           HA       LEU 121   3.732   2.359   2.359
  969   1HB   LEU 121          2HB       LEU 121   3.464   3.628   3.628
  970   2HB   LEU 121          1HB       LEU 121   1.768   3.900   3.900
  971    HG   LEU 121           HG       LEU 121   2.301   1.082   1.082
  972   1HD1  LEU 121          2HD1      LEU 121   4.163   1.974   1.974
  973   2HD1  LEU 121          1HD1      LEU 121   2.820   1.950   1.950
  974   3HD1  LEU 121          3HD1      LEU 121   3.301   0.468   0.468
  975   1HD2  LEU 121          2HD2      LEU 121   0.630   2.865   2.865
  976   2HD2  LEU 121          1HD2      LEU 121   0.108   1.758   1.758
  977   3HD2  LEU 121          3HD2      LEU 121   0.676   1.124   1.124
  978    H    THR 122           H        THR 122   2.486   0.735   0.735
  979    HA   THR 122           HA       THR 122  -0.202   1.498   1.498
  980    HB   THR 122           HB       THR 122   0.682  -1.038  -1.038
  981    HG1  THR 122           HG1      THR 122   2.523  -0.225  -0.225
  982   1HG2  THR 122          2HG2      THR 122  -0.831   0.954   0.954
  983   2HG2  THR 122          1HG2      THR 122   0.687   1.475   1.475
  984   3HG2  THR 122          3HG2      THR 122   0.018  -0.110  -0.110
  985    H    MET 123           H        MET 123  -1.775  -0.417  -0.417
  986    HA   MET 123           HA       MET 123  -1.213  -2.211  -2.211
  987   1HB   MET 123          2HB       MET 123  -3.721  -0.521  -0.521
  988   2HB   MET 123          1HB       MET 123  -3.389  -1.694  -1.694
  989   1HG   MET 123          2HG       MET 123  -1.565   0.655   0.655
  990   2HG   MET 123          1HG       MET 123  -2.939   0.758   0.758
  991   1HE   MET 123          3HE       MET 123  -3.516  -0.616  -0.616
  992   2HE   MET 123          2HE       MET 123  -2.645  -1.961  -1.961
  993   3HE   MET 123          1HE       MET 123  -2.390  -0.324  -0.324
  994    H    THR 124           H        THR 124  -2.921  -3.926  -3.926
  995    HA   THR 124           HA       THR 124  -4.505  -4.373  -4.373
  996    HB   THR 124           HB       THR 124  -2.617  -6.543  -6.543
  997    HG1  THR 124           HG1      THR 124  -1.062  -5.528  -5.528
  998   1HG2  THR 124          2HG2      THR 124  -4.647  -7.030  -7.030
  999   2HG2  THR 124          1HG2      THR 124  -4.002  -5.952  -5.952
 1000   3HG2  THR 124          3HG2      THR 124  -3.132  -7.425  -7.425
 1001    H    ALA 125           H        ALA 125  -6.128  -5.907  -5.907
 1002    HA   ALA 125           HA       ALA 125  -6.302  -7.396  -7.396
 1003   1HB   ALA 125          2HB       ALA 125  -7.141  -4.944  -4.944
 1004   2HB   ALA 125          1HB       ALA 125  -8.554  -5.480  -5.480
 1005   3HB   ALA 125          3HB       ALA 125  -8.125  -6.276  -6.276
 1006    H    ASP 126           H        ASP 126  -6.543  -9.249  -9.249
 1007    HA   ASP 126           HA       ASP 126  -7.823 -10.929 -10.929
 1008   1HB   ASP 126          2HB       ASP 126  -9.809  -9.126  -9.126
 1009   2HB   ASP 126          1HB       ASP 126 -10.174  -9.438  -9.438
 1010    H    ASP 127           H        ASP 127  -9.108  -8.116  -8.116
 1011    HA   ASP 127           HA       ASP 127  -7.248  -8.634  -8.634
 1012   1HB   ASP 127          2HB       ASP 127  -9.607  -9.953  -9.953
 1013   2HB   ASP 127          1HB       ASP 127 -10.094  -8.415  -8.415
 1014    H    VAL 128           H        VAL 128  -7.966  -6.500  -6.500
 1015    HA   VAL 128           HA       VAL 128  -8.536  -4.303  -4.303
 1016    HB   VAL 128           HB       VAL 128  -9.439  -3.023  -3.023
 1017   1HG1  VAL 128          1HG1      VAL 128 -10.770  -4.933  -4.933
 1018   2HG1  VAL 128          3HG1      VAL 128 -10.697  -5.725  -5.725
 1019   3HG1  VAL 128          2HG1      VAL 128 -11.470  -4.148  -4.148
 1020   1HG2  VAL 128          1HG2      VAL 128  -8.187  -5.218  -5.218
 1021   2HG2  VAL 128          3HG2      VAL 128  -8.416  -3.525  -3.525
 1022   3HG2  VAL 128          2HG2      VAL 128  -9.751  -4.664  -4.664
 1023    H    VAL 129           H        VAL 129  -7.529  -2.167  -2.167
 1024    HA   VAL 129           HA       VAL 129  -5.033  -2.712  -2.712
 1025    HB   VAL 129           HB       VAL 129  -5.142  -2.212  -2.212
 1026   1HG1  VAL 129          2HG1      VAL 129  -3.136  -0.905  -0.905
 1027   2HG1  VAL 129          1HG1      VAL 129  -2.659  -1.416  -1.416
 1028   3HG1  VAL 129          3HG1      VAL 129  -3.944  -0.226  -0.226
 1029   1HG2  VAL 129          2HG2      VAL 129  -3.717  -3.928  -3.928
 1030   2HG2  VAL 129          1HG2      VAL 129  -4.357  -4.322  -4.322
 1031   3HG2  VAL 129          3HG2      VAL 129  -2.813  -3.482  -3.482
 1032    H    CYS 130           H        CYS 130  -4.892  -1.110  -1.110
 1033    HA   CYS 130           HA       CYS 130  -6.126   1.531   1.531
 1034   1HB   CYS 130          2HB       CYS 130  -6.457   0.065   0.065
 1035   2HB   CYS 130          1HB       CYS 130  -4.987   0.909   0.909
 1036    HG   CYS 130           HG       CYS 130  -7.748   2.169   2.169
 1037    H    THR 131           H        THR 131  -4.728   2.990   2.990
 1038    HA   THR 131           HA       THR 131  -1.853   2.816   2.816
 1039    HB   THR 131           HB       THR 131  -3.159   4.311   4.311
 1040    HG1  THR 131           HG1      THR 131  -3.272   2.075   2.075
 1041   1HG2  THR 131          3HG2      THR 131  -0.321   3.956   3.956
 1042   2HG2  THR 131          2HG2      THR 131  -0.670   4.194   4.194
 1043   3HG2  THR 131          1HG2      THR 131  -1.137   5.424   5.424
 1044    H    ARG 132           H        ARG 132  -0.762   4.666   4.666
 1045    HA   ARG 132           HA       ARG 132  -2.191   7.184   7.184
 1046   1HB   ARG 132          2HB       ARG 132  -1.127   5.475   5.475
 1047   2HB   ARG 132          1HB       ARG 132  -1.572   7.171   7.171
 1048   1HG   ARG 132          2HG       ARG 132  -3.857   6.501   6.501
 1049   2HG   ARG 132          1HG       ARG 132  -3.364   4.834   4.834
 1050   1HD   ARG 132          2HD       ARG 132  -3.353   6.996   6.996
 1051   2HD   ARG 132          1HD       ARG 132  -4.684   5.863   5.863
 1052    HE   ARG 132           HE       ARG 132  -1.939   4.832   4.832
 1053   1HH1  ARG 132          1HH2      ARG 132  -3.450   2.582   2.582
 1054   2HH1  ARG 132          2HH2      ARG 132  -4.251   2.504   2.504
 1055   1HH2  ARG 132          2HH1      ARG 132  -3.763   5.860   5.860
 1056   2HH2  ARG 132          1HH1      ARG 132  -4.428   4.360   4.360
 1057    H    VAL 133           H        VAL 133  -0.645   8.703   8.703
 1058    HA   VAL 133           HA       VAL 133   2.202   7.918   7.918
 1059    HB   VAL 133           HB       VAL 133   0.894  10.514  10.514
 1060   1HG1  VAL 133          3HG1      VAL 133   3.300  10.731  10.731
 1061   2HG1  VAL 133          2HG1      VAL 133   3.653   9.386   9.386
 1062   3HG1  VAL 133          1HG1      VAL 133   3.015  10.896  10.896
 1063   1HG2  VAL 133          2HG2      VAL 133   1.628   7.998   7.998
 1064   2HG2  VAL 133          1HG2      VAL 133   0.058   8.798   8.798
 1065   3HG2  VAL 133          3HG2      VAL 133   1.388   9.542   9.542
 1066    H    TYR 134           H        TYR 134   3.710   8.683   8.683
 1067    HA   TYR 134           HA       TYR 134   2.671  10.643  10.643
 1068   1HB   TYR 134          2HB       TYR 134   4.145   8.061   8.061
 1069   2HB   TYR 134          1HB       TYR 134   4.360   9.373   9.373
 1070    HD1  TYR 134           HD2      TYR 134   2.484  10.213  10.213
 1071    HD2  TYR 134           HD1      TYR 134   2.000   6.911   6.911
 1072    HE1  TYR 134           HE2      TYR 134   0.338   9.628   9.628
 1073    HE2  TYR 134           HE1      TYR 134  -0.146   6.324   6.324
 1074    HH   TYR 134           HH       TYR 134  -1.055   6.970   6.970
 1075    H    VAL 135           H        VAL 135   3.881  12.420  12.420
 1076    HA   VAL 135           HA       VAL 135   6.687  12.281  12.281
 1077    HB   VAL 135           HB       VAL 135   4.571  14.071  14.071
 1078   1HG1  VAL 135          1HG1      VAL 135   6.757  15.462  15.462
 1079   2HG1  VAL 135          3HG1      VAL 135   5.579  16.283  16.283
 1080   3HG1  VAL 135          2HG1      VAL 135   5.043  15.412  15.412
 1081   1HG2  VAL 135          3HG2      VAL 135   6.754  13.211  13.211
 1082   2HG2  VAL 135          2HG2      VAL 135   6.031  14.752  14.752
 1083   3HG2  VAL 135          1HG2      VAL 135   7.431  14.721  14.721
 1084    H    ARG 136           H        ARG 136   8.340  12.819  12.819
 1085    HA   ARG 136           HA       ARG 136   7.974  12.525  12.525
 1086   1HB   ARG 136          2HB       ARG 136  10.122  13.356  13.356
 1087   2HB   ARG 136          1HB       ARG 136  10.128  14.331  14.331
 1088   1HG   ARG 136          2HG       ARG 136  10.466  12.518  12.518
 1089   2HG   ARG 136          1HG       ARG 136   9.737  11.381  11.381
 1090   1HD   ARG 136          2HD       ARG 136  12.481  12.651  12.651
 1091   2HD   ARG 136          1HD       ARG 136  12.097  10.937  10.937
 1092    HE   ARG 136           HE       ARG 136  10.879  11.663  11.663
 1093   1HH1  ARG 136          1HH2      ARG 136  13.815  10.517  10.517
 1094   2HH1  ARG 136          2HH2      ARG 136  14.730  11.125  11.125
 1095   1HH2  ARG 136          2HH1      ARG 136  12.146  13.100  13.100
 1096   2HH2  ARG 136          1HH1      ARG 136  13.784  12.590  12.590
 1097    H    GLU 137           HN       GLU 137   7.169  13.671  13.671
 1098    HA   GLU 137           HA       GLU 137   5.707  16.026  16.026
 1099   1HB   GLU 137          2HB       GLU 137   6.066  14.326  14.326
 1100   2HB   GLU 137          1HB       GLU 137   7.269  15.496  15.496
 1101   1HG   GLU 137          2HG       GLU 137   4.397  16.187  16.187
 1102   2HG   GLU 137          1HG       GLU 137   4.990  15.860  15.860

  Start of MODEL   31
    1   1H    PRO   1          1H        PRO   1 -16.224   7.127   7.127
    2   2H    PRO   1          2H        PRO   1 -15.806   6.221   6.221
    3    HA   PRO   1           HA       PRO   1 -16.572   4.367   4.367
    4   1HB   PRO   1          2HB       PRO   1 -19.205   5.104   5.104
    5   2HB   PRO   1          1HB       PRO   1 -18.754   4.177   4.177
    6   1HG   PRO   1          2HG       PRO   1 -19.728   6.865   6.865
    7   2HG   PRO   1          1HG       PRO   1 -19.267   5.937   5.937
    8   1HD   PRO   1          1HD       PRO   1 -17.860   8.120   8.120
    9   2HD   PRO   1          2HD       PRO   1 -17.411   7.195   7.195
   10    H    ASN   2           H        ASN   2 -15.129   6.069   6.069
   11    HA   ASN   2           HA       ASN   2 -15.878   4.952   4.952
   12   1HB   ASN   2          2HB       ASN   2 -16.682   7.731   7.731
   13   2HB   ASN   2          1HB       ASN   2 -15.947   7.500   7.500
   14   1HD2  ASN   2          2HD2      ASN   2 -19.711   6.812   6.812
   15   2HD2  ASN   2          1HD2      ASN   2 -18.825   8.088   8.088
   16    H    PHE   3           H        PHE   3 -13.985   4.602   4.602
   17    HA   PHE   3           HA       PHE   3 -11.604   6.188   6.188
   18   1HB   PHE   3          2HB       PHE   3 -11.913   3.608   3.608
   19   2HB   PHE   3          1HB       PHE   3 -10.378   4.381   4.381
   20    HD1  PHE   3           HD1      PHE   3 -13.463   3.367   3.367
   21    HD2  PHE   3           HD2      PHE   3  -9.168   3.480   3.480
   22    HE1  PHE   3           HE1      PHE   3 -13.349   2.166   2.166
   23    HE2  PHE   3           HE2      PHE   3  -9.065   2.269   2.269
   24    HZ   PHE   3           HZ       PHE   3 -11.155   1.603   1.603
   25    H    SER   4           H        SER   4 -13.902   5.899   5.899
   26    HA   SER   4           HA       SER   4 -12.304   6.410   6.410
   27   1HB   SER   4          2HB       SER   4 -14.381   7.072   7.072
   28   2HB   SER   4          1HB       SER   4 -14.674   5.671   5.671
   29    HG   SER   4           HG       SER   4 -15.549   7.019   7.019
   30    H    GLY   5           H        GLY   5 -11.074   8.111   8.111
   31   1HA   GLY   5          2HA       GLY   5 -11.801  10.732  10.732
   32   2HA   GLY   5          1HA       GLY   5 -11.388  10.671  10.671
   33    H    ASN   6           H        ASN   6  -9.651  12.239  12.239
   34    HA   ASN   6           HA       ASN   6  -7.373  10.633  10.633
   35   1HB   ASN   6          2HB       ASN   6  -7.979  13.598  13.598
   36   2HB   ASN   6          1HB       ASN   6  -6.325  13.024  13.024
   37   1HD2  ASN   6          2HD2      ASN   6  -7.281  11.342  11.342
   38   2HD2  ASN   6          1HD2      ASN   6  -6.535  10.899  10.899
   39    H    TRP   7           H        TRP   7  -5.208  11.373  11.373
   40    HA   TRP   7           HA       TRP   7  -5.697  11.905  11.905
   41   1HB   TRP   7          2HB       TRP   7  -4.537   9.334   9.334
   42   2HB   TRP   7          1HB       TRP   7  -4.474   9.801   9.801
   43    HD1  TRP   7           HD1      TRP   7  -6.742   8.318   8.318
   44    HE1  TRP   7           HE1      TRP   7  -9.101   7.945   7.945
   45    HE3  TRP   7           HE3      TRP   7  -6.218  10.882  10.882
   46    HZ2  TRP   7           HZ2      TRP   7 -10.564   8.684   8.684
   47    HZ3  TRP   7           HZ3      TRP   7  -8.098  11.074  11.074
   48    HH2  TRP   7           HH2      TRP   7 -10.255   9.974   9.974
   49    H    LYS   8           H        LYS   8  -4.224  13.300  13.300
   50    HA   LYS   8           HA       LYS   8  -1.506  13.223  13.223
   51   1HB   LYS   8          2HB       LYS   8  -3.231  15.443  15.443
   52   2HB   LYS   8          1HB       LYS   8  -1.488  15.589  15.589
   53   1HG   LYS   8          2HG       LYS   8  -1.182  15.139  15.139
   54   2HG   LYS   8          1HG       LYS   8  -2.936  15.155  15.155
   55   1HD   LYS   8          2HD       LYS   8  -3.060  17.457  17.457
   56   2HD   LYS   8          1HD       LYS   8  -1.350  17.461  17.461
   57   1HE   LYS   8          2HE       LYS   8  -1.222  16.672  16.672
   58   2HE   LYS   8          1HE       LYS   8  -2.627  17.737  17.737
   59   1HZ   LYS   8          3HZ       LYS   8  -0.122  18.548  18.548
   60   2HZ   LYS   8          2HZ       LYS   8  -0.341  18.774  18.774
   61   3HZ   LYS   8          1HZ       LYS   8  -1.387  19.527  19.527
   62    H    ILE   9           H        ILE   9  -0.092  12.268  12.268
   63    HA   ILE   9           HA       ILE   9  -0.586  11.467  11.467
   64    HB   ILE   9           HB       ILE   9   1.037  10.375  10.375
   65   1HG1  ILE   9          2HG1      ILE   9   2.357  11.674  11.674
   66   2HG1  ILE   9          1HG1      ILE   9   1.420  10.182  10.182
   67   1HG2  ILE   9          3HG2      ILE   9   1.765  12.879  12.879
   68   2HG2  ILE   9          2HG2      ILE   9   3.095  12.488  12.488
   69   3HG2  ILE   9          1HG2      ILE   9   2.744  11.441  11.441
   70   1HD1  ILE   9          3HD1      ILE   9   3.367   9.804   9.804
   71   2HD1  ILE   9          2HD1      ILE   9   4.220  10.579  10.579
   72   3HD1  ILE   9          1HD1      ILE   9   3.347   9.072   9.072
   73    H    ILE  10           H        ILE  10   0.378  12.160  12.160
   74    HA   ILE  10           HA       ILE  10   1.283  15.003  15.003
   75    HB   ILE  10           HB       ILE  10   0.052  15.304  15.304
   76   1HG1  ILE  10          2HG1      ILE  10  -1.791  13.293  13.293
   77   2HG1  ILE  10          1HG1      ILE  10  -0.377  12.390  12.390
   78   1HG2  ILE  10          3HG2      ILE  10  -0.988  15.701  15.701
   79   2HG2  ILE  10          2HG2      ILE  10  -1.830  14.168  14.168
   80   3HG2  ILE  10          1HG2      ILE  10  -2.120  15.506  15.506
   81   1HD1  ILE  10          1HD1      ILE  10   0.779  13.933  13.933
   82   2HD1  ILE  10          3HD1      ILE  10  -0.848  13.816  13.816
   83   3HD1  ILE  10          2HD1      ILE  10   0.082  12.352  12.352
   84    H    ARG  11           H        ARG  11   1.487  11.760  11.760
   85    HA   ARG  11           HA       ARG  11   4.176  12.431  12.431
   86   1HB   ARG  11          2HB       ARG  11   2.289  12.775  12.775
   87   2HB   ARG  11          1HB       ARG  11   2.302  11.013  11.013
   88   1HG   ARG  11          2HG       ARG  11   4.386  10.927  10.927
   89   2HG   ARG  11          1HG       ARG  11   4.958  12.343  12.343
   90   1HD   ARG  11          2HD       ARG  11   4.813  13.014  13.014
   91   2HD   ARG  11          1HD       ARG  11   3.420  13.733  13.733
   92    HE   ARG  11           HE       ARG  11   2.034  12.378  12.378
   93   1HH1  ARG  11          2HH1      ARG  11   2.435   9.708   9.708
   94   2HH1  ARG  11          1HH1      ARG  11   3.387   9.090   9.090
   95   1HH2  ARG  11          1HH2      ARG  11   4.485  12.215  12.215
   96   2HH2  ARG  11          2HH2      ARG  11   4.548  10.509  10.509
   97    H    SER  12           H        SER  12   5.239  10.329  10.329
   98    HA   SER  12           HA       SER  12   4.166   7.762   7.762
   99   1HB   SER  12          2HB       SER  12   5.366   7.270   7.270
  100   2HB   SER  12          1HB       SER  12   4.368   8.697   8.697
  101    HG   SER  12           HG       SER  12   6.230   9.475   9.475
  102    H    GLU  13           H        GLU  13   5.508   6.195   6.195
  103    HA   GLU  13           HA       GLU  13   8.318   6.959   6.959
  104   1HB   GLU  13          2HB       GLU  13   7.980   5.761   5.761
  105   2HB   GLU  13          1HB       GLU  13   7.177   7.322   7.322
  106   1HG   GLU  13          2HG       GLU  13   5.564   5.027   5.027
  107   2HG   GLU  13          1HG       GLU  13   5.929   5.013   5.013
  108    H    ASN  14           H        ASN  14   9.488   4.866   4.866
  109    HA   ASN  14           HA       ASN  14  10.289   2.723   2.723
  110   1HB   ASN  14          2HB       ASN  14   7.412   2.152   2.152
  111   2HB   ASN  14          1HB       ASN  14   8.651   0.977   0.977
  112   1HD2  ASN  14          2HD2      ASN  14   6.471   2.311   2.311
  113   2HD2  ASN  14          1HD2      ASN  14   5.997   2.209   2.209
  114    H    PHE  15           H        PHE  15   9.933   4.842   4.842
  115    HA   PHE  15           HA       PHE  15   9.196   3.516   3.516
  116   1HB   PHE  15          2HB       PHE  15   9.637   6.067   6.067
  117   2HB   PHE  15          1HB       PHE  15  11.305   5.663   5.663
  118    HD1  PHE  15           HD2      PHE  15  10.752   3.524   3.524
  119    HD2  PHE  15           HD1      PHE  15   9.041   7.406   7.406
  120    HE1  PHE  15           HE2      PHE  15  10.217   3.688   3.688
  121    HE2  PHE  15           HE1      PHE  15   8.506   7.548   7.548
  122    HZ   PHE  15           HZ       PHE  15   9.101   5.674   5.674
  123    H    GLU  16           H        GLU  16  12.483   4.390   4.390
  124    HA   GLU  16           HA       GLU  16  13.881   2.743   2.743
  125   1HB   GLU  16          2HB       GLU  16  15.767   2.889   2.889
  126   2HB   GLU  16          1HB       GLU  16  15.025   4.458   4.458
  127   1HG   GLU  16          2HG       GLU  16  13.512   3.711   3.711
  128   2HG   GLU  16          1HG       GLU  16  14.969   2.796   2.796
  129    H    GLU  17           H        GLU  17  12.262   1.959   1.959
  130    HA   GLU  17           HA       GLU  17  13.510  -0.554  -0.554
  131   1HB   GLU  17          2HB       GLU  17  10.733   0.441   0.441
  132   2HB   GLU  17          1HB       GLU  17  11.494  -0.981  -0.981
  133   1HG   GLU  17          2HG       GLU  17  13.461   0.754   0.754
  134   2HG   GLU  17          1HG       GLU  17  12.124   1.903   1.903
  135    H    LEU  18           H        LEU  18  10.695   0.367   0.367
  136    HA   LEU  18           HA       LEU  18  10.078  -2.376  -2.376
  137   1HB   LEU  18          2HB       LEU  18   8.339  -0.564  -0.564
  138   2HB   LEU  18          1HB       LEU  18   9.047   0.206   0.206
  139    HG   LEU  18           HG       LEU  18   8.639  -1.877  -1.877
  140   1HD1  LEU  18          3HD1      LEU  18   7.957  -2.856  -2.856
  141   2HD1  LEU  18          2HD1      LEU  18   6.703  -3.213  -3.213
  142   3HD1  LEU  18          1HD1      LEU  18   8.356  -3.762  -3.762
  143   1HD2  LEU  18          1HD2      LEU  18   6.937   0.111   0.111
  144   2HD2  LEU  18          3HD2      LEU  18   6.426  -1.327  -1.327
  145   3HD2  LEU  18          2HD2      LEU  18   6.011  -1.147  -1.147
  146    H    LEU  19           H        LEU  19  12.273   0.027   0.027
  147    HA   LEU  19           HA       LEU  19  12.336  -1.087  -1.087
  148   1HB   LEU  19          2HB       LEU  19  14.118   1.035   1.035
  149   2HB   LEU  19          1HB       LEU  19  13.951   0.668   0.668
  150    HG   LEU  19           HG       LEU  19  12.231   2.324   2.324
  151   1HD1  LEU  19          2HD1      LEU  19  13.656   2.727   2.727
  152   2HD1  LEU  19          1HD1      LEU  19  12.080   2.393   2.393
  153   3HD1  LEU  19          3HD1      LEU  19  12.264   3.707   3.707
  154   1HD2  LEU  19          3HD2      LEU  19  11.024   0.272   0.272
  155   2HD2  LEU  19          2HD2      LEU  19  10.477   0.758   0.758
  156   3HD2  LEU  19          1HD2      LEU  19  10.239   1.830   1.830
  157    H    LYS  20           H        LYS  20  13.916  -1.452  -1.452
  158    HA   LYS  20           HA       LYS  20  16.333  -2.691  -2.691
  159   1HB   LYS  20          2HB       LYS  20  15.370  -2.831  -2.831
  160   2HB   LYS  20          1HB       LYS  20  17.012  -3.063  -3.063
  161   1HG   LYS  20          2HG       LYS  20  16.037  -0.483  -0.483
  162   2HG   LYS  20          1HG       LYS  20  15.812  -0.649  -0.649
  163   1HD   LYS  20          2HD       LYS  20  18.414  -1.179  -1.179
  164   2HD   LYS  20          1HD       LYS  20  18.034   0.302   0.302
  165   1HE   LYS  20          2HE       LYS  20  17.513  -1.341  -1.341
  166   2HE   LYS  20          1HE       LYS  20  18.524  -2.463  -2.463
  167   1HZ   LYS  20          2HZ       LYS  20  20.231  -0.676  -0.676
  168   2HZ   LYS  20          1HZ       LYS  20  19.276   0.224   0.224
  169   3HZ   LYS  20          3HZ       LYS  20  19.915  -1.272  -1.272
  170    H    VAL  21           H        VAL  21  13.179  -3.597  -3.597
  171    HA   VAL  21           HA       VAL  21  13.770  -6.446  -6.446
  172    HB   VAL  21           HB       VAL  21  11.995  -5.315  -5.315
  173   1HG1  VAL  21          3HG1      VAL  21  11.223  -3.772  -3.772
  174   2HG1  VAL  21          2HG1      VAL  21  10.468  -5.135  -5.135
  175   3HG1  VAL  21          1HG1      VAL  21   9.908  -4.639  -4.639
  176   1HG2  VAL  21          3HG2      VAL  21  12.009  -7.803  -7.803
  177   2HG2  VAL  21          2HG2      VAL  21  10.588  -7.174  -7.174
  178   3HG2  VAL  21          1HG2      VAL  21  10.608  -7.267  -7.267
  179    H    LEU  22           H        LEU  22  12.195  -4.253  -4.253
  180    HA   LEU  22           HA       LEU  22  11.332  -6.169  -6.169
  181   1HB   LEU  22          2HB       LEU  22  11.664  -3.240  -3.240
  182   2HB   LEU  22          1HB       LEU  22  11.802  -3.833  -3.833
  183    HG   LEU  22           HG       LEU  22   9.602  -4.833  -4.833
  184   1HD1  LEU  22          2HD1      LEU  22   9.770  -5.531  -5.531
  185   2HD1  LEU  22          1HD1      LEU  22   9.445  -3.860  -3.860
  186   3HD1  LEU  22          3HD1      LEU  22   8.229  -4.788  -4.788
  187   1HD2  LEU  22          3HD2      LEU  22  10.044  -2.224  -2.224
  188   2HD2  LEU  22          2HD2      LEU  22   8.395  -2.844  -2.844
  189   3HD2  LEU  22          1HD2      LEU  22   9.178  -2.201  -2.201
  190    H    GLY  23           H        GLY  23  14.078  -3.969  -3.969
  191   1HA   GLY  23          2HA       GLY  23  15.461  -5.549  -5.549
  192   2HA   GLY  23          1HA       GLY  23  15.855  -3.889  -3.889
  193    H    VAL  24           H        VAL  24  18.020  -4.255  -4.255
  194    HA   VAL  24           HA       VAL  24  18.589  -5.460  -5.460
  195    HB   VAL  24           HB       VAL  24  20.438  -6.887  -6.887
  196   1HG1  VAL  24          3HG1      VAL  24  18.089  -7.711  -7.711
  197   2HG1  VAL  24          2HG1      VAL  24  17.745  -7.649  -7.649
  198   3HG1  VAL  24          1HG1      VAL  24  19.005  -8.721  -8.721
  199   1HG2  VAL  24          2HG2      VAL  24  19.106  -6.038  -6.038
  200   2HG2  VAL  24          1HG2      VAL  24  20.809  -5.901  -5.901
  201   3HG2  VAL  24          3HG2      VAL  24  20.107  -7.486  -7.486
  202    H    ASN  25           H        ASN  25  19.886  -3.886  -3.886
  203    HA   ASN  25           HA       ASN  25  22.382  -3.047  -3.047
  204   1HB   ASN  25          2HB       ASN  25  21.112  -2.770  -2.770
  205   2HB   ASN  25          1HB       ASN  25  20.922  -1.145  -1.145
  206   1HD2  ASN  25          2HD2      ASN  25  24.299  -0.289  -0.289
  207   2HD2  ASN  25          1HD2      ASN  25  22.752   0.232   0.232
  208    H    VAL  26           H        VAL  26  22.561  -0.343  -0.343
  209    HA   VAL  26           HA       VAL  26  20.713   0.499   0.499
  210    HB   VAL  26           HB       VAL  26  22.649   1.893   1.893
  211   1HG1  VAL  26          3HG1      VAL  26  22.419  -1.059  -1.059
  212   2HG1  VAL  26          2HG1      VAL  26  23.963  -0.407  -0.407
  213   3HG1  VAL  26          1HG1      VAL  26  22.465   0.098   0.098
  214   1HG2  VAL  26          3HG2      VAL  26  24.152   0.177   0.177
  215   2HG2  VAL  26          2HG2      VAL  26  24.015   1.934   1.934
  216   3HG2  VAL  26          1HG2      VAL  26  24.918   1.132   1.132
  217    H    MET  27           H        MET  27  22.756   1.642   1.642
  218    HA   MET  27           HA       MET  27  21.752   4.350   4.350
  219   1HB   MET  27          2HB       MET  27  23.885   3.560   3.560
  220   2HB   MET  27          1HB       MET  27  22.863   2.887   2.887
  221   1HG   MET  27          2HG       MET  27  22.242   4.958   4.958
  222   2HG   MET  27          1HG       MET  27  22.373   5.722   5.722
  223   1HE   MET  27          2HE       MET  27  23.009   7.495   7.495
  224   2HE   MET  27          1HE       MET  27  24.471   7.903   7.903
  225   3HE   MET  27          3HE       MET  27  24.513   7.786   7.786
  226    H    LEU  28           H        LEU  28  20.650   1.355   1.355
  227    HA   LEU  28           HA       LEU  28  18.857   2.296   2.296
  228   1HB   LEU  28          2HB       LEU  28  19.288  -0.150  -0.150
  229   2HB   LEU  28          1HB       LEU  28  17.630   0.065   0.065
  230    HG   LEU  28           HG       LEU  28  18.928  -1.208  -1.208
  231   1HD1  LEU  28          2HD1      LEU  28  17.199   0.749   0.749
  232   2HD1  LEU  28          1HD1      LEU  28  18.629   1.455   1.455
  233   3HD1  LEU  28          3HD1      LEU  28  18.048  -0.127  -0.127
  234   1HD2  LEU  28          1HD2      LEU  28  20.665   1.280   1.280
  235   2HD2  LEU  28          3HD2      LEU  28  21.150  -0.314  -0.314
  236   3HD2  LEU  28          2HD2      LEU  28  20.788  -0.069  -0.069
  237    H    ARG  29           H        ARG  29  18.173   1.504   1.504
  238    HA   ARG  29           HA       ARG  29  15.443   2.266   2.266
  239   1HB   ARG  29          2HB       ARG  29  17.274   2.587   2.587
  240   2HB   ARG  29          1HB       ARG  29  15.545   2.273   2.273
  241   1HG   ARG  29          2HG       ARG  29  15.944   0.052   0.052
  242   2HG   ARG  29          1HG       ARG  29  16.786   0.197   0.197
  243   1HD   ARG  29          2HD       ARG  29  18.173  -0.788  -0.788
  244   2HD   ARG  29          1HD       ARG  29  18.882   0.619   0.619
  245    HE   ARG  29           HE       ARG  29  17.313   1.016   1.016
  246   1HH1  ARG  29          1HH2      ARG  29  18.626   3.391   3.391
  247   2HH1  ARG  29          2HH2      ARG  29  20.187   3.333   3.333
  248   1HH2  ARG  29          2HH1      ARG  29  20.039  -0.065  -0.065
  249   2HH2  ARG  29          1HH1      ARG  29  20.982   1.380   1.380
  250    H    LYS  30           H        LYS  30  18.360   4.178   4.178
  251    HA   LYS  30           HA       LYS  30  17.072   6.545   6.545
  252   1HB   LYS  30          2HB       LYS  30  19.621   5.878   5.878
  253   2HB   LYS  30          1HB       LYS  30  19.562   6.702   6.702
  254   1HG   LYS  30          2HG       LYS  30  19.265   8.762   8.762
  255   2HG   LYS  30          1HG       LYS  30  18.275   8.129   8.129
  256   1HD   LYS  30          2HD       LYS  30  21.138   7.317   7.317
  257   2HD   LYS  30          1HD       LYS  30  20.796   9.001   9.001
  258   1HE   LYS  30          2HE       LYS  30  19.413   8.392   8.392
  259   2HE   LYS  30          1HE       LYS  30  19.334   6.709   6.709
  260   1HZ   LYS  30          3HZ       LYS  30  21.893   8.008   8.008
  261   2HZ   LYS  30          2HZ       LYS  30  20.915   7.253   7.253
  262   3HZ   LYS  30          1HZ       LYS  30  21.553   6.351   6.351
  263    H    ILE  31           H        ILE  31  17.539   5.285   5.285
  264    HA   ILE  31           HA       ILE  31  16.833   7.803   7.803
  265    HB   ILE  31           HB       ILE  31  16.921   4.960   4.960
  266   1HG1  ILE  31          2HG1      ILE  31  18.930   7.045   7.045
  267   2HG1  ILE  31          1HG1      ILE  31  19.029   6.374   6.374
  268   1HG2  ILE  31          3HG2      ILE  31  16.754   7.649   7.649
  269   2HG2  ILE  31          2HG2      ILE  31  17.015   6.102   6.102
  270   3HG2  ILE  31          1HG2      ILE  31  15.495   6.414   6.414
  271   1HD1  ILE  31          1HD1      ILE  31  18.723   4.079   4.079
  272   2HD1  ILE  31          3HD1      ILE  31  19.451   5.032   5.032
  273   3HD1  ILE  31          2HD1      ILE  31  20.311   4.811   4.811
  274    H    ALA  32           H        ALA  32  15.130   5.014   5.014
  275    HA   ALA  32           HA       ALA  32  12.625   5.658   5.658
  276   1HB   ALA  32          1HB       ALA  32  13.583   3.561   3.561
  277   2HB   ALA  32          3HB       ALA  32  11.856   3.916   3.916
  278   3HB   ALA  32          2HB       ALA  32  12.649   3.394   3.394
  279    H    VAL  33           H        VAL  33  14.204   6.505   6.505
  280    HA   VAL  33           HA       VAL  33  11.768   7.370   7.370
  281    HB   VAL  33           HB       VAL  33  14.593   8.192   8.192
  282   1HG1  VAL  33          3HG1      VAL  33  12.665   9.222   9.222
  283   2HG1  VAL  33          2HG1      VAL  33  12.137   7.613   7.613
  284   3HG1  VAL  33          1HG1      VAL  33  13.674   8.254   8.254
  285   1HG2  VAL  33          1HG2      VAL  33  13.555   5.488   5.488
  286   2HG2  VAL  33          3HG2      VAL  33  15.160   6.033   6.033
  287   3HG2  VAL  33          2HG2      VAL  33  13.869   5.922   5.922
  288    H    ALA  34           H        ALA  34  14.501   8.813   8.813
  289    HA   ALA  34           HA       ALA  34  13.635  11.544  11.544
  290   1HB   ALA  34          3HB       ALA  34  15.972  10.878  10.878
  291   2HB   ALA  34          2HB       ALA  34  15.378  10.306  10.306
  292   3HB   ALA  34          1HB       ALA  34  15.284  12.020  12.020
  293    H    ALA  35           H        ALA  35  13.152   8.995   8.995
  294    HA   ALA  35           HA       ALA  35  11.790  10.496  10.496
  295   1HB   ALA  35          3HB       ALA  35  11.515   7.586   7.586
  296   2HB   ALA  35          2HB       ALA  35  10.863   8.265   8.265
  297   3HB   ALA  35          1HB       ALA  35  12.607   8.220   8.220
  298    H    ALA  36           H        ALA  36  10.535   8.582   8.582
  299    HA   ALA  36           HA       ALA  36   7.800   9.562   9.562
  300   1HB   ALA  36          2HB       ALA  36   9.133   7.652   7.652
  301   2HB   ALA  36          1HB       ALA  36   7.509   8.249   8.249
  302   3HB   ALA  36          3HB       ALA  36   7.824   7.346   7.346
  303    H    SER  37           H        SER  37   9.410  11.798  11.798
  304    HA   SER  37           HA       SER  37   9.662  12.540  12.540
  305   1HB   SER  37          2HB       SER  37  10.529  13.682  13.682
  306   2HB   SER  37          1HB       SER  37   9.050  14.620  14.620
  307    HG   SER  37           HG       SER  37  11.130  15.318  15.318
  308    H    LYS  38           H        LYS  38   7.044  12.683  12.683
  309    HA   LYS  38           HA       LYS  38   5.047  12.930  12.930
  310   1HB   LYS  38          2HB       LYS  38   4.054  15.040  15.040
  311   2HB   LYS  38          1HB       LYS  38   5.639  15.299  15.299
  312   1HG   LYS  38          2HG       LYS  38   6.345  16.200  16.200
  313   2HG   LYS  38          1HG       LYS  38   6.118  14.637  14.637
  314   1HD   LYS  38          2HD       LYS  38   4.177  15.277  15.277
  315   2HD   LYS  38          1HD       LYS  38   3.629  16.175  16.175
  316   1HE   LYS  38          2HE       LYS  38   4.764  18.114  18.114
  317   2HE   LYS  38          1HE       LYS  38   5.931  17.233  17.233
  318   1HZ   LYS  38          3HZ       LYS  38   4.144  16.732  16.732
  319   2HZ   LYS  38          2HZ       LYS  38   3.057  17.642  17.642
  320   3HZ   LYS  38          1HZ       LYS  38   4.370  18.404  18.404
  321    HA   PRO  39           HA       PRO  39   4.030  10.817  10.817
  322   1HB   PRO  39          2HB       PRO  39   3.358   8.398   8.398
  323   2HB   PRO  39          1HB       PRO  39   4.992   8.824   8.824
  324   1HG   PRO  39          2HG       PRO  39   3.905   8.663   8.663
  325   2HG   PRO  39          1HG       PRO  39   5.564   8.422   8.422
  326   1HD   PRO  39          2HD       PRO  39   4.596  10.748  10.748
  327   2HD   PRO  39          1HD       PRO  39   6.103  10.624  10.624
  328    H    ALA  40           H        ALA  40   1.967  10.702  10.702
  329    HA   ALA  40           HA       ALA  40  -0.262  11.318  11.318
  330   1HB   ALA  40          3HB       ALA  40   0.195  12.695  12.695
  331   2HB   ALA  40          2HB       ALA  40  -0.308  11.283  11.283
  332   3HB   ALA  40          1HB       ALA  40  -1.450  12.077  12.077
  333    H    VAL  41           H        VAL  41  -2.416  10.287  10.287
  334    HA   VAL  41           HA       VAL  41  -2.128   7.564   7.564
  335    HB   VAL  41           HB       VAL  41  -2.949   8.181   8.181
  336   1HG1  VAL  41          2HG1      VAL  41  -3.362   5.637   5.637
  337   2HG1  VAL  41          1HG1      VAL  41  -3.501   5.740   5.740
  338   3HG1  VAL  41          3HG1      VAL  41  -4.615   6.643   6.643
  339   1HG2  VAL  41          1HG2      VAL  41  -0.847   6.422   6.422
  340   2HG2  VAL  41          3HG2      VAL  41  -0.593   7.821   7.821
  341   3HG2  VAL  41          2HG2      VAL  41  -1.276   6.339   6.339
  342    H    GLU  42           H        GLU  42  -4.352   6.595   6.595
  343    HA   GLU  42           HA       GLU  42  -6.614   8.492   8.492
  344   1HB   GLU  42          2HB       GLU  42  -5.575   9.024   9.024
  345   2HB   GLU  42          1HB       GLU  42  -5.662   7.323   7.323
  346   1HG   GLU  42          2HG       GLU  42  -8.165   7.460   7.460
  347   2HG   GLU  42          1HG       GLU  42  -7.986   9.198   9.198
  348    H    ILE  43           H        ILE  43  -8.022   7.190   7.190
  349    HA   ILE  43           HA       ILE  43  -8.069   4.295   4.295
  350    HB   ILE  43           HB       ILE  43  -9.182   5.923   5.923
  351   1HG1  ILE  43          2HG1      ILE  43  -7.574   3.655   3.655
  352   2HG1  ILE  43          1HG1      ILE  43  -6.719   4.540   4.540
  353   1HG2  ILE  43          2HG2      ILE  43  -9.889   3.178   3.178
  354   2HG2  ILE  43          1HG2      ILE  43  -9.586   3.385   3.385
  355   3HG2  ILE  43          3HG2      ILE  43 -10.839   4.338   4.338
  356   1HD1  ILE  43          3HD1      ILE  43  -7.950   6.234   6.234
  357   2HD1  ILE  43          2HD1      ILE  43  -6.644   5.195   5.195
  358   3HD1  ILE  43          1HD1      ILE  43  -6.354   6.339   6.339
  359    H    LYS  44           H        LYS  44  -9.797   3.313   3.313
  360    HA   LYS  44           HA       LYS  44 -12.146   5.014   5.014
  361   1HB   LYS  44          2HB       LYS  44 -11.652   2.540   2.540
  362   2HB   LYS  44          1HB       LYS  44 -12.178   4.126   4.126
  363   1HG   LYS  44          2HG       LYS  44  -9.856   4.963   4.963
  364   2HG   LYS  44          1HG       LYS  44  -9.328   3.399   3.399
  365   1HD   LYS  44          2HD       LYS  44  -9.778   2.321   2.321
  366   2HD   LYS  44          1HD       LYS  44 -10.763   3.665   3.665
  367   1HE   LYS  44          2HE       LYS  44  -8.843   5.081   5.081
  368   2HE   LYS  44          1HE       LYS  44  -7.811   3.935   3.935
  369   1HZ   LYS  44          1HZ       LYS  44  -8.276   2.324   2.324
  370   2HZ   LYS  44          3HZ       LYS  44  -9.101   3.541   3.541
  371   3HZ   LYS  44          2HZ       LYS  44  -7.439   3.703   3.703
  372    H    GLN  45           H        GLN  45 -13.768   4.412   4.412
  373    HA   GLN  45           HA       GLN  45 -13.870   1.573   1.573
  374   1HB   GLN  45          2HB       GLN  45 -13.959   3.305   3.305
  375   2HB   GLN  45          1HB       GLN  45 -15.418   3.974   3.974
  376   1HG   GLN  45          2HG       GLN  45 -16.639   1.919   1.919
  377   2HG   GLN  45          1HG       GLN  45 -15.180   1.115   1.115
  378   1HE2  GLN  45          2HE2      GLN  45 -16.334   2.033   2.033
  379   2HE2  GLN  45          1HE2      GLN  45 -16.124   0.752   0.752
  380    H    GLU  46           H        GLU  46 -15.109   0.247   0.247
  381    HA   GLU  46           HA       GLU  46 -17.706   1.309   1.309
  382   1HB   GLU  46          2HB       GLU  46 -15.675  -0.529  -0.529
  383   2HB   GLU  46          1HB       GLU  46 -17.377  -0.698  -0.698
  384   1HG   GLU  46          2HG       GLU  46 -17.475   1.391   1.391
  385   2HG   GLU  46          1HG       GLU  46 -16.156   2.037   2.037
  386    H    GLY  47           H        GLY  47 -17.988   0.526   0.526
  387   1HA   GLY  47          2HA       GLY  47 -19.452  -0.953  -0.953
  388   2HA   GLY  47          1HA       GLY  47 -19.320  -2.108  -2.108
  389    H    ASP  48           H        ASP  48 -18.371  -3.947  -3.947
  390    HA   ASP  48           HA       ASP  48 -16.460  -3.871  -3.871
  391   1HB   ASP  48          2HB       ASP  48 -16.214  -6.346  -6.346
  392   2HB   ASP  48          1HB       ASP  48 -17.810  -5.837  -5.837
  393    H    THR  49           H        THR  49 -16.085  -3.091  -3.091
  394    HA   THR  49           HA       THR  49 -13.460  -4.413  -4.413
  395    HB   THR  49           HB       THR  49 -15.288  -2.915  -2.915
  396    HG1  THR  49           HG1      THR  49 -15.783  -4.962  -4.962
  397   1HG2  THR  49          2HG2      THR  49 -12.365  -3.548  -3.548
  398   2HG2  THR  49          1HG2      THR  49 -13.455  -3.480  -3.480
  399   3HG2  THR  49          3HG2      THR  49 -13.224  -2.053  -2.053
  400    H    PHE  50           H        PHE  50 -11.546  -3.232  -3.232
  401    HA   PHE  50           HA       PHE  50 -11.734  -0.287  -0.287
  402   1HB   PHE  50          2HB       PHE  50 -10.177  -2.133  -2.133
  403   2HB   PHE  50          1HB       PHE  50 -10.074  -0.372  -0.372
  404    HD1  PHE  50           HD1      PHE  50 -12.218  -3.281  -3.281
  405    HD2  PHE  50           HD2      PHE  50 -11.909   0.993   0.993
  406    HE1  PHE  50           HE1      PHE  50 -14.265  -3.187  -3.187
  407    HE2  PHE  50           HE2      PHE  50 -13.950   1.092   1.092
  408    HZ   PHE  50           HZ       PHE  50 -15.137  -1.001  -1.001
  409    H    TYR  51           H        TYR  51 -10.467   0.574   0.574
  410    HA   TYR  51           HA       TYR  51  -8.150  -0.942  -0.942
  411   1HB   TYR  51          2HB       TYR  51  -9.878  -0.180  -0.180
  412   2HB   TYR  51          1HB       TYR  51  -9.677   1.471   1.471
  413    HD1  TYR  51           HD1      TYR  51  -7.173   2.374   2.374
  414    HD2  TYR  51           HD2      TYR  51  -8.710  -0.866  -0.866
  415    HE1  TYR  51           HE1      TYR  51  -5.391   2.733   2.733
  416    HE2  TYR  51           HE2      TYR  51  -6.927  -0.494  -0.494
  417    HH   TYR  51           HH       TYR  51  -5.207   2.207   2.207
  418    H    ILE  52           H        ILE  52  -6.066  -0.030  -0.030
  419    HA   ILE  52           HA       ILE  52  -5.974   2.577   2.577
  420    HB   ILE  52           HB       ILE  52  -3.721   0.658   0.658
  421   1HG1  ILE  52          2HG1      ILE  52  -5.819  -0.748  -0.748
  422   2HG1  ILE  52          1HG1      ILE  52  -4.804  -0.646  -0.646
  423   1HG2  ILE  52          1HG2      ILE  52  -3.759   2.932   2.932
  424   2HG2  ILE  52          3HG2      ILE  52  -5.196   2.493   2.493
  425   3HG2  ILE  52          2HG2      ILE  52  -3.664   1.677   1.677
  426   1HD1  ILE  52          1HD1      ILE  52  -6.291   1.108   1.108
  427   2HD1  ILE  52          3HD1      ILE  52  -7.306   0.982   0.982
  428   3HD1  ILE  52          2HD1      ILE  52  -7.175  -0.382  -0.382
  429    H    LYS  53           H        LYS  53  -5.044   4.112   4.112
  430    HA   LYS  53           HA       LYS  53  -2.974   3.224   3.224
  431   1HB   LYS  53          2HB       LYS  53  -5.314   4.495   4.495
  432   2HB   LYS  53          1HB       LYS  53  -4.269   5.887   5.887
  433   1HG   LYS  53          2HG       LYS  53  -2.598   4.574   4.574
  434   2HG   LYS  53          1HG       LYS  53  -4.044   3.710   3.710
  435   1HD   LYS  53          2HD       LYS  53  -5.126   5.889   5.889
  436   2HD   LYS  53          1HD       LYS  53  -3.629   6.712   6.712
  437   1HE   LYS  53          2HE       LYS  53  -2.659   4.884   4.884
  438   2HE   LYS  53          1HE       LYS  53  -4.273   5.123   5.123
  439   1HZ   LYS  53          3HZ       LYS  53  -2.386   7.315   7.315
  440   2HZ   LYS  53          2HZ       LYS  53  -2.613   6.679   6.679
  441   3HZ   LYS  53          1HZ       LYS  53  -3.890   7.472   7.472
  442    H    THR  54           H        THR  54  -1.045   3.637   3.637
  443    HA   THR  54           HA       THR  54  -0.802   6.280   6.280
  444    HB   THR  54           HB       THR  54   1.181   3.988   3.988
  445    HG1  THR  54           HG1      THR  54  -0.503   3.076   3.076
  446   1HG2  THR  54          2HG2      THR  54   1.240   6.643   6.643
  447   2HG2  THR  54          1HG2      THR  54   0.997   5.599   5.599
  448   3HG2  THR  54          3HG2      THR  54   2.384   5.346   5.346
  449    H    SER  55           H        SER  55   0.807   7.765   7.765
  450    HA   SER  55           HA       SER  55   2.538   7.013   7.013
  451   1HB   SER  55          2HB       SER  55   1.766   9.434   9.434
  452   2HB   SER  55          1HB       SER  55   0.946   7.950   7.950
  453    HG   SER  55           HG       SER  55  -0.504   9.553   9.553
  454    H    THR  56           H        THR  56   4.540   7.770   7.770
  455    HA   THR  56           HA       THR  56   4.929   9.900   9.900
  456    HB   THR  56           HB       THR  56   7.357   9.099   9.099
  457    HG1  THR  56           HG1      THR  56   7.692   7.185   7.185
  458   1HG2  THR  56          2HG2      THR  56   5.023   7.673   7.673
  459   2HG2  THR  56          1HG2      THR  56   6.439   6.646   6.646
  460   3HG2  THR  56          3HG2      THR  56   6.547   8.089   8.089
  461    H    THR  57           H        THR  57   7.705   9.869   9.869
  462    HA   THR  57           HA       THR  57   6.688  12.158  12.158
  463    HB   THR  57           HB       THR  57   8.952  13.004  13.004
  464    HG1  THR  57           HG1      THR  57  10.605  11.759  11.759
  465   1HG2  THR  57          1HG2      THR  57   7.643  13.429  13.429
  466   2HG2  THR  57          3HG2      THR  57   8.259  11.933  11.933
  467   3HG2  THR  57          2HG2      THR  57   9.360  13.269  13.269
  468    H    VAL  58           H        VAL  58   8.579   9.192   9.192
  469    HA   VAL  58           HA       VAL  58   8.420   9.177   9.177
  470    HB   VAL  58           HB       VAL  58  10.593   7.961   7.961
  471   1HG1  VAL  58          2HG1      VAL  58  10.002   8.131   8.131
  472   2HG1  VAL  58          1HG1      VAL  58  11.688   8.182   8.182
  473   3HG1  VAL  58          3HG1      VAL  58  10.682   6.794   6.794
  474   1HG2  VAL  58          1HG2      VAL  58  10.261  10.676  10.676
  475   2HG2  VAL  58          3HG2      VAL  58  11.136  10.186  10.186
  476   3HG2  VAL  58          2HG2      VAL  58  11.854   9.932   9.932
  477    H    ARG  59           H        ARG  59   7.404   7.621   7.621
  478    HA   ARG  59           HA       ARG  59   7.145   5.011   5.011
  479   1HB   ARG  59          2HB       ARG  59   8.488   5.004   5.004
  480   2HB   ARG  59          1HB       ARG  59   7.025   5.494   5.494
  481   1HG   ARG  59          2HG       ARG  59   5.936   3.469   3.469
  482   2HG   ARG  59          1HG       ARG  59   6.947   3.097   3.097
  483   1HD   ARG  59          2HD       ARG  59   8.402   3.357   3.357
  484   2HD   ARG  59          1HD       ARG  59   7.308   1.979   1.979
  485    HE   ARG  59           HE       ARG  59   9.817   2.237   2.237
  486   1HH1  ARG  59          2HH1      ARG  59   9.192   1.826   1.826
  487   2HH1  ARG  59          1HH1      ARG  59   8.414   0.291   0.291
  488   1HH2  ARG  59          1HH2      ARG  59   7.675  -0.060  -0.060
  489   2HH2  ARG  59          2HH2      ARG  59   7.555  -0.777  -0.777
  490    H    THR  60           H        THR  60   5.124   3.785   3.785
  491    HA   THR  60           HA       THR  60   2.863   5.266   5.266
  492    HB   THR  60           HB       THR  60   2.760   4.487   4.487
  493    HG1  THR  60           HG1      THR  60   3.155   6.600   6.600
  494   1HG2  THR  60          3HG2      THR  60   0.739   4.978   4.978
  495   2HG2  THR  60          2HG2      THR  60   1.010   6.588   6.588
  496   3HG2  THR  60          1HG2      THR  60   0.611   5.248   5.248
  497    H    THR  61           H        THR  61   2.238   3.525   3.525
  498    HA   THR  61           HA       THR  61   2.129   0.821   0.821
  499    HB   THR  61           HB       THR  61   1.434   0.244   0.244
  500    HG1  THR  61           HG1      THR  61   1.136   2.055   2.055
  501   1HG2  THR  61          2HG2      THR  61   3.666  -0.167  -0.167
  502   2HG2  THR  61          1HG2      THR  61   4.210   1.361   1.361
  503   3HG2  THR  61          3HG2      THR  61   3.741   0.030   0.030
  504    H    GLU  62           H        GLU  62   0.144  -0.441  -0.441
  505    HA   GLU  62           HA       GLU  62  -2.350   1.021   1.021
  506   1HB   GLU  62          2HB       GLU  62  -1.565   0.082   0.082
  507   2HB   GLU  62          1HB       GLU  62  -3.256   0.221   0.221
  508   1HG   GLU  62          2HG       GLU  62  -3.075   2.388   2.388
  509   2HG   GLU  62          1HG       GLU  62  -2.208   2.624   2.624
  510    H    ILE  63           H        ILE  63  -3.920  -0.378  -0.378
  511    HA   ILE  63           HA       ILE  63  -3.635  -3.279  -3.279
  512    HB   ILE  63           HB       ILE  63  -3.740  -3.970  -3.970
  513   1HG1  ILE  63          2HG1      ILE  63  -3.858  -1.021  -1.021
  514   2HG1  ILE  63          1HG1      ILE  63  -5.211  -2.144  -2.144
  515   1HG2  ILE  63          1HG2      ILE  63  -1.530  -3.285  -3.285
  516   2HG2  ILE  63          3HG2      ILE  63  -1.721  -1.725  -1.725
  517   3HG2  ILE  63          2HG2      ILE  63  -1.598  -3.199  -3.199
  518   1HD1  ILE  63          2HD1      ILE  63  -2.947  -3.298  -3.298
  519   2HD1  ILE  63          1HD1      ILE  63  -3.250  -1.678  -1.678
  520   3HD1  ILE  63          3HD1      ILE  63  -4.535  -2.884  -2.884
  521    H    ASN  64           H        ASN  64  -5.652  -4.476  -4.476
  522    HA   ASN  64           HA       ASN  64  -8.037  -2.901  -2.901
  523   1HB   ASN  64          2HB       ASN  64  -8.924  -4.345  -4.345
  524   2HB   ASN  64          1HB       ASN  64  -8.819  -2.605  -2.605
  525   1HD2  ASN  64          2HD2      ASN  64  -5.572  -4.396  -4.396
  526   2HD2  ASN  64          1HD2      ASN  64  -6.286  -5.141  -5.141
  527    H    PHE  65           H        PHE  65  -9.543  -4.207  -4.207
  528    HA   PHE  65           HA       PHE  65  -9.603  -7.102  -7.102
  529   1HB   PHE  65          2HB       PHE  65  -8.875  -7.785  -7.785
  530   2HB   PHE  65          1HB       PHE  65  -7.606  -6.848  -6.848
  531    HD1  PHE  65           HD2      PHE  65  -7.136  -4.524  -4.524
  532    HD2  PHE  65           HD1      PHE  65 -10.096  -6.925  -6.925
  533    HE1  PHE  65           HE2      PHE  65  -7.208  -2.897  -2.897
  534    HE2  PHE  65           HE1      PHE  65 -10.182  -5.302  -5.302
  535    HZ   PHE  65           HZ       PHE  65  -8.744  -3.279  -3.279
  536    H    LYS  66           H        LYS  66 -10.827  -8.105  -8.105
  537    HA   LYS  66           HA       LYS  66 -13.135  -6.342  -6.342
  538   1HB   LYS  66          2HB       LYS  66 -14.557  -8.465  -8.465
  539   2HB   LYS  66          1HB       LYS  66 -14.043  -7.788  -7.788
  540   1HG   LYS  66          2HG       LYS  66 -12.083  -9.386  -9.386
  541   2HG   LYS  66          1HG       LYS  66 -12.824 -10.144 -10.144
  542   1HD   LYS  66          2HD       LYS  66 -13.924 -11.449 -11.449
  543   2HD   LYS  66          1HD       LYS  66 -14.938 -10.036 -10.036
  544   1HE   LYS  66          2HE       LYS  66 -12.800  -9.465  -9.465
  545   2HE   LYS  66          1HE       LYS  66 -12.851 -11.224 -11.224
  546   1HZ   LYS  66          2HZ       LYS  66 -15.379 -10.802 -10.802
  547   2HZ   LYS  66          1HZ       LYS  66 -14.876  -9.249  -9.249
  548   3HZ   LYS  66          3HZ       LYS  66 -14.316 -10.610 -10.610
  549    H    VAL  67           H        VAL  67 -14.078  -6.908  -6.908
  550    HA   VAL  67           HA       VAL  67 -12.026  -8.010  -8.010
  551    HB   VAL  67           HB       VAL  67 -14.686  -7.426  -7.426
  552   1HG1  VAL  67          3HG1      VAL  67 -11.781  -6.924  -6.924
  553   2HG1  VAL  67          2HG1      VAL  67 -13.000  -5.962  -5.962
  554   3HG1  VAL  67          1HG1      VAL  67 -12.992  -7.718  -7.718
  555   1HG2  VAL  67          2HG2      VAL  67 -13.197  -5.418  -5.418
  556   2HG2  VAL  67          1HG2      VAL  67 -14.928  -5.554  -5.554
  557   3HG2  VAL  67          3HG2      VAL  67 -13.866  -4.885  -4.885
  558    H    GLY  68           H        GLY  68 -11.946 -10.250 -10.250
  559   1HA   GLY  68          2HA       GLY  68 -13.241 -12.107 -12.107
  560   2HA   GLY  68          1HA       GLY  68 -14.463 -11.797 -11.797
  561    H    GLU  69           H        GLU  69 -12.385 -11.338 -11.338
  562    HA   GLU  69           HA       GLU  69 -11.591 -14.209 -14.209
  563   1HB   GLU  69          2HB       GLU  69 -12.235 -12.151 -12.151
  564   2HB   GLU  69          1HB       GLU  69 -11.831 -13.844 -13.844
  565   1HG   GLU  69          2HG       GLU  69 -13.838 -14.273 -14.273
  566   2HG   GLU  69          1HG       GLU  69 -14.333 -12.661 -12.661
  567    H    GLU  70           H        GLU  70  -9.567 -14.595 -14.595
  568    HA   GLU  70           HA       GLU  70  -7.521 -12.585 -12.585
  569   1HB   GLU  70          2HB       GLU  70  -7.174 -15.274 -15.274
  570   2HB   GLU  70          1HB       GLU  70  -5.918 -14.311 -14.311
  571   1HG   GLU  70          2HG       GLU  70  -6.945 -14.619 -14.619
  572   2HG   GLU  70          1HG       GLU  70  -8.339 -15.419 -15.419
  573    H    PHE  71           H        PHE  71  -5.812 -12.111 -12.111
  574    HA   PHE  71           HA       PHE  71  -6.712 -12.264 -12.264
  575   1HB   PHE  71          2HB       PHE  71  -6.789  -9.758  -9.758
  576   2HB   PHE  71          1HB       PHE  71  -8.111 -10.413 -10.413
  577    HD1  PHE  71           HD2      PHE  71  -7.915 -10.376 -10.376
  578    HD2  PHE  71           HD1      PHE  71  -5.245  -8.207  -8.207
  579    HE1  PHE  71           HE2      PHE  71  -7.214  -8.965  -8.965
  580    HE2  PHE  71           HE1      PHE  71  -4.539  -6.802  -6.802
  581    HZ   PHE  71           HZ       PHE  71  -5.522  -7.180  -7.180
  582    H    GLU  72           H        GLU  72  -5.188 -10.799 -10.799
  583    HA   GLU  72           HA       GLU  72  -2.459 -11.047 -11.047
  584   1HB   GLU  72          2HB       GLU  72  -2.935 -10.517 -10.517
  585   2HB   GLU  72          1HB       GLU  72  -1.572 -11.305 -11.305
  586   1HG   GLU  72          2HG       GLU  72  -3.073 -13.217 -13.217
  587   2HG   GLU  72          1HG       GLU  72  -4.354 -12.456 -12.456
  588    H    GLU  73           H        GLU  73  -1.121  -9.230  -9.230
  589    HA   GLU  73           HA       GLU  73  -1.934  -6.707  -6.707
  590   1HB   GLU  73          2HB       GLU  73  -2.053  -5.488  -5.488
  591   2HB   GLU  73          1HB       GLU  73  -3.382  -6.623  -6.623
  592   1HG   GLU  73          2HG       GLU  73  -2.645  -8.039  -8.039
  593   2HG   GLU  73          1HG       GLU  73  -0.945  -7.704  -7.704
  594    H    GLN  74           H        GLN  74  -0.384  -4.926  -4.926
  595    HA   GLN  74           HA       GLN  74   2.342  -6.165  -6.165
  596   1HB   GLN  74          2HB       GLN  74   1.202  -3.466  -3.466
  597   2HB   GLN  74          1HB       GLN  74   2.862  -3.519  -3.519
  598   1HG   GLN  74          2HG       GLN  74   3.415  -5.178  -5.178
  599   2HG   GLN  74          1HG       GLN  74   1.773  -5.024  -5.024
  600   1HE2  GLN  74          2HE2      GLN  74   4.434  -1.950  -1.950
  601   2HE2  GLN  74          1HE2      GLN  74   4.757  -3.129  -3.129
  602    H    THR  75           H        THR  75   3.968  -5.500  -5.500
  603    HA   THR  75           HA       THR  75   2.751  -5.093  -5.093
  604    HB   THR  75           HB       THR  75   4.370  -6.981  -6.981
  605    HG1  THR  75           HG1      THR  75   5.176  -6.853  -6.853
  606   1HG2  THR  75          2HG2      THR  75   5.969  -4.849  -4.849
  607   2HG2  THR  75          1HG2      THR  75   6.767  -5.479  -5.479
  608   3HG2  THR  75          3HG2      THR  75   6.390  -6.557  -6.557
  609    H    VAL  76           H        VAL  76   5.531  -3.976  -3.976
  610    HA   VAL  76           HA       VAL  76   4.914  -1.181  -1.181
  611    HB   VAL  76           HB       VAL  76   6.462  -2.146  -2.146
  612   1HG1  VAL  76          1HG1      VAL  76   5.522   0.520   0.520
  613   2HG1  VAL  76          3HG1      VAL  76   5.668   0.253   0.253
  614   3HG1  VAL  76          2HG1      VAL  76   7.082   0.083   0.083
  615   1HG2  VAL  76          1HG2      VAL  76   4.037  -2.862  -2.862
  616   2HG2  VAL  76          3HG2      VAL  76   4.451  -1.802  -1.802
  617   3HG2  VAL  76          2HG2      VAL  76   3.603  -1.153  -1.153
  618    H    ASP  77           H        ASP  77   7.424  -3.609  -3.609
  619    HA   ASP  77           HA       ASP  77   9.514  -1.637  -1.637
  620   1HB   ASP  77          2HB       ASP  77  10.920  -3.705  -3.705
  621   2HB   ASP  77          1HB       ASP  77  10.251  -3.541  -3.541
  622    H    GLY  78           H        GLY  78   7.657  -4.125  -4.125
  623   1HA   GLY  78          2HA       GLY  78   7.051  -3.249  -3.249
  624   2HA   GLY  78          1HA       GLY  78   8.800  -3.199  -3.199
  625    H    ARG  79           H        ARG  79   6.792  -5.624  -5.624
  626    HA   ARG  79           HA       ARG  79   7.703  -7.640  -7.640
  627   1HB   ARG  79          2HB       ARG  79   7.835  -7.651  -7.651
  628   2HB   ARG  79          1HB       ARG  79   7.664  -9.168  -9.168
  629   1HG   ARG  79          2HG       ARG  79   9.645  -8.123  -8.123
  630   2HG   ARG  79          1HG       ARG  79   9.948  -7.257  -7.257
  631   1HD   ARG  79          2HD       ARG  79  11.236  -9.333  -9.333
  632   2HD   ARG  79          1HD       ARG  79   9.975  -9.426  -9.426
  633    HE   ARG  79           HE       ARG  79   8.772 -10.515 -10.515
  634   1HH1  ARG  79          1HH2      ARG  79  10.487 -11.630 -11.630
  635   2HH1  ARG  79          2HH2      ARG  79  11.131 -13.043 -13.043
  636   1HH2  ARG  79          2HH1      ARG  79  10.133 -12.087 -12.087
  637   2HH2  ARG  79          1HH1      ARG  79  10.931 -13.301 -13.301
  638    HA   PRO  80           HA       PRO  80   3.393  -8.671  -8.671
  639   1HB   PRO  80          2HB       PRO  80   3.533 -11.259 -11.259
  640   2HB   PRO  80          1HB       PRO  80   3.751  -9.832  -9.832
  641   1HG   PRO  80          2HG       PRO  80   5.798 -11.744 -11.744
  642   2HG   PRO  80          1HG       PRO  80   5.832 -10.737 -10.737
  643   1HD   PRO  80          2HD       PRO  80   7.190 -10.194 -10.194
  644   2HD   PRO  80          1HD       PRO  80   6.941  -9.050  -9.050
  645    H    CYS  81           H        CYS  81   1.918  -9.620  -9.620
  646    HA   CYS  81           HA       CYS  81   2.588 -11.967 -11.967
  647   1HB   CYS  81          2HB       CYS  81   2.241 -10.735 -10.735
  648   2HB   CYS  81          1HB       CYS  81   3.754 -10.352 -10.352
  649    HG   CYS  81           HG       CYS  81   2.763  -8.075  -8.075
  650    H    LYS  82           H        LYS  82   0.717 -12.931 -12.931
  651    HA   LYS  82           HA       LYS  82  -1.835 -11.698 -11.698
  652   1HB   LYS  82          2HB       LYS  82  -1.491 -14.059 -14.059
  653   2HB   LYS  82          1HB       LYS  82  -1.197 -14.441 -14.441
  654   1HG   LYS  82          2HG       LYS  82  -3.391 -14.895 -14.895
  655   2HG   LYS  82          1HG       LYS  82  -3.653 -13.157 -13.157
  656   1HD   LYS  82          2HD       LYS  82  -4.990 -13.889 -13.889
  657   2HD   LYS  82          1HD       LYS  82  -3.473 -13.571 -13.571
  658   1HE   LYS  82          2HE       LYS  82  -3.012 -16.113 -16.113
  659   2HE   LYS  82          1HE       LYS  82  -4.771 -16.169 -16.169
  660   1HZ   LYS  82          2HZ       LYS  82  -4.384 -14.997 -14.997
  661   2HZ   LYS  82          1HZ       LYS  82  -2.798 -15.591 -15.591
  662   3HZ   LYS  82          3HZ       LYS  82  -4.106 -16.670 -16.670
  663    H    SER  83           H        SER  83  -2.739 -10.363 -10.363
  664    HA   SER  83           HA       SER  83  -2.178 -10.811 -10.811
  665   1HB   SER  83          2HB       SER  83  -1.904  -8.568  -8.568
  666   2HB   SER  83          1HB       SER  83  -3.621  -8.422  -8.422
  667    HG   SER  83           HG       SER  83  -1.847  -7.651  -7.651
  668    H    LEU  84           H        LEU  84  -4.172 -10.002 -10.002
  669    HA   LEU  84           HA       LEU  84  -6.777 -10.745 -10.745
  670   1HB   LEU  84          2HB       LEU  84  -5.926 -12.942 -12.942
  671   2HB   LEU  84          1HB       LEU  84  -5.541 -12.293 -12.293
  672    HG   LEU  84           HG       LEU  84  -7.927 -11.851 -11.851
  673   1HD1  LEU  84          1HD1      LEU  84  -8.510 -11.532 -11.532
  674   2HD1  LEU  84          3HD1      LEU  84  -8.448 -13.282 -13.282
  675   3HD1  LEU  84          2HD1      LEU  84  -9.637 -12.540 -12.540
  676   1HD2  LEU  84          3HD2      LEU  84  -7.002 -14.593 -14.593
  677   2HD2  LEU  84          2HD2      LEU  84  -7.354 -13.952 -13.952
  678   3HD2  LEU  84          1HD2      LEU  84  -8.674 -14.358 -14.358
  679    H    VAL  85           H        VAL  85  -8.517  -9.967  -9.967
  680    HA   VAL  85           HA       VAL  85  -7.552  -8.322  -8.322
  681    HB   VAL  85           HB       VAL  85  -9.479  -7.243  -7.243
  682   1HG1  VAL  85          3HG1      VAL  85  -8.793  -6.421  -6.421
  683   2HG1  VAL  85          2HG1      VAL  85  -7.858  -5.362  -5.362
  684   3HG1  VAL  85          1HG1      VAL  85  -9.609  -5.458  -5.458
  685   1HG2  VAL  85          3HG2      VAL  85  -6.511  -7.327  -7.327
  686   2HG2  VAL  85          2HG2      VAL  85  -7.634  -7.226  -7.226
  687   3HG2  VAL  85          1HG2      VAL  85  -7.249  -5.784  -5.784
  688    H    LYS  86           H        LYS  86  -8.847  -8.412  -8.412
  689    HA   LYS  86           HA       LYS  86 -11.686  -9.241  -9.241
  690   1HB   LYS  86          2HB       LYS  86 -11.245 -10.152 -10.152
  691   2HB   LYS  86          1HB       LYS  86 -10.951 -11.162 -11.162
  692   1HG   LYS  86          2HG       LYS  86  -8.548 -10.417 -10.417
  693   2HG   LYS  86          1HG       LYS  86  -8.897  -9.568  -9.568
  694   1HD   LYS  86          2HD       LYS  86  -9.686 -11.745 -11.745
  695   2HD   LYS  86          1HD       LYS  86  -9.136 -12.548 -12.548
  696   1HE   LYS  86          2HE       LYS  86  -6.846 -11.692 -11.692
  697   2HE   LYS  86          1HE       LYS  86  -7.401 -10.931 -10.931
  698   1HZ   LYS  86          1HZ       LYS  86  -8.164 -13.217 -13.217
  699   2HZ   LYS  86          3HZ       LYS  86  -7.267 -13.820 -13.820
  700   3HZ   LYS  86          2HZ       LYS  86  -6.483 -12.982 -12.982
  701    H    TRP  87           H        TRP  87 -13.063  -8.358  -8.358
  702    HA   TRP  87           HA       TRP  87 -12.177  -5.634  -5.634
  703   1HB   TRP  87          2HB       TRP  87 -14.739  -7.175  -7.175
  704   2HB   TRP  87          1HB       TRP  87 -14.495  -5.587  -5.587
  705    HD1  TRP  87           HD1      TRP  87 -15.481  -7.286  -7.286
  706    HE1  TRP  87           HE1      TRP  87 -15.773  -5.593  -5.593
  707    HE3  TRP  87           HE3      TRP  87 -13.334  -3.191  -3.191
  708    HZ2  TRP  87           HZ2      TRP  87 -15.172  -2.856  -2.856
  709    HZ3  TRP  87           HZ3      TRP  87 -13.182  -1.055  -1.055
  710    HH2  TRP  87           HH2      TRP  87 -14.098  -0.888  -0.888
  711    H    GLU  88           H        GLU  88 -12.647  -4.862  -4.862
  712    HA   GLU  88           HA       GLU  88 -11.951  -6.892  -6.892
  713   1HB   GLU  88          2HB       GLU  88  -9.999  -5.367  -5.367
  714   2HB   GLU  88          1HB       GLU  88 -10.838  -4.095  -4.095
  715   1HG   GLU  88          2HG       GLU  88  -9.375  -4.948  -4.948
  716   2HG   GLU  88          1HG       GLU  88 -10.887  -5.786  -5.786
  717    H    SER  89           H        SER  89 -13.034  -3.617  -3.617
  718    HA   SER  89           HA       SER  89 -15.076  -3.821  -3.821
  719   1HB   SER  89          2HB       SER  89 -14.617  -1.583  -1.583
  720   2HB   SER  89          1HB       SER  89 -13.047  -2.374  -2.374
  721    HG   SER  89           HG       SER  89 -13.236  -0.245  -0.245
  722    H    GLU  90           H        GLU  90 -16.059  -1.124  -1.124
  723    HA   GLU  90           HA       GLU  90 -17.601  -1.900  -1.900
  724   1HB   GLU  90          2HB       GLU  90 -17.555   0.824   0.824
  725   2HB   GLU  90          1HB       GLU  90 -18.847   0.127   0.127
  726   1HG   GLU  90          2HG       GLU  90 -18.650  -1.782  -1.782
  727   2HG   GLU  90          1HG       GLU  90 -18.132  -0.383  -0.383
  728    H    ASN  91           H        ASN  91 -14.753   0.036   0.036
  729    HA   ASN  91           HA       ASN  91 -14.580   0.510   0.510
  730   1HB   ASN  91          2HB       ASN  91 -14.001   2.696   2.696
  731   2HB   ASN  91          1HB       ASN  91 -14.045   2.830   2.830
  732   1HD2  ASN  91          2HD2      ASN  91 -17.374   3.648   3.648
  733   2HD2  ASN  91          1HD2      ASN  91 -15.799   3.791   3.791
  734    H    LYS  92           H        LYS  92 -13.120  -1.253  -1.253
  735    HA   LYS  92           HA       LYS  92 -10.397  -0.232  -0.232
  736   1HB   LYS  92          2HB       LYS  92 -10.744   0.221   0.221
  737   2HB   LYS  92          1HB       LYS  92 -11.317  -1.423  -1.423
  738   1HG   LYS  92          2HG       LYS  92  -9.123  -2.331  -2.331
  739   2HG   LYS  92          1HG       LYS  92  -8.532  -0.737  -0.737
  740   1HD   LYS  92          2HD       LYS  92  -8.898   0.074   0.074
  741   2HD   LYS  92          1HD       LYS  92  -9.488  -1.522  -1.522
  742   1HE   LYS  92          2HE       LYS  92  -7.383  -2.487  -2.487
  743   2HE   LYS  92          1HE       LYS  92  -6.801  -1.323  -1.323
  744   1HZ   LYS  92          3HZ       LYS  92  -6.994   0.376   0.376
  745   2HZ   LYS  92          2HZ       LYS  92  -7.187  -0.924  -0.924
  746   3HZ   LYS  92          1HZ       LYS  92  -5.754  -0.768  -0.768
  747    H    MET  93           H        MET  93  -9.781  -1.685  -1.685
  748    HA   MET  93           HA       MET  93 -10.338  -4.579  -4.579
  749   1HB   MET  93          2HB       MET  93  -9.884  -4.744  -4.744
  750   2HB   MET  93          1HB       MET  93 -11.466  -4.237  -4.237
  751   1HG   MET  93          2HG       MET  93 -11.161  -2.051  -2.051
  752   2HG   MET  93          1HG       MET  93  -9.418  -2.119  -2.119
  753   1HE   MET  93          2HE       MET  93 -12.227  -3.831  -3.831
  754   2HE   MET  93          1HE       MET  93 -12.308  -2.415  -2.415
  755   3HE   MET  93          3HE       MET  93 -11.825  -3.981  -3.981
  756    H    VAL  94           H        VAL  94  -8.694  -6.069  -6.069
  757    HA   VAL  94           HA       VAL  94  -5.945  -4.931  -4.931
  758    HB   VAL  94           HB       VAL  94  -6.639  -7.781  -7.781
  759   1HG1  VAL  94          1HG1      VAL  94  -4.329  -6.029  -6.029
  760   2HG1  VAL  94          3HG1      VAL  94  -4.700  -6.775  -6.775
  761   3HG1  VAL  94          2HG1      VAL  94  -4.416  -7.782  -7.782
  762   1HG2  VAL  94          3HG2      VAL  94  -6.856  -5.409  -5.409
  763   2HG2  VAL  94          2HG2      VAL  94  -8.182  -6.449  -6.449
  764   3HG2  VAL  94          1HG2      VAL  94  -6.900  -7.100  -7.100
  765    H    CYS  95           H        CYS  95  -4.283  -6.534  -6.534
  766    HA   CYS  95           HA       CYS  95  -5.450  -7.959  -7.959
  767   1HB   CYS  95          2HB       CYS  95  -5.116  -5.595  -5.595
  768   2HB   CYS  95          1HB       CYS  95  -3.409  -5.747  -5.747
  769    HG   CYS  95           HG       CYS  95  -3.197  -7.566  -7.566
  770    H    GLU  96           H        GLU  96  -4.309  -9.769  -9.769
  771    HA   GLU  96           HA       GLU  96  -1.590 -10.050 -10.050
  772   1HB   GLU  96          2HB       GLU  96  -1.948 -12.524 -12.524
  773   2HB   GLU  96          1HB       GLU  96  -3.015 -11.857 -11.857
  774   1HG   GLU  96          2HG       GLU  96  -4.832 -11.661 -11.661
  775   2HG   GLU  96          1HG       GLU  96  -3.775 -12.064 -12.064
  776    H    GLN  97           H        GLN  97   0.041 -11.225 -11.225
  777    HA   GLN  97           HA       GLN  97  -0.577 -11.066 -11.066
  778   1HB   GLN  97          2HB       GLN  97   0.019  -8.710  -8.710
  779   2HB   GLN  97          1HB       GLN  97   1.666  -9.319  -9.319
  780   1HG   GLN  97          2HG       GLN  97   1.061  -9.979  -9.979
  781   2HG   GLN  97          1HG       GLN  97  -0.305  -8.886  -8.886
  782   1HE2  GLN  97          2HE2      GLN  97   1.668  -5.937  -5.937
  783   2HE2  GLN  97          1HE2      GLN  97   0.138  -6.587  -6.587
  784    H    LYS  98           H        LYS  98   0.837 -12.217 -12.217
  785    HA   LYS  98           HA       LYS  98   3.427 -13.119 -13.119
  786   1HB   LYS  98          2HB       LYS  98   2.891 -15.496 -15.496
  787   2HB   LYS  98          1HB       LYS  98   1.858 -14.859 -14.859
  788   1HG   LYS  98          2HG       LYS  98   0.005 -14.609 -14.609
  789   2HG   LYS  98          1HG       LYS  98   1.013 -14.795 -14.795
  790   1HD   LYS  98          2HD       LYS  98   0.928 -17.032 -17.032
  791   2HD   LYS  98          1HD       LYS  98  -0.435 -16.826 -16.826
  792   1HE   LYS  98          2HE       LYS  98   0.870 -17.215 -17.215
  793   2HE   LYS  98          1HE       LYS  98   2.371 -16.794 -16.794
  794   1HZ   LYS  98          3HZ       LYS  98   2.084 -18.805 -18.805
  795   2HZ   LYS  98          2HZ       LYS  98   0.726 -19.226 -19.226
  796   3HZ   LYS  98          1HZ       LYS  98   2.262 -19.155 -19.155
  797    H    LEU  99           H        LEU  99   4.874 -13.774 -13.774
  798    HA   LEU  99           HA       LEU  99   4.515 -12.378 -12.378
  799   1HB   LEU  99          2HB       LEU  99   6.258 -14.750 -14.750
  800   2HB   LEU  99          1HB       LEU  99   6.367 -13.854 -13.854
  801    HG   LEU  99           HG       LEU  99   6.446 -12.264 -12.264
  802   1HD1  LEU  99          1HD1      LEU  99   8.574 -14.193 -14.193
  803   2HD1  LEU  99          3HD1      LEU  99   9.004 -12.720 -12.720
  804   3HD1  LEU  99          2HD1      LEU  99   7.964 -13.922 -13.922
  805   1HD2  LEU  99          2HD2      LEU  99   6.562 -11.234 -11.234
  806   2HD2  LEU  99          1HD2      LEU  99   8.059 -10.972 -10.972
  807   3HD2  LEU  99          3HD2      LEU  99   7.988 -12.204 -12.204
  808    H    LEU 100           H        LEU 100   4.507 -13.410 -13.410
  809    HA   LEU 100           HA       LEU 100   2.422 -15.509 -15.509
  810   1HB   LEU 100          2HB       LEU 100   3.497 -13.489 -13.489
  811   2HB   LEU 100          1HB       LEU 100   2.493 -14.846 -14.846
  812    HG   LEU 100           HG       LEU 100   1.623 -13.027 -13.027
  813   1HD1  LEU 100          3HD1      LEU 100   1.561 -12.568 -12.568
  814   2HD1  LEU 100          2HD1      LEU 100   0.170 -12.059 -12.059
  815   3HD1  LEU 100          1HD1      LEU 100   1.768 -11.404 -11.404
  816   1HD2  LEU 100          1HD2      LEU 100   0.393 -15.096 -15.096
  817   2HD2  LEU 100          3HD2      LEU 100   0.224 -14.891 -14.891
  818   3HD2  LEU 100          2HD2      LEU 100  -0.627 -13.808 -13.808
  819    H    LYS 101           H        LYS 101   5.802 -15.185 -15.185
  820    HA   LYS 101           HA       LYS 101   6.055 -17.883 -17.883
  821   1HB   LYS 101          2HB       LYS 101   6.436 -15.799 -15.799
  822   2HB   LYS 101          1HB       LYS 101   8.050 -15.911 -15.911
  823   1HG   LYS 101          2HG       LYS 101   6.845 -18.503 -18.503
  824   2HG   LYS 101          1HG       LYS 101   7.198 -17.418 -17.418
  825   1HD   LYS 101          2HD       LYS 101   9.285 -17.781 -17.781
  826   2HD   LYS 101          1HD       LYS 101   9.057 -19.069 -19.069
  827   1HE   LYS 101          2HE       LYS 101   9.129 -17.111 -17.111
  828   2HE   LYS 101          1HE       LYS 101   9.929 -16.228 -16.228
  829   1HZ   LYS 101          2HZ       LYS 101  10.784 -18.879 -18.879
  830   2HZ   LYS 101          1HZ       LYS 101  11.498 -17.397 -17.397
  831   3HZ   LYS 101          3HZ       LYS 101  11.582 -17.950 -17.950
  832    H    GLY 102           H        GLY 102   7.607 -19.033 -19.033
  833   1HA   GLY 102          2HA       GLY 102   9.323 -19.491 -19.491
  834   2HA   GLY 102          1HA       GLY 102   9.955 -17.879 -17.879
  835    H    GLU 103           H        GLU 103  10.379 -17.693 -17.693
  836    HA   GLU 103           HA       GLU 103   8.338 -16.248 -16.248
  837   1HB   GLU 103          2HB       GLU 103   7.389 -18.555 -18.555
  838   2HB   GLU 103          1HB       GLU 103   8.851 -19.029 -19.029
  839   1HG   GLU 103          2HG       GLU 103   8.407 -17.500 -17.500
  840   2HG   GLU 103          1HG       GLU 103   7.132 -16.699 -16.699
  841    H    GLY 104           H        GLY 104   9.228 -15.149 -15.149
  842   1HA   GLY 104          2HA       GLY 104  11.743 -16.055 -16.055
  843   2HA   GLY 104          1HA       GLY 104  11.833 -14.538 -14.538
  844    HA   PRO 105           HA       PRO 105  10.201 -12.602 -12.602
  845   1HB   PRO 105          2HB       PRO 105   9.360 -10.229 -10.229
  846   2HB   PRO 105          1HB       PRO 105  11.066 -10.618 -10.618
  847   1HG   PRO 105          2HG       PRO 105   9.577 -10.493 -10.493
  848   2HG   PRO 105          1HG       PRO 105  11.318 -10.350 -10.350
  849   1HD   PRO 105          2HD       PRO 105   9.925 -12.659 -12.659
  850   2HD   PRO 105          1HD       PRO 105  11.639 -12.560 -12.560
  851    H    LYS 106           H        LYS 106   8.063 -11.177 -11.177
  852    HA   LYS 106           HA       LYS 106   5.727 -12.368 -12.368
  853   1HB   LYS 106          2HB       LYS 106   6.115 -13.604 -13.604
  854   2HB   LYS 106          1HB       LYS 106   6.115 -12.084 -12.084
  855   1HG   LYS 106          2HG       LYS 106   3.819 -11.688 -11.688
  856   2HG   LYS 106          1HG       LYS 106   3.781 -12.965 -12.965
  857   1HD   LYS 106          2HD       LYS 106   3.718 -14.661 -14.661
  858   2HD   LYS 106          1HD       LYS 106   4.551 -13.695 -13.695
  859   1HE   LYS 106          2HE       LYS 106   1.704 -13.241 -13.241
  860   2HE   LYS 106          1HE       LYS 106   2.164 -14.011 -14.011
  861   1HZ   LYS 106          3HZ       LYS 106   3.521 -11.841 -11.841
  862   2HZ   LYS 106          2HZ       LYS 106   2.430 -11.200 -11.200
  863   3HZ   LYS 106          1HZ       LYS 106   1.857 -11.849 -11.849
  864    H    THR 107           H        THR 107   4.134 -10.822 -10.822
  865    HA   THR 107           HA       THR 107   4.527  -8.152  -8.152
  866    HB   THR 107           HB       THR 107   3.219  -7.585  -7.585
  867    HG1  THR 107           HG1      THR 107   3.515  -9.334  -9.334
  868   1HG2  THR 107          3HG2      THR 107   5.147  -6.400  -6.400
  869   2HG2  THR 107          2HG2      THR 107   6.212  -7.685  -7.685
  870   3HG2  THR 107          1HG2      THR 107   5.362  -6.665  -6.665
  871    H    SER 108           H        SER 108   2.742  -7.020  -7.020
  872    HA   SER 108           HA       SER 108   0.019  -7.864  -7.864
  873   1HB   SER 108          2HB       SER 108  -0.454  -8.178  -8.178
  874   2HB   SER 108          1HB       SER 108   0.303  -9.519  -9.519
  875    HG   SER 108           HG       SER 108   1.641  -9.272  -9.272
  876    H    TRP 109           H        TRP 109  -1.283  -6.011  -6.011
  877    HA   TRP 109           HA       TRP 109  -0.217  -3.844  -3.844
  878   1HB   TRP 109          2HB       TRP 109  -0.925  -2.184  -2.184
  879   2HB   TRP 109          1HB       TRP 109   0.503  -3.136  -3.136
  880    HD1  TRP 109           HD1      TRP 109   0.371  -4.821  -4.821
  881    HE1  TRP 109           HE1      TRP 109  -1.395  -5.264  -5.264
  882    HE3  TRP 109           HE3      TRP 109  -3.565  -2.199  -2.199
  883    HZ2  TRP 109           HZ2      TRP 109  -4.116  -4.591  -4.591
  884    HZ3  TRP 109           HZ3      TRP 109  -5.725  -2.117  -2.117
  885    HH2  TRP 109           HH2      TRP 109  -6.011  -3.309  -3.309
  886    H    THR 110           H        THR 110  -1.905  -2.090  -2.090
  887    HA   THR 110           HA       THR 110  -4.670  -3.214  -3.214
  888    HB   THR 110           HB       THR 110  -5.101  -2.616  -2.616
  889    HG1  THR 110           HG1      THR 110  -4.147  -0.757  -0.757
  890   1HG2  THR 110          2HG2      THR 110  -3.146  -4.487  -4.487
  891   2HG2  THR 110          1HG2      THR 110  -2.404  -3.529  -3.529
  892   3HG2  THR 110          3HG2      THR 110  -3.954  -4.320  -4.320
  893    H    MET 111           H        MET 111  -6.281  -1.419  -1.419
  894    HA   MET 111           HA       MET 111  -5.412   1.330   1.330
  895   1HB   MET 111          2HB       MET 111  -6.994   1.596   1.596
  896   2HB   MET 111          1HB       MET 111  -5.633   0.538   0.538
  897   1HG   MET 111          2HG       MET 111  -6.944  -1.372  -1.372
  898   2HG   MET 111          1HG       MET 111  -8.144  -0.679  -0.679
  899   1HE   MET 111          3HE       MET 111  -7.723  -2.084  -2.084
  900   2HE   MET 111          2HE       MET 111  -8.278  -1.029  -1.029
  901   3HE   MET 111          1HE       MET 111  -6.709  -0.743  -0.743
  902    H    GLU 112           H        GLU 112  -6.699   2.674   2.674
  903    HA   GLU 112           HA       GLU 112  -9.308   1.570   1.570
  904   1HB   GLU 112          2HB       GLU 112  -7.512   3.468   3.468
  905   2HB   GLU 112          1HB       GLU 112  -8.930   2.613   2.613
  906   1HG   GLU 112          2HG       GLU 112  -7.663   0.849   0.849
  907   2HG   GLU 112          1HG       GLU 112  -7.109   0.683   0.683
  908    H    LEU 113           H        LEU 113 -10.977   3.122   3.122
  909    HA   LEU 113           HA       LEU 113 -10.557   5.726   5.726
  910   1HB   LEU 113          2HB       LEU 113 -12.278   3.680   3.680
  911   2HB   LEU 113          1HB       LEU 113 -13.317   4.693   4.693
  912    HG   LEU 113           HG       LEU 113 -13.349   5.196   5.196
  913   1HD1  LEU 113          1HD1      LEU 113 -14.016   6.841   6.841
  914   2HD1  LEU 113          3HD1      LEU 113 -12.376   7.479   7.479
  915   3HD1  LEU 113          2HD1      LEU 113 -13.391   7.589   7.589
  916   1HD2  LEU 113          1HD2      LEU 113 -10.799   4.879   4.879
  917   2HD2  LEU 113          3HD2      LEU 113 -11.513   6.224   6.224
  918   3HD2  LEU 113          2HD2      LEU 113 -10.682   6.518   6.518
  919    H    THR 114           H        THR 114 -11.339   7.554   7.554
  920    HA   THR 114           HA       THR 114 -12.031   7.002   7.002
  921    HB   THR 114           HB       THR 114 -11.480   9.278   9.278
  922    HG1  THR 114           HG1      THR 114 -11.430  10.809  10.809
  923   1HG2  THR 114          2HG2      THR 114  -9.559   7.762   7.762
  924   2HG2  THR 114          1HG2      THR 114  -9.592   8.397   8.397
  925   3HG2  THR 114          3HG2      THR 114  -9.219   9.467   9.467
  926    H    ASN 115           H        ASN 115 -13.816   8.232   8.232
  927    HA   ASN 115           HA       ASN 115 -16.276   7.912   7.912
  928   1HB   ASN 115          2HB       ASN 115 -17.250   9.251   9.251
  929   2HB   ASN 115          1HB       ASN 115 -16.216   7.931   7.931
  930   1HD2  ASN 115          2HD2      ASN 115 -13.892  10.074  10.074
  931   2HD2  ASN 115          1HD2      ASN 115 -14.371   8.478   8.478
  932    H    ASP 116           H        ASP 116 -13.993  10.536  10.536
  933    HA   ASP 116           HA       ASP 116 -15.934  12.506  12.506
  934   1HB   ASP 116          2HB       ASP 116 -13.631  12.818  12.818
  935   2HB   ASP 116          1HB       ASP 116 -12.999  12.944  12.944
  936    H    GLY 117           H        GLY 117 -13.583  10.246  10.246
  937   1HA   GLY 117          2HA       GLY 117 -14.225   9.523   9.523
  938   2HA   GLY 117          1HA       GLY 117 -14.207  11.240  11.240
  939    H    GLU 118           H        GLU 118 -11.759  11.119  11.119
  940    HA   GLU 118           HA       GLU 118  -9.675  11.391  11.391
  941   1HB   GLU 118          2HB       GLU 118  -9.477  10.498  10.498
  942   2HB   GLU 118          1HB       GLU 118  -8.142  11.110  11.110
  943   1HG   GLU 118          2HG       GLU 118  -9.635  13.193  13.193
  944   2HG   GLU 118          1HG       GLU 118 -10.568  12.596  12.596
  945    H    LEU 119           H        LEU 119  -7.708   9.822   9.822
  946    HA   LEU 119           HA       LEU 119  -8.532   6.986   6.986
  947   1HB   LEU 119          2HB       LEU 119  -9.208   7.759   7.759
  948   2HB   LEU 119          1HB       LEU 119  -7.529   8.161   8.161
  949    HG   LEU 119           HG       LEU 119  -8.362   5.375   5.375
  950   1HD1  LEU 119          3HD1      LEU 119  -8.555   6.756   6.756
  951   2HD1  LEU 119          2HD1      LEU 119  -8.140   5.042   5.042
  952   3HD1  LEU 119          1HD1      LEU 119  -9.665   5.603   5.603
  953   1HD2  LEU 119          3HD2      LEU 119  -5.942   6.711   6.711
  954   2HD2  LEU 119          2HD2      LEU 119  -6.036   5.438   5.438
  955   3HD2  LEU 119          1HD2      LEU 119  -6.285   5.051   5.051
  956    H    ILE 120           H        ILE 120  -6.932   6.155   6.155
  957    HA   ILE 120           HA       ILE 120  -4.131   7.062   7.062
  958    HB   ILE 120           HB       ILE 120  -4.820   7.320   7.320
  959   1HG1  ILE 120          2HG1      ILE 120  -3.002   4.903   4.903
  960   2HG1  ILE 120          1HG1      ILE 120  -2.479   6.561   6.561
  961   1HG2  ILE 120          1HG2      ILE 120  -5.581   4.413   4.413
  962   2HG2  ILE 120          3HG2      ILE 120  -5.282   5.128   5.128
  963   3HG2  ILE 120          2HG2      ILE 120  -6.580   5.752   5.752
  964   1HD1  ILE 120          3HD1      ILE 120  -3.271   7.147   7.147
  965   2HD1  ILE 120          2HD1      ILE 120  -3.551   5.428   5.428
  966   3HD1  ILE 120          1HD1      ILE 120  -1.918   6.016   6.016
  967    H    LEU 121           H        LEU 121  -2.474   5.282   5.282
  968    HA   LEU 121           HA       LEU 121  -3.609   2.632   2.632
  969   1HB   LEU 121          2HB       LEU 121  -3.307   3.925   3.925
  970   2HB   LEU 121          1HB       LEU 121  -1.609   4.165   4.165
  971    HG   LEU 121           HG       LEU 121  -2.162   1.359   1.359
  972   1HD1  LEU 121          3HD1      LEU 121  -3.129   2.632   2.632
  973   2HD1  LEU 121          2HD1      LEU 121  -2.793   0.911   0.911
  974   3HD1  LEU 121          1HD1      LEU 121  -4.080   1.669   1.669
  975   1HD2  LEU 121          1HD2      LEU 121   0.007   2.412   2.412
  976   2HD2  LEU 121          3HD2      LEU 121  -0.446   1.208   1.208
  977   3HD2  LEU 121          2HD2      LEU 121  -0.639   2.926   2.926
  978    H    THR 122           H        THR 122  -2.395   1.008   1.008
  979    HA   THR 122           HA       THR 122   0.327   1.729   1.729
  980    HB   THR 122           HB       THR 122  -0.623  -0.696  -0.696
  981    HG1  THR 122           HG1      THR 122  -2.465   0.083   0.083
  982   1HG2  THR 122          1HG2      THR 122   0.250   2.036   2.036
  983   2HG2  THR 122          3HG2      THR 122  -0.612   1.077   1.077
  984   3HG2  THR 122          2HG2      THR 122   0.879   0.463   0.463
  985    H    MET 123           H        MET 123   1.754  -0.337  -0.337
  986    HA   MET 123           HA       MET 123   1.112  -2.232  -2.232
  987   1HB   MET 123          2HB       MET 123   3.634  -0.546  -0.546
  988   2HB   MET 123          1HB       MET 123   3.209  -1.783  -1.783
  989   1HG   MET 123          2HG       MET 123   1.066  -0.390  -0.390
  990   2HG   MET 123          1HG       MET 123   1.921   0.907   0.907
  991   1HE   MET 123          3HE       MET 123   1.972  -1.728  -1.728
  992   2HE   MET 123          2HE       MET 123   1.083  -0.386  -0.386
  993   3HE   MET 123          1HE       MET 123   2.617  -0.893  -0.893
  994    H    THR 124           H        THR 124   2.808  -3.966  -3.966
  995    HA   THR 124           HA       THR 124   4.491  -4.255  -4.255
  996    HB   THR 124           HB       THR 124   2.568  -6.457  -6.457
  997    HG1  THR 124           HG1      THR 124   1.250  -4.824  -4.824
  998   1HG2  THR 124          2HG2      THR 124   4.641  -6.947  -6.947
  999   2HG2  THR 124          1HG2      THR 124   4.120  -5.778  -5.778
 1000   3HG2  THR 124          3HG2      THR 124   3.172  -7.239  -7.239
 1001    H    ALA 125           H        ALA 125   6.087  -5.857  -5.857
 1002    HA   ALA 125           HA       ALA 125   6.202  -7.461  -7.461
 1003   1HB   ALA 125          2HB       ALA 125   7.968  -5.048  -5.048
 1004   2HB   ALA 125          1HB       ALA 125   8.477  -6.401  -6.401
 1005   3HB   ALA 125          3HB       ALA 125   7.029  -5.485  -5.485
 1006    H    ASP 126           H        ASP 126   6.518  -9.251  -9.251
 1007    HA   ASP 126           HA       ASP 126   7.837 -10.860 -10.860
 1008   1HB   ASP 126          2HB       ASP 126   9.779  -9.061  -9.061
 1009   2HB   ASP 126          1HB       ASP 126  10.197  -9.331  -9.331
 1010    H    ASP 127           H        ASP 127   9.159  -7.966  -7.966
 1011    HA   ASP 127           HA       ASP 127   7.347  -8.380  -8.380
 1012   1HB   ASP 127          2HB       ASP 127   9.566  -9.778  -9.778
 1013   2HB   ASP 127          1HB       ASP 127  10.287  -8.214  -8.214
 1014    H    VAL 128           H        VAL 128   8.023  -6.335  -6.335
 1015    HA   VAL 128           HA       VAL 128   8.610  -4.055  -4.055
 1016    HB   VAL 128           HB       VAL 128   9.484  -2.847  -2.847
 1017   1HG1  VAL 128          2HG1      VAL 128  10.800  -4.769  -4.769
 1018   2HG1  VAL 128          1HG1      VAL 128  10.818  -5.503  -5.503
 1019   3HG1  VAL 128          3HG1      VAL 128  11.531  -3.909  -3.909
 1020   1HG2  VAL 128          3HG2      VAL 128   8.220  -5.106  -5.106
 1021   2HG2  VAL 128          2HG2      VAL 128   8.501  -3.450  -3.450
 1022   3HG2  VAL 128          1HG2      VAL 128   9.803  -4.636  -4.636
 1023    H    VAL 129           H        VAL 129   7.596  -1.980  -1.980
 1024    HA   VAL 129           HA       VAL 129   5.078  -2.591  -2.591
 1025    HB   VAL 129           HB       VAL 129   5.231  -1.935  -1.935
 1026   1HG1  VAL 129          2HG1      VAL 129   3.304  -0.626  -0.626
 1027   2HG1  VAL 129          1HG1      VAL 129   2.695  -1.179  -1.179
 1028   3HG1  VAL 129          3HG1      VAL 129   4.004   0.001   0.001
 1029   1HG2  VAL 129          3HG2      VAL 129   3.741  -3.725  -3.725
 1030   2HG2  VAL 129          2HG2      VAL 129   4.441  -4.063  -4.063
 1031   3HG2  VAL 129          1HG2      VAL 129   2.899  -3.215  -3.215
 1032    H    CYS 130           H        CYS 130   4.938  -1.071  -1.071
 1033    HA   CYS 130           HA       CYS 130   6.212   1.584   1.584
 1034   1HB   CYS 130          2HB       CYS 130   6.431   0.011   0.011
 1035   2HB   CYS 130          1HB       CYS 130   4.941   0.836   0.836
 1036    HG   CYS 130           HG       CYS 130   7.376   2.092   2.092
 1037    H    THR 131           H        THR 131   4.911   3.227   3.227
 1038    HA   THR 131           HA       THR 131   1.994   3.023   3.023
 1039    HB   THR 131           HB       THR 131   3.364   4.368   4.368
 1040    HG1  THR 131           HG1      THR 131   3.299   2.078   2.078
 1041   1HG2  THR 131          1HG2      THR 131   0.588   4.412   4.412
 1042   2HG2  THR 131          3HG2      THR 131   0.762   4.212   4.212
 1043   3HG2  THR 131          2HG2      THR 131   1.454   5.624   5.624
 1044    H    ARG 132           H        ARG 132   0.945   4.889   4.889
 1045    HA   ARG 132           HA       ARG 132   2.364   7.423   7.423
 1046   1HB   ARG 132          2HB       ARG 132   1.602   7.445   7.445
 1047   2HB   ARG 132          1HB       ARG 132   3.075   6.568   6.568
 1048   1HG   ARG 132          2HG       ARG 132   1.582   4.481   4.481
 1049   2HG   ARG 132          1HG       ARG 132   0.330   5.436   5.436
 1050   1HD   ARG 132          2HD       ARG 132   1.393   4.344   4.344
 1051   2HD   ARG 132          1HD       ARG 132   2.155   5.935   5.935
 1052    HE   ARG 132           HE       ARG 132   3.581   3.964   3.964
 1053   1HH1  ARG 132          2HH1      ARG 132   5.461   5.675   5.675
 1054   2HH1  ARG 132          1HH1      ARG 132   5.977   5.087   5.087
 1055   1HH2  ARG 132          1HH2      ARG 132   3.213   3.040   3.040
 1056   2HH2  ARG 132          2HH2      ARG 132   4.704   3.594   3.594
 1057    H    VAL 133           H        VAL 133   0.830   8.940   8.940
 1058    HA   VAL 133           HA       VAL 133  -2.011   8.152   8.152
 1059    HB   VAL 133           HB       VAL 133  -0.704  10.762  10.762
 1060   1HG1  VAL 133          1HG1      VAL 133  -3.457   9.592   9.592
 1061   2HG1  VAL 133          3HG1      VAL 133  -2.827  10.963  10.963
 1062   3HG1  VAL 133          2HG1      VAL 133  -3.059  11.097  11.097
 1063   1HG2  VAL 133          1HG2      VAL 133  -1.147   8.162   8.162
 1064   2HG2  VAL 133          3HG2      VAL 133   0.209   9.283   9.283
 1065   3HG2  VAL 133          2HG2      VAL 133  -1.317   9.652   9.652
 1066    H    TYR 134           H        TYR 134  -3.584   8.960   8.960
 1067    HA   TYR 134           HA       TYR 134  -2.603  10.899  10.899
 1068   1HB   TYR 134          2HB       TYR 134  -4.076   8.311   8.311
 1069   2HB   TYR 134          1HB       TYR 134  -4.371   9.620   9.620
 1070    HD1  TYR 134           HD2      TYR 134  -2.594  10.459  10.459
 1071    HD2  TYR 134           HD1      TYR 134  -1.893   7.217   7.217
 1072    HE1  TYR 134           HE2      TYR 134  -0.508   9.883   9.883
 1073    HE2  TYR 134           HE1      TYR 134   0.181   6.639   6.639
 1074    HH   TYR 134           HH       TYR 134   0.925   7.225   7.225
 1075    H    VAL 135           H        VAL 135  -3.907  12.601  12.601
 1076    HA   VAL 135           HA       VAL 135  -6.653  12.492  12.492
 1077    HB   VAL 135           HB       VAL 135  -4.558  14.317  14.317
 1078   1HG1  VAL 135          1HG1      VAL 135  -5.239  15.487  15.487
 1079   2HG1  VAL 135          3HG1      VAL 135  -6.801  15.801  15.801
 1080   3HG1  VAL 135          2HG1      VAL 135  -5.330  16.483  16.483
 1081   1HG2  VAL 135          3HG2      VAL 135  -7.533  14.488  14.488
 1082   2HG2  VAL 135          2HG2      VAL 135  -6.341  13.643  13.643
 1083   3HG2  VAL 135          1HG2      VAL 135  -6.294  15.402  15.402
 1084    H    ARG 136           H        ARG 136  -8.359  13.021  13.021
 1085    HA   ARG 136           HA       ARG 136  -8.075  12.632  12.632
 1086   1HB   ARG 136          2HB       ARG 136 -10.166  13.531  13.531
 1087   2HB   ARG 136          1HB       ARG 136 -10.201  14.473  14.473
 1088   1HG   ARG 136          2HG       ARG 136 -10.594  12.631  12.631
 1089   2HG   ARG 136          1HG       ARG 136  -9.853  11.511  11.511
 1090   1HD   ARG 136          2HD       ARG 136 -12.570  12.833  12.833
 1091   2HD   ARG 136          1HD       ARG 136 -12.224  11.110  11.110
 1092    HE   ARG 136           HE       ARG 136 -10.926  11.856  11.856
 1093   1HH1  ARG 136          2HH1      ARG 136 -13.708  10.391  10.391
 1094   2HH1  ARG 136          1HH1      ARG 136 -14.667  11.156  11.156
 1095   1HH2  ARG 136          1HH2      ARG 136 -12.328  13.637  13.637
 1096   2HH2  ARG 136          2HH2      ARG 136 -13.884  12.997  12.997
 1097    H    GLU 137           HN       GLU 137  -7.304  13.723  13.723
 1098    HA   GLU 137           HA       GLU 137  -5.818  16.075  16.075
 1099   1HB   GLU 137          2HB       GLU 137  -6.244  14.321  14.321
 1100   2HB   GLU 137          1HB       GLU 137  -7.428  15.506  15.506
 1101   1HG   GLU 137          2HG       GLU 137  -4.519  16.119  16.119
 1102   2HG   GLU 137          1HG       GLU 137  -5.179  15.818  15.818