*HEADER   OXIDOREDUCTASE                          28-OCT-98   1BZF    
*TITLE    NMR SOLUTION STRUCTURE AND DYNAMICS OF THE COMPLEX OF       
*TITLE   2 LACTOBACILLUS CASEI DIHYDROFOLATE REDUCTASE WITH THE NEW   
*TITLE   3 LIPOPHILIC ANTIFOLATE DRUG TRIMETREXATE, 22 STRUCTURES     
*COMPND   MOL_ID: 1;                                                  
*COMPND  2 MOLECULE: DIHYDROFOLATE REDUCTASE;                         
*COMPND  3 CHAIN: NULL;                                               
*COMPND  4 SYNONYM: DHFR;                                             
*COMPND  5 EC: 1.5.1.3;                                               
*COMPND  6 ENGINEERED: YES;                                           
*COMPND  7 BIOLOGICAL_UNIT: MONOMER                                   
*SOURCE   MOL_ID: 1;                                                  
*SOURCE  2 ORGANISM_SCIENTIFIC: LACTOBACILLUS CASEI;                  
*SOURCE  3 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                       
*SOURCE  4 EXPRESSION_SYSTEM_STRAIN: NF1;                             
*SOURCE  5 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                    
*SOURCE  6 EXPRESSION_SYSTEM_PLASMID: PMT702                          
*KEYWDS   OXIDOREDUCTASE, INHIBITOR/ENZYME COMPLEX                    
*EXPDTA   NMR, 22 STRUCTURES                                          
*AUTHOR   V.I.POLSHAKOV,B.BIRDSALL,T.A.FRENKIEL,A.R.GARGARO,J.FEENEY  
*REVDAT  1   18-MAY-99 1BZF    0                                      
 
! trimetrexate (TMQ) is labelled as residue 170
!
! NOE restraints
!---------------------------------------
! Long-range noes 
! r-6 averaging for aromatics and some others
assign (resid   1 and name hg2*) (resid 106 and name hd* )  5.5  5.5  0.0 
assign (resid   3 and name ha  ) (resid 103 and name he* )  3.5  3.5  0.0 
assign (resid   3 and name ha  ) (resid 110 and name hg* )  5.5  5.5  0.0 
assign (resid   3 and name hb1 ) (resid 103 and name he* )  4.5  4.5  0.0 
assign (resid   3 and name hd* ) (resid  96 and name hb  )  3.5  3.5  0.5 
assign (resid   3 and name hd* ) (resid  96 and name hn  )  4.5  4.5  0.0
assign (resid   3 and name hd* ) (resid  96 and name hg1*)  4.5  4.5  0.0 
assign (resid   3 and name hd* ) (resid  96 and name hg2*)  5.5  5.5  0.0
assign (resid   3 and name hd* ) (resid 103 and name hd* )  4.5  4.5  0.0 
assign (resid   3 and name hd* ) (resid 110 and name hg1*)  5.5  5.5  0.0 
assign (resid   3 and name hd* ) (resid 110 and name hg2*)  3.5  3.5  0.0
assign (resid   3 and name hd* ) (resid 113 and name hd2*)  4.5  4.5  0.0
assign (resid   3 and name hd* ) (resid 128 and name he* )  3.5  3.5  1.0 
assign (resid   3 and name hd* ) (resid 131 and name hd2*)  4.5  4.5  0.0 
assign (resid   3 and name he* ) (resid  96 and name hg1*)  4.5  4.5  0.0 
assign (resid   3 and name he* ) (resid 103 and name hb1 )  4.5  4.5  0.0 
assign (resid   3 and name he* ) (resid 103 and name hb2 )  5.5  5.5  0.0 
assign (resid   3 and name he* ) (resid 103 and name hd* )  4.5  4.5  0.0 
assign (resid   3 and name he* ) (resid 106 and name hn  )  5.5  5.5  0.0
assign (resid   3 and name he* ) (resid 106 and name hb1 )  3.5  3.5  0.0 
assign (resid   3 and name he* ) (resid 106 and name hb2 )  4.5  4.5  0.0 
assign (resid   3 and name he* ) (resid 106 and name hd* )  5.5  5.5  0.5
assign (resid   3 and name he* ) (resid 107 and name hn  )  5.5  5.5  0.0
assign (resid   3 and name he* ) (resid 107 and name ha  )  3.5  3.5  0.5
assign (resid   3 and name he* ) (resid 110 and name hb  )  3.5  3.5  0.0 
assign (resid   3 and name he* ) (resid 128 and name he* )  4.5  4.5  0.0 
assign (resid   3 and name he* ) (resid 129 and name hd1*)  4.5  4.5  0.0 
assign (resid   3 and name he* ) (resid 131 and name hd1*)  5.5  5.5  0.0 
assign (resid   3 and name he* ) (resid 131 and name hd2*)  4.5  4.5  0.0 
assign (resid   3 and name hz  ) (resid 103 and name hd* )  5.5  5.5  0.0 
assign (resid   3 and name hz  ) (resid 110 and name hg* )  4.5  4.5  0.0
assign (resid   4 and name hb1 ) (resid  30 and name he* ) 10.0  5.5  0.0 
assign (resid   4 and name hg  ) (resid  30 and name hd* )  4.5  4.5  0.5 
assign (resid   4 and name hg  ) (resid  30 and name he* )  5.5  5.5  0.0 
assign (resid   4 and name hd1*) (resid  29 and name hd* )  5.5  5.5  0.0 
assign (resid   4 and name hd1*) (resid  29 and name he* )  3.5  3.5  1.0 
assign (resid   4 and name hd2*) (resid  29 and name he* )  5.5  5.5  1.0 
assign (resid   4 and name hd1*) (resid  30 and name hd* )  5.5  5.5  0.0
assign (resid   4 and name hd2*) (resid  30 and name hd* )  3.5  3.5  0.0 
assign (resid   4 and name hd2*) (resid  30 and name he* )  3.5  3.5  0.0
assign (resid   4 and name hb* ) (resid  95 and name hg* )  3.5  3.5  0.5 
assign (resid   4 and name hn  ) (resid 103 and name hd* )  5.5  5.5  0.0 
assign (resid   4 and name hn  ) (resid 103 and name he* )  3.5  3.5  0.0
assign (resid   5 and name hb* ) (resid 103 and name he* )  3.5  3.5  0.0
assign (resid   6 and name ha  ) (resid 115 and name hg* )  5.5  5.5  0.0 
assign (resid   6 and name hb* ) (resid  19 and name hd* )  4.5  4.5  0.0 
assign (resid   7 and name hb* ) (resid  11 and name ha* )  3.5  3.5  0.5  
assign (resid   7 and name hg* ) (resid 115 and name hg1*)  5.5  5.5  0.5  
assign (resid   7 and name hg* ) (resid 115 and name hg2*)  3.5  3.5  0.0  
assign (resid   8 and name hb1 ) (resid 122 and name hd* )  3.5  3.5  0.0 
assign (resid   8 and name hb2 ) (resid 122 and name hd* )  3.5  3.5  0.5 
assign (resid  13 and name ha  ) (resid  19 and name hd* )  5.5  5.5  1.5 
assign (resid  13 and name hd1*) (resid 103 and name hd* )  5.5  5.5  0.5  
assign (resid  13 and name hd1*) (resid 103 and name he* )  5.5  5.5  0.5 
assign (resid  14 and name ha* ) (resid  20 and name hd* )  3.5  3.5  0.0 
assign (resid  15 and name hb* ) (resid 124 and name ha* )  3.5  3.5  0.0  
assign (resid  21 and name hb1 ) (resid 122 and name he* )  5.5  5.5  0.0  
assign (resid  21 and name he3 ) (resid 122 and name hd* )  3.5  3.5  0.0 
assign (resid  21 and name he3 ) (resid 122 and name he* )  5.5  5.5  0.0 
assign (resid  21 and name hz3 ) (resid 122 and name hd* )  4.5  4.5  0.0  
assign (resid  26 and name ha  ) (resid 155 and name he* )  4.5  4.5  0.0 
assign (resid  26 and name hb2 ) (resid 155 and name he* )  5.5  5.5  0.0  
assign (resid  29 and name hb1 ) (resid 155 and name he* )  4.5  4.5  0.0 
assign (resid  29 and name hb2 ) (resid 155 and name he* )  4.5  4.5  0.0 
assign (resid  29 and name hd* ) (resid 155 and name hd* )  5.5  5.5  0.0  
assign (resid  29 and name hd* ) (resid 155 and name he* )  4.5  4.5  0.0  
assign (resid  29 and name he* ) (resid 114 and name hb1 )  4.5  4.5  0.0  
assign (resid  29 and name he* ) (resid 114 and name hb2 )  5.5  5.5  0.5  
assign (resid  29 and name he* ) (resid 114 and name hd1*)  5.5  5.5  0.0  
assign (resid  29 and name he* ) (resid 155 and name hb* )  4.5  4.5  0.0  
assign (resid  29 and name he* ) (resid 155 and name hd* )  5.5  5.5  0.0  
assign (resid  29 and name he* ) (resid 155 and name he* )  5.5  5.5  0.5  
assign (resid  30 and name hd* ) (resid  54 and name hd1*)  5.5  5.5  0.0 
assign (resid  30 and name hd* ) (resid  97 and name hb* )  5.5  5.5  1.0
assign (resid  30 and name he* ) (resid  39 and name he* )  5.5  5.5  1.0 
assign (resid  30 and name he* ) (resid  41 and name hg1*)  5.5  5.5  1.0 
assign (resid  30 and name he* ) (resid  97 and name hb* )  2.5  2.5  1.0 
assign (resid  30 and name he* ) (resid  54 and name hd1*)  3.5  3.5  0.0 
assign (resid  35 and name hg* ) (resid  57 and name he  )  5.5  5.5  0.0
assign (resid  35 and name hg* ) (resid  57 and name hb* )  5.5  5.5  1.0
assign (resid  38 and name hn  ) (resid  95 and name hg* )  5.5  5.5  0.0
assign (resid  38 and name hg1*) (resid  85 and name hd* )  5.5  5.5  0.0 
assign (resid  38 and name hg1*) (resid  85 and name he* )  4.5  4.5  0.0 
assign (resid  38 and name hg2*) (resid  85 and name hd* )  4.5  4.5  0.0 
assign (resid  38 and name hg2*) (resid  85 and name he* )  5.5  5.5  0.0 
assign (resid  38 and name hd1*) (resid  85 and name hd* )  3.5  3.5  0.0 
assign (resid  38 and name hd1*) (resid  85 and name he* )  3.5  3.5  0.0 
assign (resid  39 and name ha  ) (resid  95 and name hg* )  4.5  4.5  0.5
assign (resid  39 and name he* ) (resid  57 and name hd* )  3.5  3.5  1.0 
assign (resid  40 and name hg*)  (resid  60 and name hg*)   4.5  4.5  0.0
assign (resid  40 and name hg* ) (resid  82 and name hg* )  4.5  4.5  0.0 
assign (resid  40 and name hg* ) (resid  96 and name hd1*)  4.5  4.5  0.0 
assign (resid  41 and name hg1*) (resid  46 and name hd* )  5.5  5.5  1.0 
assign (resid  41 and name hg2*) (resid  46 and name hd* )  3.5  3.5  0.0 
assign (resid  41 and name hg1*) (resid  49 and name hd* )  5.5  1.5  2.0 
assign (resid  41 and name hg2*) (resid  49 and name hd* )  5.5  5.5  0.0 
assign (resid  41 and name hg* ) (resid  97 and name hb* )  5.5  5.5  0.0
assign (resid  43 and name ha  ) (resid  68 and name he* )  5.5  5.5  0.0 
assign (resid  43 and name hn  ) (resid  61 and name hg* )  5.5  5.5  0.0
assign (resid  43 and name hb* ) (resid  68 and name hd* )  5.5  5.5  1.0 
assign (resid  43 and name hb* ) (resid  68 and name he* )  5.5  5.5  1.0 
assign (resid  43 and name hd* ) (resid  68 and name hd* )  3.5  3.5  0.5 
assign (resid  43 and name hd* ) (resid  68 and name he* )  4.5  4.5  0.0 
assign (resid  46 and name hb* ) (resid  61 and name hg1*)  4.5  4.5  0.0 
assign (resid  46 and name hb* ) (resid  61 and name hg2*)  3.5  3.5  0.0 
assign (resid  46 and name hd* ) (resid  52 and name hg* )  5.5  5.5  0.5 
assign (resid  46 and name hd* ) (resid  59 and name hb1 )  5.5  5.5  0.0 
assign (resid  46 and name hd* ) (resid  61 and name hg1*)  5.5  5.5  0.0 
assign (resid  46 and name hd* ) (resid  61 and name hg2*)  4.5  4.5  0.0 
assign (resid  46 and name hd* ) (resid  68 and name he* )  4.5  4.5  0.0 
assign (resid  46 and name hd* ) (resid  70 and name ha  )  5.5  5.5  0.0 
assign (resid  46 and name he* ) (resid  70 and name hb* )  4.5  4.5  0.0 
assign (resid  46 and name he* ) (resid  54 and name hn  )  5.5  5.5  0.5
assign (resid  49 and name hb* ) (resid  54 and name hd2*)  5.5  5.5  0.0 
assign (resid  49 and name hd* ) (resid  54 and name hg  )  4.5  4.5  0.0 
assign (resid  49 and name hd* ) (resid  54 and name hd1*)  5.5  5.5  0.0 
assign (resid  49 and name hd* ) (resid  54 and name hd2*)  5.5  5.5  0.0 
assign (resid  49 and name he* ) (resid  54 and name hd1*)  3.5  3.5  0.0
assign (resid  49 and name he* ) (resid  54 and name hd2*)  5.5  5.5  0.0
assign (resid  53 and name hb* ) (resid  59 and name hd2*)  4.5  4.5  0.0 
assign (resid  60 and name hg2*) (resid  85 and name hd* )  5.5  5.5  0.0 
assign (resid  60 and name hg2*) (resid  85 and name he* )  5.5  5.5  0.5 
assign (resid  61 and name hb  ) (resid  68 and name hd* )  4.5  4.5  0.0 
assign (resid  61 and name hb  ) (resid  68 and name he* )  5.5  5.5  0.0 
assign (resid  61 and name hb  ) (resid  75 and name hg* )  3.5  3.5  0.0 
assign (resid  61 and name hg* ) (resid  68 and name hd* )  5.5  5.5  0.0
assign (resid  61 and name hg1*) (resid  68 and name he* )  4.5  4.5  0.0 
assign (resid  61 and name hg2*) (resid  68 and name he* )  4.5  4.5  0.0 
assign (resid  63 and name hg2*) (resid  68 and name hd* )  4.5  4.5  0.0 
assign (resid  68 and name hd* ) (resid  75 and name hb  )  5.5  5.5  1.0 
assign (resid  68 and name hd* ) (resid  75 and name hg* )  4.5  4.5  0.0 
assign (resid  68 and name he* ) (resid  75 and name hg* )  5.5  5.5  0.5 
assign (resid  70 and name hn  ) (resid  75 and name hg* )  3.5  3.5  0.5
assign (resid  70 and name hb* ) (resid  75 and name hg* )  4.5  4.5  0.0 
assign (resid  74 and name hg* ) (resid  85 and name he* )  5.5  5.5  0.0
assign (resid  79 and name hg* ) (resid 105 and name ha  )  5.5  5.5  0.0 
assign (resid  79 and name hg* ) (resid 105 and name hb* )  4.5  4.5  0.0 
assign (resid  79 and name hg* ) (resid 106 and name hd* )  5.5  5.5  0.0 
assign (resid  79 and name hg* ) (resid 106 and name he* )  5.5  5.5  0.5 
assign (resid  79 and name hg* ) (resid 106 and name hz  )  4.5  4.5  0.0 
assign (resid  82 and name hb  ) (resid 106 and name hd* )  5.5  5.5  1.0
assign (resid  82 and name hb  ) (resid 106 and name he* )  3.5  3.5  0.0 
assign (resid  82 and name hg2*) (resid 106 and name he* )  5.5  5.5  0.0 
assign (resid  86 and name hn  ) (resid  94 and name hd* )  5.5  5.5  0.0 
assign (resid  86 and name hb* ) (resid  94 and name hd* )  3.5  3.5  0.0 
assign (resid  96 and name hb  ) (resid 103 and name hd* )  4.5  4.5  0.0
assign (resid  96 and name hb  ) (resid 103 and name he* )  5.5  5.5  0.0
assign (resid  96 and name hg1*) (resid 103 and name he* )  5.5  5.5  0.0 
assign (resid  96 and name hg1*) (resid 106 and name hd* )  5.5  5.5  0.5 
assign (resid  96 and name hg2*) (resid 103 and name hd* )  3.5  3.5  0.5 
assign (resid  96 and name hg2*) (resid 103 and name he* )  3.5  3.5  0.0 
assign (resid  96 and name hg2*) (resid 106 and name hd* )  4.5  4.5  0.0
assign (resid  96 and name hd1*) (resid 106 and name hd* )  4.5  4.5  0.0 
assign (resid  96 and name hd1*) (resid 106 and name he* )  4.5  4.5  0.0 
assign (resid  98 and name hn  ) (resid 103 and name he* )  5.5  5.5  0.0 
assign (resid  98 and name ha* ) (resid 103 and name he* )  4.5  4.5  0.0 
assign (resid 103 and name hd* ) (resid 128 and name he* )  3.5  3.5  0.5 
assign (resid 103 and name hd* ) (resid 129 and name hd1*)  5.5  5.5  0.0 
assign (resid 103 and name he* ) (resid 128 and name he* )  4.5  4.5  0.5 
assign (resid 110 and name hg* ) (resid 131 and name hd2*)  5.5  5.5  0.0 
assign (resid 111 and name ha  ) (resid 136 and name hd* )  5.5  5.5  0.0 
assign (resid 111 and name ha  ) (resid 136 and name he* )  4.5  4.5  0.0
assign (resid 112 and name ha  ) (resid 159 and name hg* )  4.5  4.5  0.0
assign (resid 113 and name hn  ) (resid 136 and name hd* )  5.5  5.5  0.0
assign (resid 113 and name hn  ) (resid 136 and name he* )  5.5  5.5  0.5
assign (resid 113 and name hg  ) (resid 136 and name hd* )  5.5  5.5  0.0
assign (resid 113 and name hd1*) (resid 136 and name hd* )  4.5  4.5  0.0 
assign (resid 113 and name hd1*) (resid 136 and name he* )  5.5  5.5  0.0
assign (resid 113 and name hd2*) (resid 136 and name hd* )  5.5  5.5  1.0 
assign (resid 113 and name hd2*) (resid 136 and name he* )  5.5  5.5  0.0
assign (resid 115 and name hg1*) (resid 158 and name he1 )  3.5  3.5  0.0
assign (resid 115 and name hg* ) (resid 156 and name hb* )  4.5  4.5  0.0
assign (resid 115 and name hg* ) (resid 156 and name hn  )  5.5  5.5  0.0
assign (resid 116 and name ha  ) (resid 155 and name hd* )  4.5  4.5  0.0 
assign (resid 116 and name hg1 ) (resid 155 and name hd* )  5.5  5.5  0.0
assign (resid 116 and name hg1 ) (resid 155 and name he* )  4.5  4.5  0.0
assign (resid 116 and name hg2*) (resid 155 and name he* )  4.5  4.5  0.0
assign (resid 116 and name hg2*) (resid 155 and name hd* )  3.5  3.5  0.0
assign (resid 120 and name ha* ) (resid 150 and name hb* )  3.5  3.5  0.0 
assign (resid 122 and name he* ) (resid 150 and name hb* )  5.5  5.5  0.0 
assign (resid 122 and name he* ) (resid 151 and name hd2*)  5.5  5.5  0.0 
assign (resid 136 and name hd* ) (resid 158 and name hb1 )  4.5  4.5  0.0  
assign (resid 136 and name hd* ) (resid 159 and name ha  )  4.5  4.5  0.5
assign (resid 136 and name hd* ) (resid 160 and name hn  )  4.5  4.5  0.0
assign (resid 136 and name he* ) (resid 160 and name hn  )  5.5  5.5  0.0
assign (resid 136 and name he* ) (resid 160 and name hb2 )  4.5  4.5  0.0
assign (resid 139 and name hg* ) (resid 158 and name ha  )  5.5  5.5  0.0
assign (resid 139 and name hg* ) (resid 159 and name hn  )  5.5  5.5  0.0
assign (resid 142 and name hb* ) (resid 155 and name hd* )  4.5  4.5  0.0 
assign (resid 142 and name hg1 ) (resid 155 and name hd* )  5.5  5.5  0.0 
assign (resid 142 and name hg2 ) (resid 155 and name hd* )  4.5  4.5  0.0 
assign (resid 144 and name hg1*) (resid 155 and name hd* )  5.5  5.5  0.0
assign (resid 144 and name hg1*) (resid 155 and name he* )  3.5  3.5  0.0
!nh(i)-ha(j)
assign (resid   2 and name hn  ) (resid  95 and name ha  )  3.5  3.5  0.0
assign (resid   2 and name ha  ) (resid 111 and name hn  )  4.5  4.5  0.0
assign (resid   2 and name ha  ) (resid 112 and name hn  )  3.5  3.5  0.0
assign (resid   2 and name ha  ) (resid 114 and name hn  )  5.5  5.5  0.0
assign (resid   3 and name ha  ) (resid  96 and name hn  )  3.5  3.5  0.0
assign (resid   3 and name hn  ) (resid 113 and name ha  )  3.5  3.5  0.0
assign (resid   4 and name ha  ) (resid 114 and name hn  )  3.5  3.5  0.0
assign (resid   5 and name hn  ) (resid 115 and name ha  )  3.5  3.5  0.0
assign (resid   6 and name ha  ) (resid 116 and name hn  )  2.5  2.5  0.5
assign (resid   7 and name hn  ) (resid 117 and name ha  )  4.5  4.5  0.0
assign (resid   8 and name hn  ) (resid  13 and name ha  )  4.5  4.5  0.0
assign (resid   9 and name hn  ) (resid 121 and name ha  )  4.5  4.5  0.0
assign (resid  12 and name ha  ) (resid 128 and name hn  )  4.5  4.5  0.0
assign (resid  13 and name hn  ) (resid 127 and name ha  )  3.5  3.5  0.0
assign (resid  14 and name hn  ) (resid 124 and name ha* )  5.5  5.5  1.0
assign (resid  14 and name hn  ) (resid 127 and name ha  )  4.5  4.5  0.5
assign (resid  15 and name ha  ) (resid 125 and name hn  )  3.5  3.5  0.0
assign (resid  36 and name hn  ) (resid  57 and name ha  )  3.5  3.5  0.0
assign (resid  37 and name ha  ) (resid  93 and name hn  )  3.5  3.5  0.0
assign (resid  38 and name hn  ) (resid  94 and name ha  )  4.5  4.5  0.0
assign (resid  39 and name hn  ) (resid  59 and name ha  )  3.5  3.5  1.0
assign (resid  40 and name ha  ) (resid  60 and name hn  )  3.5  3.5  0.0
assign (resid  41 and name hn  ) (resid  61 and name ha  )  3.5  3.5  0.0
assign (resid  41 and name ha  ) (resid  98 and name hn  )  4.5  4.5  0.0
assign (resid  41 and name ha  ) (resid  99 and name hn  )  5.5  5.5  0.0
assign (resid  42 and name ha* ) (resid  99 and name hn  )  3.5  3.5  1.0
assign (resid  59 and name hn  ) (resid  73 and name ha  )  4.5  4.5  0.0
assign (resid  62 and name ha  ) (resid  76 and name hn  )  3.5  3.5  0.5
assign (resid  39 and name ha  ) (resid  95 and name hn  )  4.5  4.5  0.0
assign (resid  98 and name ha* ) (resid 103 and name hn  )  5.5  5.5  0.0
assign (resid 112 and name ha  ) (resid 158 and name hn  )  5.5  5.5  0.0
assign (resid 113 and name hn  ) (resid 159 and name ha  )  4.5  4.5  0.0
assign (resid 115 and name hn  ) (resid 157 and name ha  )  4.5  4.5  0.0
assign (resid 116 and name ha  ) (resid 154 and name hn  )  5.5  5.5  0.0
assign (resid 116 and name ha  ) (resid 156 and name hn  )  3.5  3.5  0.5
assign (resid 117 and name hn  ) (resid 155 and name ha  )  4.5  4.5  0.0
assign (resid 119 and name hn  ) (resid 151 and name ha  )  5.5  5.5  0.0
assign (resid 119 and name hn  ) (resid 153 and name ha  )  4.5  4.5  0.0
assign (resid 120 and name hn  ) (resid 150 and name ha  )  3.5  3.5  0.0
assign (resid 120 and name hn  ) (resid 151 and name ha  )  4.5  4.5  0.0
assign (resid 121 and name hn  ) (resid 150 and name ha  )  5.5  5.5  0.0
assign (resid 139 and name hn  ) (resid 158 and name ha  )  3.5  3.5  0.0
assign (resid 136 and name ha  ) (resid 159 and name hn  )  5.5  5.5  0.0
assign (resid 136 and name ha  ) (resid 161 and name hn  )  3.5  3.5  0.0
assign (resid 136 and name hn  ) (resid 160 and name ha  )  4.5  4.5  1.0
assign (resid 137 and name hn  ) (resid 158 and name ha  )  4.5  4.5  0.0
assign (resid 137 and name hn  ) (resid 160 and name ha  )  4.5  4.5  0.0
assign (resid 138 and name ha  ) (resid 158 and name hn  )  5.5  5.5  0.0
assign (resid 138 and name ha  ) (resid 159 and name hn  )  4.5  4.5  0.0
assign (resid 138 and name hn  ) (resid 158 and name ha  )  5.5  5.5  0.0
assign (resid 140 and name hn  ) (resid 158 and name ha  )  5.5  5.5  0.0
assign (resid 143 and name hn  ) (resid 154 and name ha  )  5.5  5.5  0.0
assign (resid 144 and name hn  ) (resid 154 and name ha  )  3.5  3.5  0.0
assign (resid 145 and name ha  ) (resid 153 and name hn  )  4.5  4.5  0.0
assign (resid 146 and name hn  ) (resid 152 and name ha  )  4.5  4.5  0.0
!nh(i)-nh(j)
assign (resid   2 and name hn  ) (resid  96 and name hn  )  3.5  3.5  0.5
assign (resid   3 and name hn  ) (resid 112 and name hn  )  5.5  5.5  0.0
assign (resid   3 and name hn  ) (resid 114 and name hn  )  5.5  5.5  0.0
assign (resid   4 and name hn  ) (resid  96 and name hn  )  5.5  5.5  0.0
assign (resid   4 and name hn  ) (resid  97 and name hn  )  5.5  5.5  1.0
assign (resid   4 and name hn  ) (resid 114 and name hn  )  5.5  5.5  0.0
assign (resid   5 and name hn  ) (resid 116 and name hn  )  5.5  5.5  0.0
assign (resid   7 and name hn  ) (resid 116 and name hn  )  4.5  4.5  0.0
assign (resid   9 and name hn  ) (resid 118 and name hn  )  5.5  5.5  0.0
assign (resid   9 and name hn  ) (resid 122 and name hn  )  5.5  5.5  0.0
assign (resid  12 and name ha  ) (resid 127 and name hn  )  5.5  5.5  0.0
assign (resid  13 and name hn  ) (resid 126 and name hn  )  5.5  5.5  1.0
assign (resid  13 and name hn  ) (resid 127 and name hn  )  5.5  5.5  0.0
assign (resid  14 and name hn  ) (resid 125 and name hn  )  5.5  5.5  0.0
assign (resid  14 and name hn  ) (resid 126 and name hn  )  4.5  4.5  0.0
assign (resid  15 and name hn  ) (resid 125 and name hn  )  5.5  5.5  0.0
assign (resid  16 and name hn  ) (resid 125 and name hn  )  4.5  4.5  0.5
assign (resid  36 and name hn  ) (resid  58 and name hn  )  5.5  5.5  0.0
assign (resid  38 and name hn  ) (resid  95 and name hn  )  4.5  4.5  0.0
assign (resid  39 and name hn  ) (resid  58 and name hn  )  4.5  4.5  0.0
assign (resid  39 and name hn  ) (resid  60 and name hn  )  5.5  5.5  0.0
assign (resid  40 and name hn  ) (resid  95 and name hn  )  4.5  4.5  0.0
assign (resid  41 and name hn  ) (resid  62 and name hn  )  4.5  4.5  0.0
assign (resid  42 and name hn  ) (resid  99 and name hn  )  3.5  3.5  0.0
assign (resid  63 and name hn  ) (resid  76 and name hn  )  5.5  5.5  0.0
assign (resid 112 and name hn  ) (resid 160 and name hn  )  5.5  5.5  0.5
assign (resid 113 and name hn  ) (resid 158 and name hn  )  3.5  3.5  0.0
assign (resid 113 and name hn  ) (resid 160 and name hn  )  5.5  5.5  0.0
assign (resid 115 and name hn  ) (resid 156 and name hn  )  5.5  5.5  0.0
assign (resid 117 and name hn  ) (resid 154 and name hn  )  3.5  3.5  0.0
assign (resid 119 and name hn  ) (resid 152 and name hn  )  5.5  5.5  0.0
assign (resid 119 and name hn  ) (resid 153 and name hn  )  5.5  5.5  0.0
assign (resid 120 and name hn  ) (resid 151 and name hn  )  5.5  5.5  0.0
assign (resid 137 and name hn  ) (resid 159 and name hn  )  3.5  3.5  0.0
assign (resid 137 and name hn  ) (resid 161 and name hn  )  5.5  5.5  0.0
assign (resid 139 and name hn  ) (resid 157 and name hn  )  5.5  5.5  0.0
assign (resid 139 and name hn  ) (resid 159 and name hn  )  5.5  5.5  0.0
assign (resid 142 and name hn  ) (resid 155 and name hn  )  4.5  4.5  0.0
assign (resid 144 and name hn  ) (resid 153 and name hn  )  4.5  4.5  0.0
assign (resid 146 and name hn  ) (resid 152 and name hn  )  5.5  5.5  0.0
!nh(i)-hb(j)
assign (resid   1 and name hb  ) (resid 111 and name hn  )  4.5  4.5  0.0
assign (resid   2 and name hn  ) (resid 112 and name hb  )  5.5  5.5  0.5
assign (resid   3 and name hn  ) (resid 112 and name hb  )  4.5  4.5  0.0
assign (resid   3 and name hb1 ) (resid 114 and name hn  )  5.5  5.5  0.0
assign (resid   3 and name hb2 ) (resid 114 and name hn  )  4.5  4.5  0.0
assign (resid   4 and name hn  ) (resid  96 and name hb  )  4.5  4.5  0.5
assign (resid   5 and name hn  ) (resid 114 and name hb1 )  5.5  5.5  0.0
assign (resid   5 and name hn  ) (resid 114 and name hb2 )  4.5  4.5  0.0
assign (resid   7 and name hn  ) (resid 116 and name hb  )  3.5  3.5  0.0
assign (resid  13 and name hn  ) (resid 126 and name hb  )  4.5  4.5  0.0
assign (resid  15 and name hb1 ) (resid 125 and name hn  )  5.5  5.5  0.0
assign (resid  15 and name hb2 ) (resid 125 and name hn  )  4.0  4.0  0.0
assign (resid  36 and name hn  ) (resid  56 and name hb1 )  5.5  5.5  0.0
assign (resid  38 and name hn  ) (resid  93 and name hb* )  4.5  4.5  1.0
assign (resid  41 and name hb  ) (resid  46 and name hn  )  4.5  4.5  0.0
assign (resid  43 and name hn  ) (resid  63 and name hb  )  4.5  4.5  0.0
assign (resid  59 and name hn  ) (resid  73 and name hb* )  4.5  4.5  1.0
assign (resid  61 and name hb  ) (resid  76 and name hn  )  5.5  5.5  0.0
assign (resid 111 and name hb* ) (resid 160 and name hn  )  4.5  4.5  0.0
assign (resid 113 and name hb1 ) (resid 158 and name hn  )  5.5  5.5  0.0
assign (resid 113 and name hb2 ) (resid 158 and name hn  )  5.5  5.5  0.0
assign (resid 113 and name hn  ) (resid 158 and name hb1 )  5.5  5.5  0.0
assign (resid 113 and name hn  ) (resid 158 and name hb2 )  4.5  4.5  0.0
assign (resid 117 and name hb* ) (resid 154 and name hn  )  5.5  5.5  0.0
assign (resid 119 and name hb* ) (resid 152 and name hn  )  5.5  5.5  0.0
assign (resid 119 and name hn  ) (resid 153 and name hb* )  5.5  5.5  0.0
assign (resid 121 and name hn  ) (resid 150 and name hb* )  4.5  4.5  1.0
assign (resid 136 and name hb* ) (resid 159 and name hn  )  5.5  5.5  0.0
assign (resid 137 and name hb  ) (resid 159 and name hn  )  4.5  4.5  0.0
assign (resid 137 and name hn  ) (resid 159 and name hb* )  6.0  6.0  0.0
assign (resid 140 and name hn  ) (resid 157 and name hb  )  4.5  4.5  0.0
assign (resid 144 and name hb  ) (resid 153 and name hn  )  5.5  5.5  0.5
assign (resid 146 and name hb1 ) (resid 152 and name hn  )  5.5  5.5  0.0
assign (resid 146 and name hb2 ) (resid 152 and name hn  )  4.5  4.5  0.5
assign (resid 146 and name hn  ) (resid 152 and name hb  )  5.5  5.5  0.0
!ha(i)-ha(j)
assign (resid   2 and name ha  ) (resid 112 and name ha  )  5.5  5.5  0.0
assign (resid   6 and name ha  ) (resid 115 and name ha  )  5.5  5.5  0.0  
assign (resid   7 and name ha  ) (resid  13 and name ha  )  2.5  2.5  0.5
assign (resid   8 and name ha  ) (resid 121 and name ha  )  5.5  5.5  0.5
assign (resid  12 and name ha  ) (resid 127 and name ha  )  3.5  3.5  0.0
assign (resid  15 and name ha  ) (resid 124 and name ha* )  4.5  4.5  1.0
assign (resid  35 and name ha  ) (resid  57 and name ha  )  5.5  5.5  0.0
assign (resid  64 and name ha  ) (resid  77 and name ha  )  4.5  4.5  0.0
assign (resid  41 and name ha  ) (resid  98 and name ha* )  5.5  5.5  0.0
assign (resid  41 and name ha  ) (resid  45 and name ha  ) 10.0  4.5  0.0   
assign (resid 114 and name ha  ) (resid 157 and name ha  )  3.5  3.5  0.0
assign (resid 116 and name ha  ) (resid 155 and name ha  )  3.5  3.5  0.0
assign (resid 118 and name ha  ) (resid 153 and name ha  )  3.5  3.5  0.0
assign (resid 136 and name ha  ) (resid 160 and name ha  )  3.5  3.5  0.0
assign (resid 138 and name ha  ) (resid 158 and name ha  )  2.5  2.5  0.0
assign (resid 143 and name ha  ) (resid 154 and name ha  )  2.5  2.5  0.0
assign (resid 145 and name ha  ) (resid 152 and name ha  )  3.5  3.5  0.0
!ha(i)-hb(j)
assign (resid   1 and name ha  ) (resid  94 and name hb1 )  3.5  3.5  0.0
assign (resid   1 and name ha  ) (resid  94 and name hb2 )  4.5  4.5  0.0
assign (resid   1 and name hb  ) (resid 110 and name ha  )  2.5  2.5  0.5
assign (resid   2 and name hb* ) (resid  95 and name ha  )  3.5  3.5  1.0
assign (resid   2 and name ha  ) (resid 112 and name hb  )  3.5  3.5  0.0 
assign (resid   3 and name ha  ) (resid  96 and name hb  )  3.5  3.5  0.0 
assign (resid   4 and name hb1 ) (resid  97 and name ha  )  3.5  3.5  0.0 
assign (resid   4 and name ha  ) (resid 114 and name hb1 )  4.5  4.5  0.0 
assign (resid   4 and name ha  ) (resid 114 and name hb2 )  2.5  2.5  0.5 
assign (resid   6 and name ha  ) (resid 116 and name hb  )  2.5  2.5  0.0
assign (resid  38 and name hb  ) (resid  94 and name ha  )  4.5  4.5  0.0
assign (resid  39 and name ha  ) (resid  95 and name hb  )  3.5  3.5  0.0
assign (resid  59 and name hb1 ) (resid  73 and name ha  )  4.5  4.5  0.0 
assign (resid  59 and name hb2 ) (resid  73 and name ha  )  3.5  3.5  0.0 
assign (resid  61 and name hb  ) (resid  75 and name ha  )  3.5  3.5  0.0
assign (resid  64 and name ha  ) (resid  77 and name hb* )  5.5  5.5  1.0
assign (resid 111 and name ha  ) (resid 160 and name hb1 )  4.5  4.5  0.0
assign (resid 111 and name ha  ) (resid 160 and name hb2 )  2.5  2.5  0.5
assign (resid 118 and name hb* ) (resid 153 and name ha  )  4.5  4.5  1.0
assign (resid 119 and name hb* ) (resid 153 and name ha  )  5.5  5.5  0.0
!other long-range noes
assign (resid   1 and name hg2*) (resid  96 and name hd1*)  2.5  2.5  2.0
assign (resid   1 and name hg2*) (resid 110 and name ha  )  3.5  3.5  1.0
assign (resid   2 and name ha  ) (resid 110 and name hg2*)  4.5  4.5  0.5 
assign (resid   2 and name hb* ) (resid 112 and name hb  )  3.5  3.5  0.5 
assign (resid   3 and name hn  ) (resid 110 and name hg2*)  3.5  3.5  1.0
assign (resid   3 and name ha  ) (resid 103 and name hz  )  5.5  5.5  0.0 
assign (resid   3 and name ha  ) (resid  96 and name hg1*)  4.5  4.5  1.0
assign (resid   3 and name ha  ) (resid  96 and name hg2*)  4.5  4.5  1.0
assign (resid   3 and name hb1 ) (resid 113 and name hd2*)  4.5  4.5  1.0
assign (resid   3 and name hb2 ) (resid 113 and name hd2*)  3.5  3.5  1.0
assign (resid   3 and name hz  ) (resid 106 and name hb2 )  4.5  4.5  0.0 
assign (resid   3 and name hz  ) (resid 107 and name ha  )  2.5  2.5  0.5 
assign (resid   3 and name hz  ) (resid 107 and name hb* )  4.5  4.5  1.0 
assign (resid   3 and name hz  ) (resid 108 and name hn  )  5.5  5.5  0.5
assign (resid   3 and name hz  ) (resid 109 and name hn  )  5.5  5.5  0.0
assign (resid   3 and name hz  ) (resid 110 and name hb  )  4.5  4.5  0.0 
assign (resid   3 and name hz  ) (resid 110 and name hg1*)  4.5  4.5  1.0 
assign (resid   3 and name hz  ) (resid 129 and name hd1*)  5.5  5.5  1.0 
assign (resid   4 and name ha  ) (resid 114 and name hd1*)  4.5  4.5  1.0
assign (resid   4 and name hd1*) (resid  97 and name ha  )  5.5  5.5  1.5 
assign (resid   4 and name hd2*) (resid  97 and name ha  )  4.5  4.5  1.0 
assign (resid   4 and name hd1*) (resid 114 and name hb* )  2.5  2.5  2.0 
assign (resid   4 and name hn  ) (resid 103 and name hz  )  5.5  5.5  0.0
assign (resid   5 and name ha  ) (resid 103 and name hz  )  5.5  5.5  0.0 
assign (resid   5 and name hb* ) (resid 103 and name hz  )  2.5  2.5  1.0 
assign (resid   5 and name hd1 ) (resid  13 and name hg2*)  2.5  2.5  1.0
assign (resid   5 and name hd1 ) (resid 115 and name hg2*)  4.5  4.5  1.0
assign (resid   5 and name he1 ) (resid  13 and name hg2*)  4.5  4.5  1.0
assign (resid   5 and name he1 ) (resid 115 and name hb  )  5.5  5.5  0.0
assign (resid   5 and name he1 ) (resid 115 and name hg2*)  3.5  3.5  1.0
assign (resid   5 and name he1 ) (resid 128 and name he* )  5.5  5.5  1.5
assign (resid   5 and name he1 ) (resid 128 and name hg* )  5.5  5.5  0.0
assign (resid   5 and name he1 ) (resid 133 and name hh2 )  5.5  5.5  0.0
assign (resid   5 and name he3 ) (resid 114 and name hn  )  4.5  4.5  0.0
assign (resid   5 and name he3 ) (resid 128 and name he* )  5.5  5.5  0.0
assign (resid   5 and name hz2 ) (resid 113 and name hd1*)  5.5  5.5  1.0
assign (resid   5 and name hz2 ) (resid 113 and name hd2*)  5.5  5.5  0.5
assign (resid   5 and name hz2 ) (resid 115 and name hb  )  3.5  3.5  0.0 
assign (resid   5 and name hz2 ) (resid 115 and name hg2*)  4.5  4.5  1.0
assign (resid   5 and name hz2 ) (resid 128 and name he* )  5.5  5.5  0.5
assign (resid   5 and name hz2 ) (resid 131 and name hd1*)  3.5  3.5  1.0
assign (resid   5 and name hz2 ) (resid 133 and name hz2 )  3.5  3.5  0.0 
assign (resid   5 and name hz3 ) (resid 113 and name ha  )  3.5  3.5  0.0 
assign (resid   5 and name hz3 ) (resid 113 and name hb1 )  3.5  3.5  0.5 
assign (resid   5 and name hz3 ) (resid 113 and name hb2 )  5.5  5.5  0.0 
assign (resid   5 and name hz3 ) (resid 113 and name hd1*)  5.5  5.5  1.0 
assign (resid   5 and name hz3 ) (resid 113 and name hd2*)  2.5  2.5  1.0 
assign (resid   5 and name hz3 ) (resid 114 and name hn  )  3.5  3.5  1.0
assign (resid   5 and name hz3 ) (resid 128 and name he* )  5.5  5.5  1.0 
assign (resid   5 and name hh2 ) (resid 113 and name hb1 )  2.5  2.5  0.0
assign (resid   5 and name hh2 ) (resid 113 and name hb2 )  4.5  4.5  0.0 
assign (resid   5 and name hh2 ) (resid 113 and name hd2*)  3.5  3.5  1.0 
assign (resid   5 and name hh2 ) (resid 115 and name hb  )  4.5  4.5  0.0 
assign (resid   5 and name hh2 ) (resid 115 and name hg2*)  4.5  4.5  1.0 
assign (resid   5 and name hh2 ) (resid 131 and name hd1*)  2.5  2.5  1.0 
assign (resid   6 and name ha  ) (resid 115 and name hg2*)  5.5  5.5  1.0
assign (resid   6 and name ha  ) (resid 116 and name hg2*)  4.5  4.5  1.0 
assign (resid   6 and name ha  ) (resid 118 and name hd1*)  6.5  6.5  0.0
assign (resid   6 and name hb* ) (resid  21 and name hz2 )  2.5  2.5  1.0 
assign (resid   6 and name hb* ) (resid 116 and name hb  )  5.5  5.5  0.0 
assign (resid   6 and name hb* ) (resid 116 and name hg2*)  5.5  5.5  1.0 
assign (resid   6 and name hb* ) (resid 118 and name hd1*)  3.5  3.5  2.5
assign (resid   7 and name hn  ) (resid  21 and name hh2 )  5.5  5.5  0.0
assign (resid   7 and name hn  ) (resid  21 and name hz2 )  4.5  4.5  0.0
assign (resid   7 and name hn  ) (resid 118 and name hd1*)  4.5  4.5  1.0
assign (resid   7 and name hn  ) (resid 115 and name hg2*)  5.5  5.5  0.0
assign (resid   7 and name hn  ) (resid 116 and name hg2*)  6.5  6.5  0.0
assign (resid   7 and name ha  ) (resid  13 and name hg2*)  3.5  3.5  1.0 
assign (resid   7 and name ha  ) (resid  21 and name hz2 )  4.5  4.5  0.0
assign (resid   7 and name ha  ) (resid  21 and name hh2 )  3.5  3.5  0.0
assign (resid   7 and name ha  ) (resid  21 and name hz3 )  5.5  5.5  0.0
assign (resid   7 and name hg* ) (resid 117 and name ha  )  3.5  3.5  1.0
assign (resid   7 and name he2*) (resid 117 and name hg* )  3.5  3.5  2.0
assign (resid   8 and name hn  ) (resid  21 and name hz2 )  5.5  5.5  1.0
assign (resid   8 and name hn  ) (resid  21 and name hz3 )  4.5  4.5  0.0
assign (resid   8 and name hn  ) (resid  21 and name hh2 )  4.5  4.5  0.0
assign (resid   8 and name ha  ) (resid 118 and name hb2 )  3.5  3.5  0.0
assign (resid   8 and name ha  ) (resid 118 and name hd1*)  5.5  5.5  0.0
assign (resid   8 and name ha  ) (resid 118 and name hd2*)  5.5  5.5  0.0
assign (resid   8 and name hb1 ) (resid  21 and name hz3 )  3.5  3.5  0.0 
assign (resid   8 and name hb2 ) (resid  21 and name hz3 )  5.5  5.5  0.0 
assign (resid   9 and name hg* ) (resid 121 and name hn  )  5.5  5.5  0.0
assign (resid   9 and name hg* ) (resid 121 and name ha  )  3.5  3.5  1.0
assign (resid  12 and name hn  ) (resid 127 and name hg* )  6.5  6.5  0.0
assign (resid  12 and name hb* ) (resid  21 and name hz3 )  4.5  4.5  1.0 
assign (resid  12 and name hg  ) (resid 126 and name hn  )  4.5  4.5  0.0
assign (resid  12 and name hd1*) (resid 124 and name hn  )  4.5  4.5  1.0
assign (resid  12 and name hd1*) (resid 125 and name hn  )  4.5  4.5  1.0
assign (resid  12 and name hd1*) (resid 126 and name hn  )  4.5  4.5  1.0
assign (resid  12 and name hd2*) (resid  21 and name hz3 )  3.5  3.5  1.0
assign (resid  12 and name hd2*) (resid  21 and name he3 )  5.5  5.5  0.0
assign (resid  12 and name hd2*) (resid 122 and name hb* )  2.5  2.5  2.0
assign (resid  12 and name hd2*) (resid 124 and name hn  )  4.5  4.5  1.0
assign (resid  12 and name hd2*) (resid 126 and name hn  )  6.5  6.5  0.0
assign (resid  13 and name ha  ) (resid  21 and name hh2 )  3.5  3.5  0.5 
assign (resid  13 and name ha  ) (resid  21 and name he3 )  5.5  5.5  1.5 
assign (resid  13 and name ha  ) (resid  21 and name hz2 )  5.5  5.5  0.5 
assign (resid  13 and name ha  ) (resid  21 and name hz3 )  5.5  5.5  0.0
assign (resid  13 and name hg1*) (resid 128 and name hn  )  5.5  5.5  0.0
assign (resid  13 and name hg2*) (resid  21 and name hz3 )  5.5  5.5  1.5  
assign (resid  13 and name hg2*) (resid 128 and name hb2 )  3.5  3.5  1.0  
assign (resid  13 and name hd1*) (resid 100 and name hn  )  4.5  4.5  1.0
assign (resid  13 and name hd1*) (resid 126 and name hg2*)  2.5  2.5  2.0
assign (resid  14 and name hn  ) (resid  20 and name hd* )  5.5  5.5  0.0
assign (resid  14 and name hn  ) (resid 126 and name hg2*)  5.5  5.5  1.0
assign (resid  15 and name hn  ) (resid  20 and name hd* )  5.5  5.5  0.0
assign (resid  15 and name hg* ) (resid 125 and name hn  )  4.5  4.5  1.0
assign (resid  20 and name hb* ) (resid 122 and name hb* )  4.5  4.5  1.0 
assign (resid  21 and name hb2 ) (resid 151 and name hd2*)  3.5  3.5  1.0 
assign (resid  21 and name hd1 ) (resid  26 and name hb1 )  6.5  6.5  0.0 
assign (resid  21 and name hd1 ) (resid 118 and name hd2*)  4.5  4.5  0.0 
assign (resid  21 and name hd1 ) (resid 151 and name hd2*)  4.5  4.5  1.0 
assign (resid  21 and name he1 ) (resid 118 and name hd1*)  5.5  5.5  1.0 
assign (resid  21 and name he1 ) (resid 118 and name hd2*)  5.5  5.5  1.0 
assign (resid  21 and name he3 ) (resid 118 and name hd2*)  5.5  5.5  1.0 
assign (resid  21 and name he3 ) (resid 122 and name hb1 )  5.5  5.5  0.0  
assign (resid  21 and name he3 ) (resid 122 and name hb2 )  5.5  5.5  0.0  
assign (resid  21 and name hz2 ) (resid 118 and name hd1*)  4.5  4.5  1.0 
assign (resid  21 and name hz2 ) (resid 118 and name hd2*)  6.0  6.0  1.0 
assign (resid  21 and name hz3 ) (resid 122 and name hb2 )  5.5  5.5  0.0  
assign (resid  22 and name hd2 ) (resid  27 and name hd1*)  5.5  5.5  1.0  
assign (resid  22 and name he1 ) (resid  27 and name hd1*)  3.5  3.5  1.0  
assign (resid  22 and name he1 ) (resid  27 and name hd2*)  5.5  5.5  1.0  
assign (resid  23 and name hg  ) (resid 153 and name hd2 )  5.5  5.5  0.5
assign (resid  23 and name hd1*) (resid 153 and name he1 )  3.5  3.5  1.0
assign (resid  23 and name hd1*) (resid 153 and name hd2 )  5.5  5.5  1.0
assign (resid  23 and name hd1*) (resid 118 and name hd1*)  5.5  5.5  0.5 
assign (resid  23 and name hd2*) (resid 116 and name hg2*)  4.5  4.5  1.0 
assign (resid  23 and name hd2*) (resid 118 and name hd1*)  3.5  3.5  1.0
assign (resid  23 and name hd2*) (resid 118 and name hd2*)  3.5  3.5  1.0
assign (resid  23 and name hd2*) (resid 151 and name hd2*)  4.5  4.5  1.5
assign (resid  23 and name hd2*) (resid 153 and name he1 )  4.5  4.5  1.0
assign (resid  23 and name hd2*) (resid 153 and name hd2 )  5.5  5.5  1.0
assign (resid  25 and name hb1 ) (resid 153 and name he1 )  5.5  2.0  1.0  
assign (resid  25 and name hb2 ) (resid 153 and name he1 )  4.5  4.5  1.0  
assign (resid  26 and name hb1 ) (resid 116 and name hg2*)  5.5  5.5  1.0 
assign (resid  26 and name hb2 ) (resid 116 and name hg2*)  3.5  3.5  1.0 
assign (resid  26 and name hb2 ) (resid 153 and name he1 )  4.5  4.5  1.0 
assign (resid  30 and name hz  ) (resid  41 and name hg1*)  4.5  4.5  0.5 
assign (resid  30 and name hz  ) (resid  54 and name hd1*)  5.5  5.5  1.0 
assign (resid  30 and name hz  ) (resid  97 and name hb* )  4.5  4.5  1.0 
assign (resid  35 and name ha  ) (resid  57 and name he  )  5.5  5.5  0.0
assign (resid  35 and name ha  ) (resid  57 and name hd* )  5.5  5.5  1.0
assign (resid  37 and name ha  ) (resid  92 and name he2*)  4.5  4.5  1.0
assign (resid  38 and name hg1*) (resid  92 and name hn  )  5.5  5.5  1.0
assign (resid  38 and name hg1*) (resid  92 and name he2*)  4.5  4.5  2.0
assign (resid  38 and name hd1*) (resid  92 and name he2*)  5.5  5.5  2.0
assign (resid  38 and name hd1*) (resid  86 and name ha  )  2.5  2.5  1.0 
assign (resid  38 and name hd1*) (resid  89 and name hb2 )  3.5  3.5  1.0 
assign (resid  39 and name hb* ) (resid  54 and name hd1*)  4.5  4.5  1.0
assign (resid  39 and name he* ) (resid  54 and name hg  )  3.5  3.5  1.0
assign (resid  39 and name he* ) (resid  54 and name hd1*)  2.5  2.5  1.0
assign (resid  39 and name he* ) (resid  59 and name ha  )  2.5  2.5  1.0
assign (resid  39 and name he* ) (resid  59 and name hb* )  3.5  3.5  2.0
assign (resid  39 and name he* ) (resid  59 and name hd2*)  3.5  3.5  1.0
assign (resid  39 and name hb* ) (resid  59 and name ha  )  5.5  5.5  1.0
assign (resid  39 and name he* ) (resid  54 and name hn  )  5.5  5.5  0.0
assign (resid  40 and name ha  ) (resid  60 and name hg2*)  5.5  5.5  1.0  
assign (resid  40 and name hg2*) (resid  96 and name hd1*)  2.5  2.5  2.0  
assign (resid  40 and name hb  ) (resid  96 and name hd1*)  2.5  2.5  1.0  
assign (resid  41 and name hn  ) (resid  61 and name hg1*)  5.5  5.5  0.5
assign (resid  41 and name hn  ) (resid  61 and name hg2*)  5.5  5.5  0.0
assign (resid  41 and name ha  ) (resid  97 and name hb* )  5.5  5.5  1.0
assign (resid  41 and name ha  ) (resid 102 and name hg2*)  3.5  3.5  1.0
assign (resid  41 and name hb  ) (resid  99 and name hn  )  5.5  5.5  0.5
assign (resid  41 and name hg1*) (resid  49 and name hz  )  4.5  4.5  1.0
assign (resid  41 and name hg2*) (resid  49 and name hz  )  3.5  3.5  1.0
assign (resid  41 and name hg2*) (resid  61 and name ha  )  3.5  3.5  1.0
assign (resid  41 and name hg2*) (resid  61 and name hg1*)  4.5  4.5  2.0
assign (resid  41 and name hg2*) (resid  61 and name hg2*)  2.5  2.5  2.0
assign (resid  41 and name hg1*) (resid  97 and name hn  )  4.5  4.5  1.0
assign (resid  41 and name hg1*) (resid  98 and name hn  )  5.5  5.5  1.0
assign (resid  43 and name ha  ) (resid  61 and name hg1*)  2.5  2.5  1.0
assign (resid  43 and name ha  ) (resid  61 and name hg2*)  4.5  4.5  1.0
assign (resid  45 and name hg2*) (resid  99 and name hn  )  5.5  5.5  1.0
assign (resid  46 and name hn  ) (resid  61 and name hg1*)  5.5  5.5  1.0
assign (resid  46 and name hn  ) (resid  61 and name hg2*)  5.5  5.5  1.0
assign (resid  46 and name ha  ) (resid  61 and name hg1*)  5.5  5.5  1.0
assign (resid  46 and name ha  ) (resid  61 and name hg2*)  5.5  5.5  1.0
assign (resid  47 and name ha  ) (resid  52 and name he  )  3.5  3.5  0.0
assign (resid  47 and name ha  ) (resid  52 and name hd* )  3.5  3.5  1.0
assign (resid  49 and name hz  ) (resid  54 and name hd1*)  4.5  4.5  1.0
assign (resid  54 and name hb* ) (resid  59 and name hd2*)  3.5  3.5  2.0
assign (resid  58 and name hb  ) (resid  92 and name he2*)  5.5  5.5  1.0
assign (resid  59 and name hb2 ) (resid  73 and name hb* )  3.5  3.5  1.0
assign (resid  60 and name hg1*) (resid  74 and name ha  )  5.5  5.5  1.0
assign (resid  60 and name hg2*) (resid  74 and name ha  )  5.5  5.5  1.0
assign (resid  60 and name hg1*) (resid  74 and name hb  )  4.5  4.5  1.0
assign (resid  60 and name hg2*) (resid  74 and name hb  )  3.5  3.5  1.0
assign (resid  61 and name hb  ) (resid  70 and name hb* )  5.5  5.5  1.0 
assign (resid  61 and name hg2*) (resid  70 and name hb* )  3.5  3.5  1.0 
assign (resid  61 and name hg1*) (resid  75 and name hg1*)  5.5  5.5  1.0 
assign (resid  61 and name hg2*) (resid  75 and name hg2*)  4.5  4.5  1.0 
assign (resid  61 and name hg2*) (resid  73 and name ha  )  5.5  5.5  1.0 
assign (resid  61 and name hg2*) (resid  73 and name hb* )  2.5  2.5  2.0
assign (resid  62 and name ha  ) (resid  76 and name hg2*)  3.5  3.5  1.0 
assign (resid  62 and name hd1*) (resid  77 and name ha  )  3.5  3.5  1.0 
assign (resid  62 and name hd1*) (resid  77 and name hn  )  4.5  4.5  1.0
assign (resid  62 and name hd1*) (resid  78 and name hn  )  4.5  4.5  1.0
assign (resid  62 and name hd1*) (resid  78 and name ha  )  3.5  3.5  1.0 
assign (resid  62 and name hd1*) (resid  79 and name ha  )  4.5  4.5  1.0 
assign (resid  63 and name hg2*) (resid  68 and name hb* )  4.5  4.5  2.0
assign (resid  63 and name hg2*) (resid  77 and name ha  )  5.5  5.5  1.0 
assign (resid  63 and name hg2*) (resid  77 and name he1 )  3.5  3.5  1.0 
assign (resid  66 and name ha  ) (resid  77 and name he1 )  4.5  4.5  0.0 
assign (resid  66 and name hg* ) (resid  77 and name he1 )  4.5  4.5  1.0 
assign (resid  68 and name hb1 ) (resid  77 and name he1 )  4.5  4.5  0.5 
assign (resid  68 and name hb2 ) (resid  77 and name he1 )  5.5  5.5  0.5 
assign (resid  79 and name ha  ) (resid 106 and name hz  )  3.5  3.5  0.0 
assign (resid  82 and name hn  ) (resid 106 and name hz  )  5.5  5.5  0.0
assign (resid  82 and name hg2*) (resid 106 and name hz  )  2.5  2.5  1.0 
assign (resid  96 and name hg2*) (resid 106 and name hn  )  6.0  6.0  0.0
assign (resid  96 and name hd1*) (resid 102 and name hb  )  5.5  5.5  0.5
assign (resid  96 and name hd1*) (resid 106 and name hb* )  4.5  4.5  2.0
assign (resid  96 and name hd1*) (resid 106 and name hz  )  5.5  5.5  1.0 
assign (resid 100 and name hn  ) (resid 126 and name hg2*)  5.5  5.5  0.0
assign (resid 100 and name hb* ) (resid 126 and name hg2*)  2.5  2.5  2.0
assign (resid 100 and name hb* ) (resid 129 and name hg2*)  3.5  3.5  2.0
assign (resid 103 and name ha  ) (resid 128 and name he* )  5.5  5.5  0.5
assign (resid 103 and name hb1 ) (resid 128 and name he* )  3.5  3.5  1.0
assign (resid 103 and name hb2 ) (resid 128 and name he* )  4.5  4.5  1.0
assign (resid 103 and name hb* ) (resid 129 and name hd1*)  5.5  5.5  1.0
assign (resid 104 and name hn  ) (resid 129 and name hg2*)  4.5  4.5  1.0
assign (resid 104 and name hn  ) (resid 129 and name hd1*)  4.5  4.5  1.0
assign (resid 107 and name hn  ) (resid 129 and name hd1*)  5.5  5.5  1.0
assign (resid 110 and name hg1*) (resid 136 and name hz  )  2.5  2.5  1.0
assign (resid 111 and name ha  ) (resid 160 and name hd* )  4.5  4.5  1.0
assign (resid 111 and name hb1 ) (resid 160 and name hn  )  5.5  5.5  0.0
assign (resid 111 and name hb2 ) (resid 160 and name hn  )  5.5  5.5  0.0
assign (resid 112 and name hg2*) (resid 159 and name ha  )  4.5  4.5  1.0
assign (resid 113 and name hb1 ) (resid 158 and name hd1 )  5.5  5.5  0.0 
assign (resid 113 and name hb2 ) (resid 158 and name hd1 )  3.5  3.5  0.5
assign (resid 113 and name hg  ) (resid 159 and name ha  )  5.5  5.5  0.0
assign (resid 113 and name hd1*) (resid 131 and name hd2*)  5.6  5.6  1.0
assign (resid 113 and name hd1*) (resid 131 and name hd1*)  5.6  5.6  1.0
assign (resid 113 and name hd1*) (resid 133 and name he3 )  4.5  4.5  1.0
assign (resid 113 and name hd1*) (resid 133 and name hz2 )  5.5  5.5  1.0
assign (resid 113 and name hd1*) (resid 133 and name hz3 )  3.5  3.5  1.0
assign (resid 113 and name hd1*) (resid 133 and name hh2 )  4.5  4.5  0.5
assign (resid 113 and name hd1*) (resid 158 and name hb1 )  5.5  5.5  0.0
assign (resid 113 and name hd1*) (resid 158 and name hb2 )  3.5  3.5  0.5
assign (resid 113 and name hd1*) (resid 158 and name he3 )  4.5  4.5  1.5
assign (resid 113 and name hd2*) (resid 131 and name hd2*)  3.5  3.5  1.0
assign (resid 114 and name hd2*) (resid 157 and name ha  )  3.5  3.5  1.0
assign (resid 114 and name hd2*) (resid 157 and name hb  )  4.5  4.5  1.0
assign (resid 114 and name hd2*) (resid 158 and name hn  )  4.5  4.5  0.5
assign (resid 115 and name hg1*) (resid 158 and name hd1 )  3.5  3.5  1.0 
assign (resid 115 and name hg1*) (resid 133 and name hh2 )  3.5  3.5  1.0 
assign (resid 115 and name hg2*) (resid 133 and name hh2 )  3.5  3.5  1.0 
assign (resid 116 and name hg2*) (resid 153 and name ha  )  4.5  4.5  1.0
assign (resid 116 and name hg2*) (resid 154 and name hn  )  4.5  4.5  1.0
assign (resid 116 and name hg2*) (resid 153 and name hb2 )  3.5  3.5  1.0
assign (resid 116 and name hg2*) (resid 153 and name hd2 )  2.5  2.5  1.0
assign (resid 117 and name hn  ) (resid 153 and name hd2 )  5.5  5.5  1.0
assign (resid 118 and name hg  ) (resid 153 and name ha  )  4.5  4.5  0.0
assign (resid 118 and name hd1*) (resid 153 and name ha  )  5.5  5.5  0.0
assign (resid 118 and name hd1*) (resid 153 and name hb1 )  3.5  3.5  1.0 
assign (resid 118 and name hd1*) (resid 153 and name hb2 )  3.5  3.5  1.0 
assign (resid 118 and name hd1*) (resid 153 and name hd2 )  5.5  5.5  1.0 
assign (resid 118 and name hd1*) (resid 151 and name ha  )  5.5  5.5  1.0
assign (resid 118 and name hd2*) (resid 151 and name ha  )  3.5  3.5  1.0
assign (resid 118 and name hd2*) (resid 151 and name hd2*)  4.5  4.5  1.0
assign (resid 122 and name hz  ) (resid 150 and name hb* )  2.5  2.5  1.5 
assign (resid 122 and name hz  ) (resid 151 and name hg  )  5.5  5.5  0.0 
assign (resid 122 and name hz  ) (resid 151 and name hd2*)  3.5  3.5  1.5 
assign (resid 133 and name he3 ) (resid 158 and name he3 )  5.5  5.5  0.0 
assign (resid 133 and name he3 ) (resid 158 and name hz3 )  4.5  4.5  0.0 
assign (resid 133 and name hz3 ) (resid 158 and name hd1 )  4.5  4.5  0.0 
assign (resid 133 and name hz3 ) (resid 158 and name he1 )  5.5  5.5  0.0
assign (resid 136 and name ha  ) (resid 158 and name he3 )  5.5  5.5  2.0
assign (resid 136 and name hn  ) (resid 158 and name he3 )  3.5  3.5  2.0
assign (resid 136 and name hb1 ) (resid 158 and name he3 )  2.5  2.5  0.0  
assign (resid 136 and name hb2 ) (resid 158 and name he3 )  3.5  3.5  0.0  
assign (resid 136 and name hb1 ) (resid 158 and name hz3 )  5.5  5.5  0.0  
assign (resid 136 and name hb2 ) (resid 158 and name hz3 )  4.5  4.5  0.0  
assign (resid 137 and name hn  ) (resid 158 and name he3 )  3.5  3.5  0.0
assign (resid 137 and name ha  ) (resid 158 and name he3 )  5.5  5.5  0.0
assign (resid 137 and name ha  ) (resid 158 and name hz3 )  4.5  4.5  0.0 
assign (resid 137 and name hg2*) (resid 159 and name hn  )  5.5  5.5  1.0
assign (resid 138 and name hn  ) (resid 158 and name he3 )  4.5  4.5  0.0
assign (resid 138 and name ha  ) (resid 158 and name hd1 )  5.5  5.5  0.0 
assign (resid 138 and name ha  ) (resid 158 and name he3 )  5.5  5.5  0.0 
assign (resid 138 and name hb* ) (resid 158 and name hz3 )  5.5  5.5  1.0
assign (resid 138 and name hg1 ) (resid 158 and name he1 )  5.5  5.5  0.0
assign (resid 138 and name hd* ) (resid 158 and name he1 )  4.5  4.5  1.0
assign (resid 138 and name he* ) (resid 158 and name hh2 )  5.5  5.5  0.0
assign (resid 138 and name he* ) (resid 158 and name hz2 )  4.5  4.5  1.0
assign (resid 142 and name hn  ) (resid 154 and name hg2*)  3.5  3.5  1.0
assign (resid 143 and name hn  ) (resid 154 and name hg2*)  5.5  5.5  0.0
assign (resid 143 and name ha  ) (resid 154 and name hg2*)  4.5  4.5  1.0
assign (resid 144 and name hg1*) (resid 153 and name hd2 )  3.5  3.5  1.0 
assign (resid 143 and name hg2*) (resid 154 and name hg2*)  2.5  2.5  2.0
assign (resid 144 and name hg2*) (resid 153 and name he1 )  3.5  3.5  1.0
assign (resid 144 and name hg2*) (resid 153 and name hd2 )  5.5  5.5  1.0 
assign (resid 145 and name ha  ) (resid 152 and name hg1 )  4.5  4.5  1.0 
assign (resid 145 and name ha  ) (resid 152 and name hg2*)  3.5  3.5  1.0 
assign (resid 145 and name hg* ) (resid 152 and name hg1 )  5.5  5.5  1.0
assign (resid 146 and name hb* ) (resid 151 and name hd1*)  4.5  4.5  2.0
assign (resid 146 and name hn  ) (resid 152 and name hg2*)  5.5  5.5  1.0
!medium-range noes
!r-6 averaging for aromatics and some others
assign (resid   1 and name hg2*) (resid   3 and name he* )  4.5  4.5  1.0 
assign (resid  19 and name hd* ) (resid  21 and name hn  )  5.5  5.5  1.0
assign (resid  19 and name hd* ) (resid  21 and name hd1 )  5.5  5.5  1.0
assign (resid  19 and name hd* ) (resid  21 and name he1 )  4.5  4.5  1.0
assign (resid  19 and name hd* ) (resid  21 and name hz2 )  5.5  5.5  1.0
assign (resid  26 and name ha  ) (resid  29 and name hd* )  5.5  5.5  0.0 
assign (resid  27 and name ha  ) (resid  30 and name hd* )  5.5  5.5  0.0
assign (resid  29 and name hd* ) (resid  32 and name hb* )  4.5  4.5  1.0
assign (resid  29 and name hd* ) (resid  33 and name hn  )  5.5  5.5  0.0
assign (resid  29 and name hd* ) (resid  33 and name hb2 )  5.5  5.5  0.0 
assign (resid  29 and name hd* ) (resid  33 and name hg* )  5.5  5.5  0.0 
assign (resid  29 and name he* ) (resid  33 and name hb2 )  4.5  4.5  1.0 
assign (resid  29 and name he* ) (resid  33 and name hg* )  4.5  4.5  0.0 
assign (resid  30 and name hd* ) (resid  34 and name hg2*)  5.5  5.5  0.0
assign (resid  30 and name he* ) (resid  34 and name hg2*)  4.5  4.5  0.0
assign (resid  32 and name ha  ) (resid  35 and name hg* )  3.5  3.5  0.0
assign (resid  43 and name ha  ) (resid  46 and name hd* )  4.5  4.5  0.0 
assign (resid  46 and name ha  ) (resid  49 and name hd* )  3.5  3.5  0.0 
assign (resid  46 and name ha  ) (resid  49 and name he* )  4.5  4.5  0.0 
assign (resid  46 and name hd* ) (resid  49 and name hd* )  4.5  4.5  0.0
assign (resid  46 and name hd* ) (resid  49 and name he* )  4.5  4.5  0.0
assign (resid  68 and name hd* ) (resid  70 and name hb* )  3.5  3.5  0.5 
assign (resid  68 and name he* ) (resid  70 and name ha  )  5.5  5.5  0.0 
assign (resid  68 and name he* ) (resid  70 and name hb* )  3.5  3.5  0.0 
assign (resid  75 and name hg* ) (resid  77 and name he1 )  4.5  4.5  0.0 
assign (resid  80 and name ha  ) (resid  83 and name hd* )  3.5  3.5  0.0
assign (resid  80 and name hn  ) (resid  83 and name hd* )  5.5  5.5  0.0
assign (resid  94 and name hb* ) (resid  96 and name hd1*)  5.5  5.5  0.5
assign (resid  94 and name hd* ) (resid  96 and name hd1*)  3.5  3.5  0.5
assign (resid 100 and name hn  ) (resid 103 and name hd* )  5.5  5.5  0.0
assign (resid 100 and name ha  ) (resid 103 and name he* )  5.5  5.5  0.0 
assign (resid 100 and name hb* ) (resid 103 and name hd* )  5.5  5.5  0.0 
assign (resid 106 and name hd* ) (resid 109 and name hb1 )  5.5  5.5  0.0 
assign (resid 106 and name hd* ) (resid 109 and name hb2 )  4.5  4.5  0.0 
assign (resid 107 and name ha  ) (resid 110 and name hg* )  3.5  3.5  0.5
assign (resid 110 and name hg* ) (resid 112 and name hn  )  4.5  4.5  0.0
assign (resid 110 and name hg* ) (resid 113 and name hd2*)  3.5  3.5  0.0
assign (resid 113 and name hb* ) (resid 115 and name hg* )  5.5  5.5  0.5
assign (resid 118 and name hb1 ) (resid 122 and name he* )  4.5  4.5  0.0 
assign (resid 118 and name hd1*) (resid 122 and name he* )  5.5  5.5  1.0 
assign (resid 118 and name hd2*) (resid 122 and name hd* )  4.5  4.5  0.5 
assign (resid 118 and name hd2*) (resid 122 and name he* )  3.5  3.5  0.0 
assign (resid 120 and name ha* ) (resid 122 and name he* )  5.5  5.5  0.0 
assign (resid 120 and name hn  ) (resid 122 and name he* )  4.5  4.5  0.0
assign (resid 133 and name ha  ) (resid 136 and name he* )  4.5  4.5  1.0 
assign (resid 134 and name hn  ) (resid 136 and name hd* )  4.5  4.5  1.0
assign (resid 153 and name hd2 ) (resid 155 and name hd* )  4.5  4.5  0.0
assign (resid 153 and name hd2 ) (resid 155 and name he* )  3.5  3.5  0.0
!hn(i)-hn(i+2)
assign (resid   9 and name hn  ) (resid  11 and name hn  )  4.5  4.5  0.0
assign (resid  15 and name hn  ) (resid  17 and name hn  )  4.5  4.5  0.0
assign (resid  16 and name hn  ) (resid  18 and name hn  )  5.5  5.5  0.0
assign (resid  26 and name hn  ) (resid  28 and name hn  )  5.5  5.5  0.0
assign (resid  27 and name hn  ) (resid  29 and name hn  )  5.5  5.5  0.0
assign (resid  28 and name hn  ) (resid  30 and name hn  )  4.5  4.5  0.0
assign (resid  30 and name hn  ) (resid  32 and name hn  )  5.5  5.5  0.0
assign (resid  31 and name hn  ) (resid  33 and name hn  )  4.5  4.5  0.0
assign (resid  32 and name hn  ) (resid  34 and name hn  )  4.5  4.5  0.0
assign (resid  33 and name hn  ) (resid  35 and name hn  )  4.5  4.5  0.0
assign (resid  44 and name hn  ) (resid  46 and name hn  )  4.5  4.5  0.0
assign (resid  46 and name hn  ) (resid  48 and name hn  )  5.5  5.5  0.0
assign (resid  47 and name hn  ) (resid  49 and name hn  )  5.5  5.5  0.0
assign (resid  80 and name hn  ) (resid  82 and name hn  )  4.5  4.5  0.0
assign (resid  82 and name hn  ) (resid  84 and name hn  )  4.5  4.5  0.0
assign (resid  84 and name hn  ) (resid  86 and name hn  )  4.5  4.5  0.5
assign (resid  85 and name hn  ) (resid  87 and name hn  )  4.5  4.5  0.0
assign (resid  86 and name hn  ) (resid  88 and name hn  )  5.5  5.5  0.0
assign (resid  87 and name hn  ) (resid  89 and name hn  )  4.5  4.5  0.0
assign (resid 102 and name hn  ) (resid 104 and name hn  )  4.5  4.5  0.0
assign (resid 103 and name hn  ) (resid 105 and name hn  )  4.5  4.5  0.0
assign (resid 105 and name hn  ) (resid 107 and name hn  )  4.5  4.5  0.0
assign (resid 107 and name hn  ) (resid 109 and name hn  )  4.5  4.5  0.0
assign (resid 108 and name hn  ) (resid 110 and name hn  )  5.5  5.5  0.0
assign (resid 133 and name hn  ) (resid 135 and name hn  )  5.5  5.5  0.0
!ha(i)-hn(i+2)
assign (resid  19 and name ha  ) (resid  21 and name hn  )  5.5  5.5  1.0
assign (resid  24 and name ha  ) (resid  26 and name hn  )  4.5  4.5  1.0
assign (resid  45 and name ha  ) (resid  47 and name hn  )  4.5  4.5  1.0
assign (resid  46 and name ha  ) (resid  48 and name hn  )  4.5  4.5  0.0
assign (resid  47 and name ha  ) (resid  49 and name hn  )  4.5  4.5  1.0
assign (resid  52 and name ha  ) (resid  54 and name hn  )  4.5  4.5  0.0
assign (resid  55 and name ha  ) (resid  57 and name hn  )  3.5  3.5  1.0
assign (resid  65 and name ha  ) (resid  67 and name hn  )  4.5  4.5  1.0
assign (resid  66 and name ha  ) (resid  68 and name hn  )  4.5  4.5  0.0
assign (resid  71 and name ha  ) (resid  73 and name hn  )  4.5  4.5  0.0
assign (resid  76 and name ha  ) (resid  78 and name hn  )  3.5  3.5  1.0
assign (resid  79 and name ha  ) (resid  81 and name hn  )  4.5  4.5  1.0
assign (resid  84 and name ha  ) (resid  86 and name hn  )  4.5  4.5  1.0
assign (resid  86 and name ha  ) (resid  88 and name hn  )  4.5  4.5  1.0
assign (resid  89 and name ha  ) (resid  91 and name hn  )  3.5  3.5  1.0
assign (resid 102 and name ha  ) (resid 104 and name hn  )  4.5  4.5  1.0
assign (resid 104 and name ha  ) (resid 106 and name hn  )  5.5  5.5  1.0
assign (resid 106 and name ha  ) (resid 108 and name hn  )  4.5  4.5  1.0
assign (resid 107 and name ha  ) (resid 109 and name hn  )  4.5  4.5  1.0
assign (resid 108 and name ha  ) (resid 110 and name hn  )  5.5  5.5  1.0
assign (resid 118 and name ha  ) (resid 120 and name hn  )  4.5  4.5  1.0
assign (resid 132 and name ha  ) (resid 134 and name hn  )  3.5  3.5  1.0
assign (resid 133 and name ha  ) (resid 135 and name hn  )  3.5  3.5  1.0
assign (resid 134 and name ha  ) (resid 136 and name hn  )  5.5  5.5  0.0
assign (resid 146 and name ha  ) (resid 148 and name hn  )  5.5  5.5  0.0
assign (resid 148 and name ha  ) (resid 150 and name hn  )  4.5  4.5  1.0
!hn(i)-hn(i+3)
assign (resid   8 and name hn  ) (resid  11 and name hn  )  4.5  4.5  1.0
assign (resid   8 and name hn  ) (resid  12 and name hn  )  3.5  3.5  1.0
assign (resid  15 and name hn  ) (resid  18 and name hn  )  4.5  4.5  0.0
assign (resid  26 and name hn  ) (resid  29 and name hn  )  5.5  5.5  0.0
assign (resid  27 and name hn  ) (resid  30 and name hn  )  5.5  5.5  0.0
assign (resid  28 and name hn  ) (resid  31 and name hn  )  5.5  5.5  0.0
assign (resid  30 and name hn  ) (resid  33 and name hn  )  5.5  5.5  0.0
assign (resid  32 and name hn  ) (resid  35 and name hn  )  5.5  5.5  0.0
assign (resid  43 and name hn  ) (resid  46 and name hn  )  5.5  5.5  0.0
assign (resid  44 and name hn  ) (resid  47 and name hn  )  5.5  5.5  0.0
assign (resid  45 and name hn  ) (resid  48 and name hn  )  5.5  5.5  0.0
assign (resid  46 and name hn  ) (resid  49 and name hn  )  5.5  5.5  0.0
assign (resid  65 and name hn  ) (resid  68 and name hn  )  5.5  5.5  0.0
assign (resid  78 and name hn  ) (resid  81 and name hn  )  4.5  4.5  0.0
assign (resid  79 and name hn  ) (resid  82 and name hn  )  5.5  5.5  0.0
assign (resid  81 and name hn  ) (resid  84 and name hn  )  4.5  4.5  1.0
assign (resid  82 and name hn  ) (resid  85 and name hn  )  4.5  4.5  1.0
assign (resid  86 and name hn  ) (resid  89 and name hn  )  5.5  5.5  0.0
!ha(i)-hn(i+3)
assign (resid  15 and name ha  ) (resid  18 and name hn  )  5.5  5.5  0.5
assign (resid  24 and name ha  ) (resid  27 and name hn  )  3.5  3.5  0.5
assign (resid  26 and name ha  ) (resid  29 and name hn  )  3.5  3.5  0.5
assign (resid  27 and name ha  ) (resid  30 and name hn  )  3.5  3.5  0.5
assign (resid  28 and name ha  ) (resid  31 and name hn  )  3.5  3.5  0.5
assign (resid  30 and name ha  ) (resid  33 and name hn  )  3.5  3.5  0.5
assign (resid  43 and name ha  ) (resid  46 and name hn  )  3.5  3.5  0.5
assign (resid  44 and name ha  ) (resid  47 and name hn  )  3.5  3.5  0.5
assign (resid  45 and name ha  ) (resid  48 and name hn  )  3.5  3.5  0.5
assign (resid  46 and name ha  ) (resid  49 and name hn  )  4.5  4.5  0.5
assign (resid  79 and name ha  ) (resid  82 and name hn  )  3.5  3.5  0.5
assign (resid  80 and name ha  ) (resid  83 and name hn  )  3.5  3.5  0.5
assign (resid  81 and name ha  ) (resid  84 and name hn  )  3.5  3.5  0.5
assign (resid  82 and name ha  ) (resid  85 and name hn  )  3.5  3.5  0.5
assign (resid  83 and name ha  ) (resid  86 and name hn  )  3.5  3.5  0.5
assign (resid  84 and name ha  ) (resid  87 and name hn  )  3.5  3.5  0.5
assign (resid  86 and name ha  ) (resid  89 and name hn  )  3.5  3.5  0.5
assign (resid 101 and name ha  ) (resid 104 and name hn  )  3.5  3.5  0.5
assign (resid 102 and name ha  ) (resid 105 and name hn  )  3.5  3.5  0.5
assign (resid 104 and name ha  ) (resid 107 and name hn  )  3.5  3.5  0.5
assign (resid 107 and name ha  ) (resid 110 and name hn  )  4.5  4.5  1.0 
!ha(i)-hb(i+3)
assign (resid  24 and name ha  ) (resid  27 and name hb2 )  2.5  2.5  0.5
assign (resid  25 and name ha  ) (resid  28 and name hb* )  3.5  3.5  0.5
assign (resid  26 and name ha  ) (resid  29 and name hb* )  3.5  3.5  1.0
assign (resid  27 and name ha  ) (resid  27 and name hb1 )  2.5  2.5  0.5
assign (resid  27 and name ha  ) (resid  27 and name hb2 )  3.5  3.5  0.0
assign (resid  28 and name ha  ) (resid  31 and name hb* )  3.5  3.5  1.0
assign (resid  29 and name ha  ) (resid  32 and name hb* )  3.5  3.5  1.0
assign (resid  30 and name ha  ) (resid  33 and name hb* )  3.5  3.5  1.0
assign (resid  43 and name ha  ) (resid  46 and name hb* )  3.5  3.5  1.0
assign (resid  44 and name ha  ) (resid  47 and name hb* )  3.5  3.5  1.0
assign (resid  45 and name ha  ) (resid  48 and name hb* )  3.5  3.5  1.0
assign (resid  79 and name ha  ) (resid  82 and name hb  )  3.5  3.5  0.0
assign (resid  80 and name ha  ) (resid  83 and name hb2 )  3.5  3.5  0.0
assign (resid  81 and name ha  ) (resid  84 and name hb* )  3.5  3.5  1.0
assign (resid  82 and name ha  ) (resid  85 and name hb* )  3.5  3.5  1.0
assign (resid  83 and name ha  ) (resid  86 and name hb* )  3.5  3.5  1.0
assign (resid  84 and name ha  ) (resid  87 and name hb* )  3.5  3.5  1.0
assign (resid  85 and name ha  ) (resid  88 and name hb* )  3.5  3.5  1.0
assign (resid  86 and name ha  ) (resid  89 and name hb* )  3.5  3.5  1.0
assign (resid 102 and name ha  ) (resid 105 and name hb* )  3.5  3.5  1.0
assign (resid 103 and name ha  ) (resid 106 and name hb2 )  3.5  3.5  0.5
assign (resid 104 and name ha  ) (resid 107 and name hb* )  3.5  3.5  1.0
!ha(i)-hn(i+4)
assign (resid  24 and name ha  ) (resid  28 and name hn  )  4.5  4.5  1.0
assign (resid  26 and name ha  ) (resid  30 and name hn  )  4.5  4.5  1.0
assign (resid  27 and name ha  ) (resid  31 and name hn  )  4.5  4.5  1.0
assign (resid  28 and name ha  ) (resid  32 and name hn  )  4.5  4.5  1.0
assign (resid  29 and name ha  ) (resid  33 and name hn  )  4.5  4.5  1.0
assign (resid  31 and name ha  ) (resid  35 and name hn  )  4.5  4.5  1.0
assign (resid  80 and name ha  ) (resid  84 and name hn  )  4.5  4.5  1.0
assign (resid  81 and name ha  ) (resid  85 and name hn  )  4.5  4.5  1.0
assign (resid  82 and name ha  ) (resid  86 and name hn  )  4.5  4.5  1.0
! other medium-range noes
assign (resid   3 and name ha  ) (resid   5 and name he3 )  4.5  4.5  0.0 
assign (resid   3 and name hb1 ) (resid   5 and name he3 )  3.5  3.5  0.0 
assign (resid   3 and name hb1 ) (resid   5 and name hz3 )  2.5  2.5  0.0 
assign (resid   3 and name hb2 ) (resid   5 and name hz3 )  3.5  3.5  0.0 
assign (resid   5 and name hd1 ) (resid   7 and name hn  )  4.5  4.5  0.0
assign (resid   5 and name hd1 ) (resid   7 and name ha  )  5.5  5.5  0.0 
assign (resid   5 and name hd1 ) (resid   7 and name hb1 )  3.5  3.5  0.0
assign (resid   5 and name hd1 ) (resid   7 and name hb2 )  5.5  5.5  0.0
assign (resid   5 and name he1 ) (resid   7 and name hb1 )  3.5  3.5  0.0
assign (resid   5 and name he1 ) (resid   7 and name hb2 )  5.5  5.5  0.0
assign (resid   5 and name he1 ) (resid   7 and name hg* )  3.5  3.5  1.0
assign (resid   7 and name he2*) (resid  11 and name hn  )  4.5  4.5  1.0
assign (resid   7 and name he2*) (resid  11 and name ha* )  4.5  4.5  2.0
assign (resid   8 and name hn  ) (resid  12 and name hb1 )  4.5  4.5  0.0
assign (resid   8 and name hn  ) (resid  12 and name hb2 )  5.5  5.5  0.0
assign (resid   8 and name hb* ) (resid  12 and name hd2*)  5.5  5.5  2.0
assign (resid  12 and name hg  ) (resid  14 and name hn  )  4.5  4.5  0.0
assign (resid  12 and name hb* ) (resid  14 and name hn  )  5.5  5.5  0.0
assign (resid  12 and name hd1*) (resid  14 and name hn  )  5.5  5.5  1.0
assign (resid  12 and name hd2*) (resid  14 and name hn  )  4.5  4.5  1.0
assign (resid  15 and name hn  ) (resid  19 and name ha  )  4.5  4.5  0.0
assign (resid  15 and name hb* ) (resid  18 and name he1 )  5.5  5.5  0.0 
assign (resid  15 and name hg* ) (resid  18 and name he1 )  5.5  5.5  0.0 
assign (resid  16 and name hb1 ) (resid  18 and name hd2 )  4.5  4.5  0.0 
assign (resid  16 and name hb2 ) (resid  18 and name hd2 )  5.5  5.5  0.0 
assign (resid  16 and name hb1 ) (resid  18 and name he1 )  5.5  5.5  0.0 
assign (resid  18 and name he1 ) (resid  20 and name ha  )  5.5  5.5  0.0 
assign (resid  19 and name hg  ) (resid  21 and name hn  )  5.5  5.5  0.0
assign (resid  19 and name hb1 ) (resid  21 and name hn  )  2.5  2.5  0.5 
assign (resid  19 and name hb1 ) (resid  21 and name hd1 )  4.5  4.5  0.0 
assign (resid  21 and name hd1 ) (resid  23 and name ha  )  4.4  4.4  0.0
assign (resid  21 and name hd1 ) (resid  23 and name hb1 )  3.5  3.5  1.0 
assign (resid  21 and name hd1 ) (resid  23 and name hb2 )  3.5  3.5  1.0 
assign (resid  21 and name hd1 ) (resid  23 and name hd1*)  4.5  4.5  1.0 
assign (resid  21 and name hd1 ) (resid  23 and name hd2*)  4.5  4.5  1.0
assign (resid  21 and name hd1 ) (resid  23 and name hn  )  3.5  3.5  0.0
assign (resid  21 and name hd1 ) (resid  23 and name hg  )  5.5  5.5  0.0
assign (resid  22 and name hd2 ) (resid  24 and name hb* )  4.5  4.5  1.0 
assign (resid  22 and name hd2 ) (resid  24 and name hg* )  3.5  3.5  1.0 
assign (resid  22 and name hd2 ) (resid  24 and name hd* )  4.5  4.5  1.0 
assign (resid  22 and name he1 ) (resid  24 and name hb* )  5.5  5.5  1.0 
assign (resid  22 and name he1 ) (resid  24 and name hg* )  5.5  5.5  1.0 
assign (resid  23 and name hn  ) (resid  27 and name hg  )  4.5  4.5  0.0
assign (resid  23 and name hn  ) (resid  27 and name hd1*)  6.5  6.5  0.0
assign (resid  23 and name hb* ) (resid  26 and name hn  )  4.5  4.5  1.0
assign (resid  23 and name hg  ) (resid  25 and name hn  )  5.5  5.5  0.0
assign (resid  23 and name hg  ) (resid  26 and name hn  )  3.5  3.5  0.0
assign (resid  23 and name hg  ) (resid  27 and name hn  )  4.5  4.5  0.0
assign (resid  23 and name hg  ) (resid  26 and name hb1 )  3.5  3.5  0.0 
assign (resid  23 and name hg  ) (resid  26 and name hb2 )  3.5  3.5  0.0 
assign (resid  23 and name hd1*) (resid  25 and name hn  )  4.5  4.5  1.0
assign (resid  23 and name hd1*) (resid  26 and name hn  )  4.5  4.5  1.0
assign (resid  23 and name hd2*) (resid  26 and name hn  )  4.5  4.5  1.0
assign (resid  23 and name hd2*) (resid  26 and name hb1 )  3.5  3.5  1.0 
assign (resid  23 and name hd2*) (resid  26 and name hb2 )  4.5  4.5  1.0 
assign (resid  24 and name ha  ) (resid  27 and name hg  )  4.5  4.5  0.0
assign (resid  24 and name ha  ) (resid  27 and name hd1*)  3.5  3.5  1.0
assign (resid  24 and name hg* ) (resid  27 and name hd1*)  4.5  4.5  2.0
assign (resid  25 and name ha  ) (resid  28 and name hd2 )  3.5  3.5  0.0 
assign (resid  30 and name hn  ) (resid  32 and name hb* )  5.5  5.5  1.0
assign (resid  30 and name hz  ) (resid  34 and name hg2*)  4.5  4.5  1.0
assign (resid  31 and name ha  ) (resid  34 and name hg1 )  3.5  3.5  0.0
assign (resid  39 and name he* ) (resid  41 and name hg1*)  3.5  3.5  1.0
assign (resid  39 and name he* ) (resid  41 and name hg2*)  3.5  3.5  1.0
assign (resid  41 and name ha  ) (resid  45 and name hb  )  5.5  5.5  0.0
assign (resid  41 and name hb  ) (resid  45 and name hn  )  4.5  4.5  0.0
assign (resid  41 and name hb  ) (resid  45 and name hb  )  2.5  2.5  0.0
assign (resid  49 and name hb* ) (resid  51 and name hn  )  4.5  4.5  1.0
assign (resid  54 and name hn  ) (resid  59 and name hd2*)  3.5  3.5  1.0
assign (resid  54 and name hb* ) (resid  57 and name he  )  3.5  3.5  1.0
assign (resid  54 and name hd1*) (resid  57 and name he  )  5.5  5.5  2.0
assign (resid  54 and name hd1*) (resid  57 and name hd* )  4.5  4.5  2.0
assign (resid  57 and name hn  ) (resid  59 and name hd2*)  4.5  4.5  1.0
assign (resid  58 and name hg2*) (resid  60 and name hg2*)  3.5  3.5  2.0
assign (resid  58 and name hg2*) (resid  60 and name hn  )  5.5  5.5  0.0
assign (resid  61 and name hg1*) (resid  63 and name hb  )  4.5  4.5  1.0
assign (resid  61 and name hg1*) (resid  63 and name hg2*)  4.5  4.5  2.0
assign (resid  63 and name hg2*) (resid  68 and name hn  )  4.5  4.5  1.0
assign (resid  70 and name hb* ) (resid  73 and name ha  )  5.5  5.5  1.0
assign (resid  70 and name hn  ) (resid  75 and name hb  )  5.5  5.5  0.0
assign (resid  73 and name hb* ) (resid  75 and name hn  )  5.5  5.5  0.0
assign (resid  75 and name hg1*) (resid  77 and name he1 )  3.5  3.5  1.0 
assign (resid  75 and name hb  ) (resid  77 and name he1 )  5.5  5.5  1.0 
assign (resid  76 and name hb  ) (resid  78 and name hn  )  3.5  3.5  0.0
assign (resid  76 and name hb  ) (resid  81 and name hn  )  5.5  5.5  0.0
assign (resid  76 and name hg2*) (resid  78 and name hn  )  4.5  4.5  1.0
assign (resid  76 and name hg2*) (resid  81 and name hb* )  5.5  5.5  1.0
assign (resid  77 and name hn  ) (resid  81 and name hb* )  4.5  4.5  1.0
assign (resid  78 and name hb* ) (resid  81 and name hn  )  6.5  6.5  0.0
assign (resid  78 and name hb* ) (resid  80 and name hn  )  4.5  4.5  1.0
assign (resid  78 and name hn  ) (resid  81 and name hb* )  3.5  3.5  1.0
assign (resid  79 and name ha  ) (resid  82 and name hg2*)  3.5  3.5  1.0
assign (resid  82 and name hb  ) (resid  84 and name hn  )  5.5  5.5  0.0
assign (resid  82 and name hg1*) (resid  85 and name hn  )  5.5  5.5  1.0
assign (resid  84 and name hb* ) (resid  86 and name hn  )  5.5  5.5  1.0
assign (resid  84 and name hn  ) (resid  87 and name hb* )  5.5  5.5  1.0
assign (resid  84 and name ha  ) (resid  87 and name hd* )  3.5  3.5  1.0
assign (resid  86 and name ha  ) (resid  89 and name hd2 )  5.5  5.5  1.0 
assign (resid  89 and name hb* ) (resid  92 and name hn  )  4.5  4.5  1.0
assign (resid  94 and name hg  ) (resid  96 and name hd1*)  4.5  4.5  1.0
assign (resid  96 and name hg2*) (resid  98 and name hn  )  3.5  3.5  1.0
assign (resid  98 and name hn  ) (resid 102 and name hg1*)  4.5  4.5  1.0
assign (resid  98 and name hn  ) (resid 102 and name hg2*)  4.5  4.5  1.0
assign (resid 100 and name hb* ) (resid 103 and name hn  )  5.5  5.5  1.0
assign (resid 102 and name hg2*) (resid 106 and name hn  )  4.5  4.5  1.0
assign (resid 104 and name hn  ) (resid 107 and name hb* )  6.5  6.5  0.0
assign (resid 107 and name hb* ) (resid 109 and name hn  )  6.5  6.5  0.0
assign (resid 116 and name hb  ) (resid 118 and name hd1*)  4.5  4.5  1.0
assign (resid 116 and name hg2*) (resid 118 and name hd1*)  2.5  2.5  2.0
assign (resid 118 and name hb1 ) (resid 120 and name hn  )  3.5  3.5  0.0
assign (resid 118 and name hb2 ) (resid 120 and name hn  )  5.5  5.5  0.0
assign (resid 118 and name hd2*) (resid 122 and name hz  )  4.5  4.5  1.0
assign (resid 128 and name he* ) (resid 131 and name hd1*)  2.5  2.5  2.0
assign (resid 128 and name he* ) (resid 131 and name hd2*)  3.5  3.5  2.0
assign (resid 130 and name ha  ) (resid 133 and name he1 )  5.5  5.5  0.0
assign (resid 131 and name hn  ) (resid 133 and name he1 )  4.5  4.5  0.0
assign (resid 131 and name hb1 ) (resid 133 and name hd1 )  5.5  5.5  0.0 
assign (resid 131 and name hb2 ) (resid 133 and name hd1 )  4.5  4.5  0.0 
assign (resid 131 and name hb1 ) (resid 133 and name he1 )  5.5  5.5  0.5
assign (resid 131 and name hb2 ) (resid 133 and name he1 )  4.5  4.5  0.5
assign (resid 131 and name hb1 ) (resid 133 and name hn  )  5.5  5.5  0.0
assign (resid 131 and name hb2 ) (resid 133 and name hn  )  4.5  4.5  0.0
assign (resid 131 and name hd1*) (resid 133 and name hd1 )  5.5  5.5  1.0 
assign (resid 131 and name hd1*) (resid 133 and name hz2 )  3.5  3.5  1.0 
assign (resid 132 and name hb1 ) (resid 135 and name hn  )  5.5  5.5  0.0
assign (resid 133 and name he3 ) (resid 136 and name hb1 )  5.5  5.5  0.0
assign (resid 133 and name he3 ) (resid 136 and name hb2 )  5.5  5.5  0.0
assign (resid 138 and name hg* ) (resid 140 and name hn  )  4.5  4.5  1.0
assign (resid 146 and name hb1 ) (resid 148 and name hn  )  4.5  4.5  0.0
assign (resid 146 and name hb2 ) (resid 148 and name hn  )  5.5  5.5  0.0
assign (resid 148 and name hb* ) (resid 151 and name hn  )  5.5  5.5  1.0
assign (resid 148 and name hb* ) (resid 151 and name hd1*)  4.5  4.5  1.0
assign (resid 148 and name hb* ) (resid 151 and name hb* )  4.5  4.5  2.0
assign (resid 148 and name hd2*) (resid 150 and name hb* )  3.5  3.5  2.5
assign (resid 148 and name hd2*) (resid 151 and name hd1*)  4.5  4.5  2.0
assign (resid 149 and name ha  ) (resid 152 and name hg1 )  3.5  3.5  0.0
assign (resid 154 and name hg2*) (resid 156 and name hn  )  5.5  5.5  0.0
assign (resid 156 and name ha  ) (resid 158 and name he1 )  5.5  5.5  0.0
assign (resid 156 and name hb1 ) (resid 158 and name hd1 )  4.5  4.5  0.0 
assign (resid 156 and name hb2 ) (resid 158 and name hd1 )  4.5  4.5  0.0 
assign (resid 156 and name hb1 ) (resid 158 and name he1 )  2.5  2.5  0.0
assign (resid 156 and name hb2 ) (resid 158 and name he1 )  3.5  3.5  0.0
!sequential noes
!r-6 averaging for aromatics and some others
assign (resid   3 and name hd* ) (resid   4 and name hn  )  5.5  5.5  0.0
assign (resid  18 and name ha  ) (resid  19 and name hd* )  5.5  5.5  0.0
assign (resid  23 and name ha  ) (resid  24 and name hd* )  2.5  2.5  0.0
assign (resid  29 and name hd* ) (resid  30 and name hn  )  4.5  4.5  0.5
assign (resid  29 and name hd* ) (resid  30 and name ha  )  5.5  5.5  0.0 
assign (resid  30 and name hd* ) (resid  31 and name hn  )  5.5  5.5  0.0
assign (resid  30 and name hd* ) (resid  31 and name ha  )  5.5  5.5  0.0 
assign (resid  35 and name hg* ) (resid  36 and name hn  )  4.5  4.5  0.5
assign (resid  46 and name hd* ) (resid  47 and name hn  )  5.5  5.5  0.0
assign (resid  46 and name hd* ) (resid  47 and name ha  )  5.5  5.5  0.0
assign (resid  46 and name hd* ) (resid  47 and name hg* )  4.5  4.5  0.0 
assign (resid  49 and name hd* ) (resid  50 and name hd* )  5.5  5.5  0.0 
assign (resid  68 and name hd* ) (resid  69 and name hn  )  4.5  4.5  0.0
assign (resid  68 and name he* ) (resid  69 and name hn  )  5.5  5.5  0.0
assign (resid  79 and name hg* ) (resid  80 and name hn  )  5.5  5.5  0.0
assign (resid  83 and name hd* ) (resid  84 and name hn  )  5.5  5.5  0.0
assign (resid  85 and name hd* ) (resid  86 and name hn  )  5.5  5.5  0.0
assign (resid  94 and name hd* ) (resid  95 and name hn  )  4.5  4.5  0.0
assign (resid  98 and name ha* ) (resid  99 and name ha* )  3.5  3.5  0.0 
assign (resid 103 and name hd* ) (resid 104 and name hn  )  5.5  5.5  0.0
assign (resid 106 and name hd* ) (resid 105 and name hb* )  5.5  5.5  0.0 
assign (resid 107 and name hd* ) (resid 108 and name hn  )  5.5  5.5  0.0
assign (resid 114 and name ha  ) (resid 115 and name hg* )  5.5  5.5  0.0
assign (resid 115 and name hg* ) (resid 116 and name hn  )  3.5  3.5  0.0
assign (resid 121 and name ha  ) (resid 122 and name hd* )  4.5  4.5  0.0
assign (resid 135 and name hn  ) (resid 136 and name he* )  5.5  5.5  0.0
assign (resid 135 and name hn  ) (resid 136 and name hd* )  3.5  3.5  0.0
assign (resid 136 and name hd* ) (resid 137 and name hn  )  4.5  4.5  0.0
assign (resid 139 and name hg* ) (resid 140 and name hn  )  4.5  4.5  0.0
assign (resid 156 and name hn  ) (resid 155 and name hd* )  5.5  5.5  0.0
assign (resid 157 and name hg* ) (resid 158 and name hn  )  4.5  4.5  0.0
assign (resid 157 and name hg* ) (resid 158 and name hd1 )  5.5  5.5  1.0 
!hn(i)-hn(i+1)
assign (resid   4 and name hn  ) (resid   5 and name hn  )  5.5  5.5  0.0
assign (resid   5 and name hn  ) (resid   6 and name hn  )  5.5  5.5  0.0
assign (resid   6 and name hn  ) (resid   7 and name hn  )  4.5  4.5  0.0
assign (resid   7 and name hn  ) (resid   8 and name hn  )  5.5  5.5  0.0
assign (resid   9 and name hn  ) (resid  10 and name hn  )  3.5  3.5  0.0
assign (resid  10 and name hn  ) (resid  11 and name hn  )  2.5  2.5  0.5
assign (resid  11 and name hn  ) (resid  12 and name hn  )  3.5  3.5  0.0
assign (resid  12 and name hn  ) (resid  13 and name hn  )  5.5  5.5  0.0
assign (resid  13 and name hn  ) (resid  14 and name hn  )  2.5  2.5  0.0
assign (resid  15 and name hn  ) (resid  16 and name hn  )  5.5  5.5  0.0
assign (resid  16 and name hn  ) (resid  17 and name hn  )  3.5  3.5  0.0
assign (resid  17 and name hn  ) (resid  18 and name hn  )  4.5  4.5  0.0
assign (resid  25 and name hn  ) (resid  26 and name hn  )  2.5  2.5  1.0
assign (resid  26 and name hn  ) (resid  27 and name hn  )  2.5  2.5  1.0
assign (resid  27 and name hn  ) (resid  28 and name hn  )  2.5  2.5  1.0
assign (resid  28 and name hn  ) (resid  29 and name hn  )  2.5  2.5  1.0
assign (resid  29 and name hn  ) (resid  30 and name hn  )  2.5  2.5  1.0
assign (resid  30 and name hn  ) (resid  31 and name hn  )  3.5  3.5  0.0
assign (resid  31 and name hn  ) (resid  32 and name hn  )  3.5  3.5  0.0
assign (resid  32 and name hn  ) (resid  33 and name hn  )  3.5  3.5  0.0
assign (resid  33 and name hn  ) (resid  34 and name hn  )  2.5  2.5  0.5
assign (resid  34 and name hn  ) (resid  35 and name hn  )  2.5  2.5  0.0
assign (resid  35 and name hn  ) (resid  36 and name hn  )  5.5  5.5  0.0
assign (resid  36 and name hn  ) (resid  37 and name hn  )  4.5  4.5  0.0
assign (resid  38 and name hn  ) (resid  39 and name hn  )  5.5  5.5  0.0
assign (resid  41 and name hn  ) (resid  42 and name hn  )  5.5  5.5  0.0
assign (resid  43 and name hn  ) (resid  44 and name hn  )  3.5  3.5  0.0
assign (resid  44 and name hn  ) (resid  45 and name hn  )  3.5  3.5  0.0
assign (resid  45 and name hn  ) (resid  46 and name hn  )  3.5  3.5  0.0
assign (resid  46 and name hn  ) (resid  47 and name hn  )  3.5  3.5  0.0
assign (resid  47 and name hn  ) (resid  48 and name hn  )  3.5  3.5  0.0
assign (resid  48 and name hn  ) (resid  49 and name hn  )  3.5  3.5  0.0
assign (resid  51 and name hn  ) (resid  52 and name hn  )  5.5  5.5  0.0
assign (resid  56 and name hn  ) (resid  57 and name hn  )  3.5  3.5  0.0
assign (resid  57 and name hn  ) (resid  58 and name hn  )  4.5  4.5  0.0
assign (resid  59 and name hn  ) (resid  60 and name hn  )  4.5  4.5  0.0
assign (resid  63 and name hn  ) (resid  64 and name hn  )  5.5  5.5  0.0
assign (resid  66 and name hn  ) (resid  67 and name hn  )  3.5  3.5  0.0
assign (resid  67 and name hn  ) (resid  68 and name hn  )  2.5  2.5  0.0
assign (resid  68 and name hn  ) (resid  69 and name hn  )  5.5  5.5  0.0
assign (resid  69 and name hn  ) (resid  70 and name hn  )  4.5  4.5  0.0
assign (resid  70 and name hn  ) (resid  71 and name hn  )  4.5  4.5  0.0
assign (resid  72 and name hn  ) (resid  73 and name hn  )  4.5  4.5  0.0
assign (resid  73 and name hn  ) (resid  74 and name hn  )  4.5  4.5  0.0
assign (resid  74 and name hn  ) (resid  75 and name hn  )  4.5  4.5  0.0
assign (resid  75 and name hn  ) (resid  76 and name hn  )  4.5  4.5  0.0
assign (resid  77 and name hn  ) (resid  78 and name hn  )  3.5  3.5  0.0
assign (resid  78 and name hn  ) (resid  79 and name hn  )  4.5  4.5  0.0
assign (resid  80 and name hn  ) (resid  81 and name hn  )  3.5  3.5  0.0
assign (resid  81 and name hn  ) (resid  82 and name hn  )  3.5  3.5  0.0
assign (resid  82 and name hn  ) (resid  83 and name hn  )  3.5  3.5  0.0
assign (resid  83 and name hn  ) (resid  84 and name hn  )  3.5  3.5  0.0
assign (resid  84 and name hn  ) (resid  85 and name hn  )  3.5  3.5  0.0
assign (resid  85 and name hn  ) (resid  86 and name hn  )  3.5  3.5  0.0
assign (resid  86 and name hn  ) (resid  87 and name hn  )  3.5  3.5  0.0
assign (resid  87 and name hn  ) (resid  88 and name hn  )  3.5  3.5  0.0
assign (resid  88 and name hn  ) (resid  89 and name hn  )  3.5  3.5  0.0
assign (resid  91 and name hn  ) (resid  92 and name hn  )  3.5  3.5  0.0
assign (resid  92 and name hn  ) (resid  93 and name hn  )  5.5  5.5  0.0
assign (resid  94 and name hn  ) (resid  95 and name hn  )  5.5  5.5  0.0
assign (resid  95 and name hn  ) (resid  96 and name hn  )  5.5  5.5  0.0
assign (resid  96 and name hn  ) (resid  97 and name hn  )  5.5  5.5  0.0
assign (resid  97 and name hn  ) (resid  98 and name hn  )  2.5  2.5  0.0
assign (resid 101 and name hn  ) (resid 102 and name hn  )  3.5  3.5  0.0
assign (resid 102 and name hn  ) (resid 103 and name hn  )  3.5  3.5  0.0
assign (resid 103 and name hn  ) (resid 104 and name hn  )  3.5  3.5  0.0
assign (resid 104 and name hn  ) (resid 105 and name hn  )  3.5  3.5  0.0
assign (resid 105 and name hn  ) (resid 106 and name hn  )  3.5  3.5  0.0
assign (resid 106 and name hn  ) (resid 107 and name hn  )  3.5  3.5  0.0
assign (resid 107 and name hn  ) (resid 108 and name hn  )  3.5  3.5  0.0
assign (resid 108 and name hn  ) (resid 109 and name hn  )  3.5  3.5  0.0
assign (resid 109 and name hn  ) (resid 110 and name hn  )  3.5  3.5  0.0
assign (resid 110 and name hn  ) (resid 111 and name hn  )  5.5  5.5  0.0
assign (resid 111 and name hn  ) (resid 112 and name hn  )  2.5  2.5  0.0
assign (resid 113 and name hn  ) (resid 114 and name hn  )  4.5  4.5  0.0
assign (resid 114 and name hn  ) (resid 115 and name hn  )  4.5  4.5  0.0
assign (resid 119 and name hn  ) (resid 120 and name hn  )  3.5  3.5  0.0
assign (resid 120 and name hn  ) (resid 121 and name hn  )  5.5  5.5  0.0
assign (resid 121 and name hn  ) (resid 122 and name hn  )  4.5  4.5  0.5
assign (resid 123 and name hn  ) (resid 124 and name hn  )  5.5  5.5  0.0
assign (resid 124 and name hn  ) (resid 125 and name hn  )  4.5  4.5  0.0
assign (resid 125 and name hn  ) (resid 126 and name hn  )  2.5  2.5  0.0
assign (resid 126 and name hn  ) (resid 127 and name hn  )  5.5  5.5  0.0
assign (resid 127 and name hn  ) (resid 128 and name hn  )  5.5  5.5  0.0
assign (resid 128 and name hn  ) (resid 129 and name hn  )  5.5  5.5  0.0
assign (resid 131 and name hn  ) (resid 132 and name hn  )  5.5  5.5  0.0
assign (resid 132 and name hn  ) (resid 133 and name hn  )  5.5  5.5  0.0
assign (resid 133 and name hn  ) (resid 134 and name hn  )  3.5  3.5  0.0
assign (resid 134 and name hn  ) (resid 135 and name hn  )  3.5  3.5  0.0
assign (resid 135 and name hn  ) (resid 136 and name hn  )  3.5  3.5  0.0
assign (resid 136 and name hn  ) (resid 137 and name hn  )  5.5  5.5  0.0
assign (resid 137 and name hn  ) (resid 138 and name hn  )  4.5  4.5  0.0
assign (resid 138 and name hn  ) (resid 139 and name hn  )  5.5  5.5  0.0
assign (resid 139 and name hn  ) (resid 140 and name hn  )  4.5  4.5  0.0
assign (resid 140 and name hn  ) (resid 141 and name hn  )  4.5  4.5  0.0
assign (resid 141 and name hn  ) (resid 142 and name hn  )  4.5  4.5  0.0
assign (resid 144 and name hn  ) (resid 145 and name hn  )  4.5  4.5  0.0
assign (resid 145 and name hn  ) (resid 146 and name hn  )  4.5  4.5  0.0
assign (resid 146 and name hn  ) (resid 147 and name hn  )  5.5  5.5  0.0
assign (resid 147 and name hn  ) (resid 148 and name hn  )  3.5  3.5  0.0
assign (resid 150 and name hn  ) (resid 151 and name hn  )  3.5  3.5  0.0
assign (resid 151 and name hn  ) (resid 152 and name hn  )  3.5  3.5  0.0
assign (resid 152 and name hn  ) (resid 153 and name hn  )  4.5  4.5  0.5
assign (resid 154 and name hn  ) (resid 155 and name hn  )  5.5  5.5  0.0
assign (resid 155 and name hn  ) (resid 156 and name hn  )  5.5  5.5  0.0
assign (resid 156 and name hn  ) (resid 157 and name hn  )  4.5  4.5  0.5
assign (resid 159 and name hn  ) (resid 160 and name hn  )  4.5  4.5  0.0
assign (resid 161 and name hn  ) (resid 162 and name hn  )  4.5  4.5  0.0
!ha(i)-hn(i+1)
assign (resid   1 and name ha  ) (resid   2 and name hn  )  2.5  2.5  0.0
assign (resid   2 and name ha  ) (resid   3 and name hn  )  2.5  2.5  0.0
assign (resid   3 and name ha  ) (resid   4 and name hn  )  2.5  2.5  0.0
assign (resid   4 and name ha  ) (resid   5 and name hn  )  2.5  2.5  0.0
assign (resid   5 and name ha  ) (resid   6 and name hn  )  2.5  2.5  0.0
assign (resid   6 and name ha  ) (resid   7 and name hn  )  2.5  2.5  0.0
assign (resid   7 and name ha  ) (resid   8 and name hn  )  2.5  2.5  0.5
assign (resid   8 and name ha  ) (resid   9 and name hn  )  3.5  3.5  0.5
assign (resid  10 and name ha  ) (resid  11 and name hn  )  3.5  3.5  0.5
assign (resid  11 and name ha* ) (resid  12 and name hn  )  3.5  3.5  1.0
assign (resid  12 and name ha  ) (resid  13 and name hn  )  2.5  2.5  0.0
assign (resid  13 and name ha  ) (resid  14 and name hn  )  4.5  4.5  0.0
assign (resid  14 and name ha* ) (resid  15 and name hn  )  3.5  3.5  1.0
assign (resid  15 and name ha  ) (resid  16 and name hn  )  2.5  2.5  0.5
assign (resid  16 and name ha  ) (resid  17 and name hn  )  3.5  3.5  0.0
assign (resid  17 and name ha* ) (resid  18 and name hn  )  3.5  3.5  1.0
assign (resid  20 and name ha  ) (resid  21 and name hn  )  3.5  3.5  0.5
assign (resid  21 and name ha  ) (resid  22 and name hn  )  3.5  3.5  0.5
assign (resid  22 and name ha  ) (resid  23 and name hn  )  3.5  3.5  0.5
assign (resid  25 and name ha  ) (resid  26 and name hn  )  5.5  5.5  0.0
assign (resid  26 and name ha  ) (resid  27 and name hn  )  4.5  4.5  0.5
assign (resid  27 and name ha  ) (resid  28 and name hn  )  4.5  4.5  0.5
assign (resid  28 and name ha  ) (resid  29 and name hn  )  4.5  4.5  0.5
assign (resid  29 and name ha  ) (resid  30 and name hn  )  3.5  3.5  0.5
assign (resid  30 and name ha  ) (resid  31 and name hn  )  4.5  4.5  0.5
assign (resid  31 and name ha  ) (resid  32 and name hn  )  3.5  3.5  0.5
assign (resid  32 and name ha  ) (resid  33 and name hn  )  3.5  3.5  0.5
assign (resid  33 and name ha  ) (resid  34 and name hn  )  3.5  3.5  0.5
assign (resid  34 and name ha  ) (resid  35 and name hn  )  3.5  3.5  0.5
assign (resid  35 and name ha  ) (resid  36 and name hn  )  2.5  2.5  0.5
assign (resid  36 and name ha* ) (resid  37 and name hn  )  3.5  3.5  1.0
assign (resid  37 and name ha  ) (resid  38 and name hn  )  4.5  4.5  0.5
assign (resid  38 and name ha  ) (resid  39 and name hn  )  2.5  2.5  0.5
assign (resid  40 and name ha  ) (resid  41 and name hn  )  2.5  2.5  0.5
assign (resid  41 and name ha  ) (resid  42 and name hn  )  2.5  2.5  0.5
assign (resid  42 and name ha* ) (resid  43 and name hn  )  3.5  3.5  1.0
assign (resid  43 and name ha  ) (resid  44 and name hn  )  3.5  3.5  0.5
assign (resid  44 and name ha  ) (resid  45 and name hn  )  3.5  3.5  0.5
assign (resid  45 and name ha  ) (resid  46 and name hn  )  4.5  4.5  0.5
assign (resid  46 and name ha  ) (resid  47 and name hn  )  4.5  4.5  0.5
assign (resid  47 and name ha  ) (resid  48 and name hn  )  4.5  4.5  0.5
assign (resid  48 and name ha  ) (resid  49 and name hn  )  3.5  3.5  0.5
assign (resid  51 and name ha  ) (resid  52 and name hn  )  2.5  2.5  0.5
assign (resid  53 and name ha  ) (resid  54 and name hn  )  2.5  2.5  0.5
assign (resid  55 and name ha  ) (resid  56 and name hn  )  2.5  2.5  0.5
assign (resid  56 and name ha  ) (resid  57 and name hn  )  3.5  3.5  0.5
assign (resid  57 and name ha  ) (resid  58 and name hn  )  3.5  3.5  0.5
assign (resid  58 and name ha  ) (resid  59 and name hn  )  2.5  2.5  0.5
assign (resid  59 and name ha  ) (resid  60 and name hn  )  2.5  2.5  0.5
assign (resid  60 and name ha  ) (resid  61 and name hn  )  2.5  2.5  0.5
assign (resid  65 and name ha  ) (resid  66 and name hn  )  2.5  2.5  0.5
assign (resid  66 and name ha  ) (resid  67 and name hn  )  3.5  3.5  0.5
assign (resid  67 and name ha  ) (resid  68 and name hn  )  4.5  4.5  0.5
assign (resid  68 and name ha  ) (resid  69 and name hn  )  2.5  2.5  0.5
assign (resid  70 and name ha  ) (resid  71 and name hn  )  2.5  2.5  0.5
assign (resid  71 and name ha  ) (resid  72 and name hn  )  3.5  3.5  0.5
assign (resid  72 and name ha* ) (resid  73 and name hn  )  3.5  3.5  1.0
assign (resid  73 and name ha  ) (resid  74 and name hn  )  3.5  3.5  0.5
assign (resid  74 and name ha  ) (resid  75 and name hn  )  2.5  2.5  0.5
assign (resid  75 and name ha  ) (resid  76 and name hn  )  2.5  2.5  0.5
assign (resid  76 and name ha  ) (resid  77 and name hn  )  2.5  2.5  0.5
assign (resid  77 and name ha  ) (resid  78 and name hn  )  4.5  4.5  0.5
assign (resid  78 and name ha  ) (resid  79 and name hn  )  3.5  3.5  0.5
assign (resid  79 and name ha  ) (resid  80 and name hn  )  4.5  4.5  0.5
assign (resid  81 and name ha  ) (resid  82 and name hn  )  4.5  4.5  0.5
assign (resid  82 and name ha  ) (resid  83 and name hn  )  4.5  4.5  0.5
assign (resid  83 and name ha  ) (resid  84 and name hn  )  3.5  3.5  0.5
assign (resid  84 and name ha  ) (resid  85 and name hn  )  4.5  4.5  0.5
assign (resid  85 and name ha  ) (resid  86 and name hn  )  3.5  3.5  0.5
assign (resid  86 and name ha  ) (resid  87 and name hn  )  3.5  3.5  0.5
assign (resid  88 and name ha  ) (resid  89 and name hn  )  3.5  3.5  0.5
assign (resid  91 and name ha  ) (resid  92 and name hn  )  3.5  3.5  0.5
assign (resid  92 and name ha  ) (resid  93 and name hn  )  2.5  2.5  0.5
assign (resid  93 and name ha  ) (resid  94 and name hn  )  2.5  2.5  0.5
assign (resid  94 and name ha  ) (resid  95 and name hn  )  2.5  2.5  0.5
assign (resid  95 and name ha  ) (resid  96 and name hn  )  2.5  2.5  0.5
assign (resid  96 and name ha  ) (resid  97 and name hn  )  2.5  2.5  0.5
assign (resid  99 and name ha* ) (resid 100 and name hn  )  4.5  4.5  1.0
assign (resid 100 and name ha  ) (resid 101 and name hn  )  4.5  4.5  0.5
assign (resid 101 and name ha  ) (resid 102 and name hn  )  4.5  4.5  0.5
assign (resid 102 and name ha  ) (resid 103 and name hn  )  3.5  3.5  0.5
assign (resid 103 and name ha  ) (resid 104 and name hn  )  4.5  4.5  0.5
assign (resid 104 and name ha  ) (resid 105 and name hn  )  3.5  3.5  0.5
assign (resid 105 and name ha  ) (resid 106 and name hn  )  3.5  3.5  0.5
assign (resid 106 and name ha  ) (resid 107 and name hn  )  3.5  3.5  0.5
assign (resid 107 and name ha  ) (resid 108 and name hn  )  3.5  3.5  0.5
assign (resid 108 and name ha  ) (resid 109 and name hn  )  4.5  4.5  0.5
assign (resid 109 and name ha  ) (resid 110 and name hn  )  3.5  3.5  0.5
assign (resid 110 and name ha  ) (resid 111 and name hn  )  2.5  2.5  0.5
assign (resid 111 and name ha  ) (resid 112 and name hn  )  3.5  3.5  0.5
assign (resid 112 and name ha  ) (resid 113 and name hn  )  2.5  2.5  0.5
assign (resid 113 and name ha  ) (resid 114 and name hn  )  2.5  2.5  0.5
assign (resid 114 and name ha  ) (resid 115 and name hn  )  2.5  2.5  0.5
assign (resid 115 and name ha  ) (resid 116 and name hn  )  2.5  2.5  0.5
assign (resid 116 and name ha  ) (resid 117 and name hn  )  2.5  2.5  0.5
assign (resid 118 and name ha  ) (resid 119 and name hn  )  2.5  2.5  0.5
assign (resid 119 and name ha  ) (resid 120 and name hn  )  3.5  3.5  0.5
assign (resid 120 and name ha* ) (resid 121 and name hn  )  2.5  2.5  1.0
assign (resid 121 and name ha  ) (resid 122 and name hn  )  2.5  2.5  0.5
assign (resid 122 and name ha  ) (resid 123 and name hn  )  3.5  3.5  0.5
assign (resid 123 and name ha  ) (resid 124 and name hn  )  2.5  2.5  0.5
assign (resid 124 and name ha* ) (resid 125 and name hn  )  2.5  2.5  1.0
assign (resid 125 and name ha  ) (resid 126 and name hn  )  3.5  3.5  0.5
assign (resid 126 and name ha  ) (resid 127 and name hn  )  2.5  2.5  0.5
assign (resid 127 and name ha  ) (resid 128 and name hn  )  2.5  2.5  0.5
assign (resid 128 and name ha  ) (resid 129 and name hn  )  2.5  2.5  0.5
assign (resid 130 and name ha  ) (resid 131 and name hn  )  2.5  2.5  0.5
assign (resid 131 and name ha  ) (resid 132 and name hn  )  2.5  2.5  0.5
assign (resid 132 and name ha  ) (resid 133 and name hn  )  2.5  2.5  0.5
assign (resid 133 and name ha  ) (resid 134 and name hn  )  4.5  4.5  0.5
assign (resid 135 and name ha  ) (resid 136 and name hn  )  3.5  3.5  0.5
assign (resid 136 and name ha  ) (resid 137 and name hn  )  2.5  2.5  0.5
assign (resid 137 and name ha  ) (resid 138 and name hn  )  2.5  2.5  0.5
assign (resid 138 and name ha  ) (resid 139 and name hn  )  2.5  2.5  0.5
assign (resid 139 and name ha  ) (resid 140 and name hn  )  3.5  3.5  0.5
assign (resid 140 and name ha  ) (resid 141 and name hn  )  2.5  2.5  0.5
assign (resid 141 and name ha  ) (resid 142 and name hn  )  2.5  2.5  0.5
assign (resid 142 and name ha  ) (resid 143 and name hn  )  2.5  2.5  0.5
assign (resid 143 and name ha  ) (resid 144 and name hn  )  2.5  2.5  0.5
assign (resid 144 and name ha  ) (resid 145 and name hn  )  2.5  2.5  0.5
assign (resid 145 and name ha  ) (resid 146 and name hn  )  2.5  2.5  0.5
assign (resid 146 and name ha  ) (resid 147 and name hn  )  2.5  2.5  0.5
assign (resid 147 and name ha  ) (resid 148 and name hn  )  3.5  3.5  0.5
assign (resid 149 and name ha  ) (resid 150 and name hn  )  3.5  3.5  0.5
assign (resid 150 and name ha  ) (resid 151 and name hn  )  3.5  3.5  0.5
assign (resid 152 and name ha  ) (resid 153 and name hn  )  2.5  2.5  0.5
assign (resid 153 and name ha  ) (resid 154 and name hn  )  2.5  2.5  0.5
assign (resid 154 and name ha  ) (resid 155 and name hn  )  2.5  2.5  0.5
assign (resid 155 and name ha  ) (resid 156 and name hn  )  2.5  2.5  0.5
assign (resid 156 and name ha  ) (resid 157 and name hn  )  2.5  2.5  0.5
assign (resid 157 and name ha  ) (resid 158 and name hn  )  2.5  2.5  0.5
assign (resid 158 and name ha  ) (resid 159 and name hn  )  2.5  2.5  0.5
assign (resid 159 and name ha  ) (resid 160 and name hn  )  2.5  2.5  0.5
assign (resid 160 and name ha  ) (resid 161 and name hn  )  2.5  2.5  0.5
!hb(i)-hn(i+1)
assign (resid   1 and name hb  ) (resid   2 and name hn  )  4.5  4.5  0.0
assign (resid   2 and name hb* ) (resid   3 and name hn  )  4.5  4.5  1.0
assign (resid   3 and name hb1 ) (resid   4 and name hn  )  3.5  3.5  1.0
assign (resid   3 and name hb2 ) (resid   4 and name hn  )  4.5  4.5  1.0
assign (resid   5 and name hb* ) (resid   6 and name hn  )  4.2  4.2  1.0
assign (resid   6 and name hb* ) (resid   7 and name hn  )  4.5  4.5  1.0
assign (resid   7 and name hb1 ) (resid   8 and name hn  )  4.5  4.5  0.0
assign (resid   7 and name hb2 ) (resid   8 and name hn  )  3.5  3.5  0.0
assign (resid   8 and name hb1 ) (resid   9 and name hn  )  4.5  4.5  0.0
assign (resid   8 and name hb2 ) (resid   9 and name hn  )  3.5  3.5  0.0
assign (resid   9 and name hb1 ) (resid  10 and name hn  )  3.5  3.5  1.0
assign (resid  10 and name hb1 ) (resid  11 and name hn  )  5.5  5.5  0.0
assign (resid  10 and name hb2 ) (resid  11 and name hn  )  4.5  4.5  0.0
assign (resid  12 and name hb* ) (resid  13 and name hn  )  4.5  4.5  1.0
assign (resid  15 and name hb1 ) (resid  16 and name hn  )  4.5  4.5  0.0
assign (resid  15 and name hb2 ) (resid  16 and name hn  )  4.5  4.5  0.0
assign (resid  16 and name hb1 ) (resid  17 and name hn  )  5.5  5.5  0.0
assign (resid  16 and name hb2 ) (resid  17 and name hn  )  5.5  5.5  0.0
assign (resid  20 and name hb* ) (resid  21 and name hn  )  5.5  5.5  0.0
assign (resid  21 and name hb1 ) (resid  22 and name hn  )  4.5  4.5  0.0
assign (resid  21 and name hb2 ) (resid  22 and name hn  )  3.5  3.5  0.0
assign (resid  22 and name hb* ) (resid  23 and name hn  )  5.5  5.5  0.0
assign (resid  24 and name hb* ) (resid  25 and name hn  )  4.5  4.5  1.0
assign (resid  25 and name hb* ) (resid  26 and name hn  )  5.5  5.5  0.0
assign (resid  26 and name hb1 ) (resid  27 and name hn  )  3.5  3.5  0.0
assign (resid  26 and name hb2 ) (resid  27 and name hn  )  4.5  4.5  0.0
assign (resid  27 and name hb1 ) (resid  28 and name hn  )  4.5  4.5  0.0
assign (resid  27 and name hb2 ) (resid  28 and name hn  )  3.5  3.5  0.0
assign (resid  28 and name hb* ) (resid  29 and name hn  )  3.5  3.5  1.0
assign (resid  29 and name hb1 ) (resid  30 and name hn  )  3.5  3.5  0.0
assign (resid  29 and name hb2 ) (resid  30 and name hn  )  4.5  4.5  0.0
assign (resid  30 and name hb1 ) (resid  31 and name hn  )  2.5  2.5  0.0
assign (resid  30 and name hb2 ) (resid  31 and name hn  )  4.5  4.5  0.0
assign (resid  31 and name hb* ) (resid  32 and name hn  )  3.5  3.5  1.0
assign (resid  32 and name hb* ) (resid  33 and name hn  )  4.5  4.5  1.0
assign (resid  33 and name hb1 ) (resid  34 and name hn  )  5.5  5.5  0.0
assign (resid  33 and name hb2 ) (resid  34 and name hn  )  4.5  4.5  0.0
assign (resid  34 and name hb  ) (resid  35 and name hn  )  5.5  5.5  0.0
assign (resid  35 and name hb  ) (resid  36 and name hn  )  3.5  3.5  0.0
assign (resid  37 and name hb1 ) (resid  38 and name hn  )  2.5  2.5  0.0
assign (resid  37 and name hb2 ) (resid  38 and name hn  )  4.5  4.5  0.0
assign (resid  38 and name hb  ) (resid  39 and name hn  )  5.5  5.5  0.0
assign (resid  39 and name hb* ) (resid  40 and name hn  )  5.5  5.5  0.0
assign (resid  40 and name hb  ) (resid  41 and name hn  )  4.5  4.5  0.0
assign (resid  41 and name hb  ) (resid  42 and name hn  )  3.5  3.5  0.0
assign (resid  43 and name hb1 ) (resid  44 and name hn  )  4.5  4.5  0.0
assign (resid  43 and name hb2 ) (resid  44 and name hn  )  5.5  5.5  0.0
assign (resid  44 and name hb* ) (resid  45 and name hn  )  4.5  4.5  1.0
assign (resid  45 and name hb  ) (resid  46 and name hn  )  3.5  3.5  0.0
assign (resid  46 and name hb* ) (resid  47 and name hn  )  4.5  4.5  1.0
assign (resid  47 and name hb1 ) (resid  48 and name hn  )  4.5  4.5  0.0
assign (resid  47 and name hb2 ) (resid  48 and name hn  )  3.5  3.5  0.0
assign (resid  48 and name hb* ) (resid  49 and name hn  )  5.5  5.5  0.0
assign (resid  49 and name ha  ) (resid  50 and name hd1 )  3.5  3.5  0.0
assign (resid  49 and name ha  ) (resid  50 and name hd2 )  3.5  3.5  0.0
assign (resid  49 and name hb* ) (resid  50 and name hd* )  3.5  3.5  2.0
assign (resid  50 and name hb2 ) (resid  51 and name hn  )  2.5  2.5  0.0
assign (resid  50 and name hb1 ) (resid  51 and name hn  )  4.5  4.5  0.0
assign (resid  51 and name hb* ) (resid  52 and name hn  )  3.5  3.5  1.0
assign (resid  53 and name hb* ) (resid  54 and name hn  )  4.5  4.5  1.0
assign (resid  55 and name hb1 ) (resid  56 and name hn  )  5.5  5.5  0.0
assign (resid  55 and name hb2 ) (resid  56 and name hn  )  3.5  3.5  0.0
assign (resid  56 and name hb* ) (resid  57 and name hn  )  5.5  5.5  0.0
assign (resid  57 and name hb2 ) (resid  58 and name hn  )  5.5  5.5  0.0
assign (resid  57 and name hb1 ) (resid  58 and name hn  )  4.5  4.5  0.0
assign (resid  58 and name hb  ) (resid  59 and name hn  )  4.5  4.5  0.0
assign (resid  59 and name hb* ) (resid  60 and name hn  )  5.5  5.5  0.0
assign (resid  62 and name hb1 ) (resid  63 and name hn  )  5.5  5.5  0.0
assign (resid  62 and name hb2 ) (resid  63 and name hn  )  5.5  5.5  0.0
assign (resid  66 and name hb* ) (resid  67 and name hn  )  4.5  4.5  1.0
assign (resid  67 and name hb* ) (resid  68 and name hn  )  4.5  4.5  1.0
assign (resid  68 and name hb1 ) (resid  69 and name hn  )  4.5  4.5  0.0
assign (resid  68 and name hb2 ) (resid  69 and name hn  )  4.5  4.5  0.0
assign (resid  69 and name hb1 ) (resid  70 and name hn  )  4.5  4.5  0.0
assign (resid  69 and name hb2 ) (resid  70 and name hn  )  4.5  4.5  1.0
assign (resid  70 and name hb* ) (resid  71 and name hn  )  4.5  4.5  1.0
assign (resid  73 and name hb* ) (resid  74 and name hn  )  3.5  3.5  1.0
assign (resid  74 and name hb  ) (resid  75 and name hn  )  5.5  5.5  0.0
assign (resid  75 and name hb  ) (resid  76 and name hn  )  5.5  5.5  0.0
assign (resid  76 and name hb  ) (resid  77 and name hn  )  3.5  3.5  0.0
assign (resid  77 and name hb1 ) (resid  78 and name hn  )  5.5  5.5  0.0
assign (resid  77 and name hb2 ) (resid  78 and name hn  )  5.5  5.5  0.0
assign (resid  78 and name hb* ) (resid  79 and name hn  )  3.5  3.5  1.0
assign (resid  79 and name hb  ) (resid  80 and name hn  )  4.5  4.5  0.0
assign (resid  80 and name hb* ) (resid  81 and name hn  )  3.5  3.5  1.0
assign (resid  81 and name hb* ) (resid  82 and name hn  )  3.5  3.5  1.0
assign (resid  82 and name hb  ) (resid  83 and name hn  )  3.5  3.5  0.0
assign (resid  83 and name hb1 ) (resid  84 and name hn  )  5.5  5.5  0.0
assign (resid  83 and name hb2 ) (resid  84 and name hn  )  3.5  3.5  0.0
assign (resid  84 and name hb* ) (resid  85 and name hn  )  3.5  3.5  1.0
assign (resid  85 and name hb1 ) (resid  86 and name hn  )  3.5  3.5  0.0
assign (resid  85 and name hb2 ) (resid  86 and name hn  )  4.5  4.5  0.0
assign (resid  86 and name hb* ) (resid  87 and name hn  )  3.5  3.5  1.0
assign (resid  88 and name hb* ) (resid  89 and name hn  )  4.5  4.5  1.0
assign (resid  91 and name hb* ) (resid  92 and name hn  )  4.5  4.5  1.0
assign (resid  93 and name hb* ) (resid  94 and name hn  )  4.5  4.5  1.0
assign (resid  95 and name hb  ) (resid  96 and name hn  )  5.5  5.5  0.0
assign (resid  97 and name hb* ) (resid  98 and name hn  )  5.5  5.5  0.0
assign (resid 100 and name hb* ) (resid 101 and name hn  )  3.5  3.5  1.0
assign (resid 102 and name hb  ) (resid 103 and name hn  )  3.5  3.5  0.0
assign (resid 103 and name hb1 ) (resid 104 and name hn  )  4.5  4.5  0.0
assign (resid 103 and name hb2 ) (resid 104 and name hn  )  3.5  3.5  0.0
assign (resid 104 and name hb  ) (resid 105 and name hn  )  3.5  3.5  0.5
assign (resid 105 and name hb* ) (resid 106 and name hn  )  3.5  3.5  1.0
assign (resid 106 and name hb1 ) (resid 107 and name hn  )  5.5  5.5  0.0
assign (resid 106 and name hb2 ) (resid 107 and name hn  )  5.5  5.5  0.0
assign (resid 107 and name hb* ) (resid 108 and name hn  )  4.5  4.5  1.0
assign (resid 108 and name hb1 ) (resid 109 and name hn  )  5.5  5.5  0.0
assign (resid 108 and name hb2 ) (resid 109 and name hn  )  4.5  4.5  0.0
assign (resid 109 and name hb* ) (resid 110 and name hn  )  5.5  5.5  1.0
assign (resid 110 and name hb  ) (resid 111 and name hn  )  4.5  4.5  0.0
assign (resid 111 and name hb1 ) (resid 112 and name hn  )  4.5  4.5  0.0
assign (resid 111 and name hb2 ) (resid 112 and name hn  )  4.5  4.5  0.0
assign (resid 112 and name hb  ) (resid 113 and name hn  )  4.5  4.5  0.0
assign (resid 113 and name hb1 ) (resid 114 and name hn  )  5.5  5.5  0.0
assign (resid 113 and name hb2 ) (resid 114 and name hn  )  5.5  5.5  0.0
assign (resid 114 and name hb1 ) (resid 115 and name hn  )  5.5  5.5  0.0
assign (resid 114 and name hb2 ) (resid 115 and name hn  )  5.5  5.5  0.0
assign (resid 115 and name hb  ) (resid 116 and name hn  )  4.5  4.5  0.0
assign (resid 116 and name hb  ) (resid 117 and name hn  )  4.5  4.5  0.0
assign (resid 118 and name hb1 ) (resid 119 and name hn  )  3.5  3.5  0.0
assign (resid 118 and name hb2 ) (resid 119 and name hn  )  4.5  4.5  0.0
assign (resid 119 and name hb* ) (resid 120 and name hn  )  3.5  3.5  1.0
assign (resid 121 and name hb* ) (resid 122 and name hn  )  5.5  5.5  0.0
assign (resid 123 and name hb* ) (resid 124 and name hn  )  4.5  4.5  1.0
assign (resid 125 and name hb1 ) (resid 126 and name hn  )  5.5  5.5  0.0
assign (resid 125 and name hb2 ) (resid 126 and name hn  )  4.5  4.5  0.0
assign (resid 126 and name hb  ) (resid 127 and name hn  )  5.5  5.5  0.0
assign (resid 127 and name hb1 ) (resid 128 and name hn  )  3.5  3.5  0.0
assign (resid 127 and name hb2 ) (resid 128 and name hn  )  4.5  4.5  0.0
assign (resid 128 and name hb1 ) (resid 129 and name hn  )  5.5  5.5  0.0
assign (resid 128 and name hb2 ) (resid 129 and name hn  )  5.5  5.5  0.0
assign (resid 130 and name hb* ) (resid 131 and name hn  )  4.5  4.5  1.0
assign (resid 131 and name hb1 ) (resid 132 and name hn  )  3.5  3.5  0.0
assign (resid 131 and name hb2 ) (resid 132 and name hn  )  5.5  5.5  0.0
assign (resid 132 and name hb* ) (resid 133 and name hn  )  5.5  5.5  0.0
assign (resid 133 and name hb1 ) (resid 134 and name hn  )  5.5  5.5  0.0
assign (resid 133 and name hb2 ) (resid 134 and name hn  )  3.5  3.5  0.0
assign (resid 134 and name hb* ) (resid 135 and name hn  )  3.5  3.5  1.0
assign (resid 135 and name hb* ) (resid 136 and name hn  )  5.5  5.5  0.0
assign (resid 136 and name hb1 ) (resid 137 and name hn  )  3.5  3.5  0.0 
assign (resid 136 and name hb2 ) (resid 137 and name hn  )  4.5  4.5  0.0 
assign (resid 137 and name hb  ) (resid 138 and name hn  )  4.5  4.5  0.0
assign (resid 139 and name hb  ) (resid 140 and name hn  )  4.5  4.5  0.0
assign (resid 140 and name hb* ) (resid 141 and name hn  )  4.5  4.5  1.0
assign (resid 143 and name hb  ) (resid 144 and name hn  )  4.5  4.5  0.0
assign (resid 144 and name hb  ) (resid 145 and name hn  )  4.5  4.5  0.0
assign (resid 145 and name hb* ) (resid 146 and name hn  )  3.5  3.5  1.0
assign (resid 147 and name hb  ) (resid 148 and name hn  )  4.5  4.5  0.0
assign (resid 149 and name hb* ) (resid 150 and name hn  )  3.5  3.5  1.0
assign (resid 150 and name hb* ) (resid 151 and name hn  )  3.5  3.5  1.0
assign (resid 151 and name hb* ) (resid 152 and name hn  )  3.5  3.5  1.0
assign (resid 152 and name hb  ) (resid 153 and name hn  )  5.5  5.5  0.0
assign (resid 153 and name hb1 ) (resid 154 and name hn  )  5.5  5.5  0.0
assign (resid 153 and name hb2 ) (resid 154 and name hn  )  3.5  3.5  0.0
assign (resid 154 and name hb  ) (resid 155 and name hn  )  5.5  5.5  0.0
assign (resid 155 and name hb* ) (resid 156 and name hn  )  5.5  5.5  0.0
assign (resid 157 and name hb  ) (resid 158 and name hn  )  5.5  5.5  0.0
assign (resid 158 and name hb1 ) (resid 159 and name hn  )  3.5  3.5  0.0
assign (resid 158 and name hb2 ) (resid 159 and name hn  )  5.5  5.5  0.0
assign (resid 159 and name hb1 ) (resid 160 and name hn  )  4.5  4.5  0.0
assign (resid 159 and name hb2 ) (resid 160 and name hn  )  5.5  5.5  0.0
assign (resid 161 and name hb* ) (resid 162 and name hn  )  3.5  3.5  1.0
!nh(i)-ha(i+1) or hb(i+1)
assign (resid   8 and name hn  ) (resid   9 and name ha  )  5.5  5.5  1.0
assign (resid  70 and name hn  ) (resid  71 and name ha  )  5.5  5.5  0.0
assign (resid  77 and name hn  ) (resid  78 and name ha  )  5.5  5.5  0.0
assign (resid  79 and name hn  ) (resid  80 and name hb* )  5.5  5.5  0.0
assign (resid  80 and name hn  ) (resid  81 and name hb* )  5.5  5.5  0.0
assign (resid  86 and name hn  ) (resid  87 and name hb* )  4.5  4.5  1.0
assign (resid 106 and name hn  ) (resid 107 and name hb* )  5.5  5.5  1.0
assign (resid 108 and name hn  ) (resid 109 and name hb* )  5.5  5.5  1.0
assign (resid 111 and name hn  ) (resid 112 and name hb  )  5.5  5.5  0.0
!other sequential noes
assign (resid   1 and name hg2*) (resid   2 and name hn  )  4.5  4.5  1.0
assign (resid   4 and name hn  ) (resid   5 and name he3 )  3.5  3.5  0.0
assign (resid   4 and name hd1*) (resid   5 and name hn  )  3.5  3.5  1.0
assign (resid   4 and name ha  ) (resid   5 and name he3 )  3.5  3.5  0.0 
assign (resid   4 and name hg  ) (resid   5 and name hn  )  4.5  4.5  0.0
assign (resid   5 and name hd1 ) (resid   6 and name hn  )  4.5  4.5  0.0
assign (resid   7 and name he2*) (resid   8 and name hn  )  5.5  5.5  1.0
assign (resid  12 and name hd2*) (resid  13 and name hn  )  4.5  4.5  1.0
assign (resid  12 and name hd1*) (resid  13 and name hn  )  4.5  4.5  1.0
assign (resid  12 and name hg  ) (resid  13 and name hn  )  3.5  3.5  0.0
assign (resid  12 and name hg  ) (resid  13 and name ha  )  5.5  5.5  0.0
assign (resid  13 and name ha  ) (resid  14 and name ha* )  5.5  5.5  1.0
assign (resid  17 and name ha* ) (resid  18 and name hd2 )  4.5  4.5  1.0 
assign (resid  20 and name hb* ) (resid  21 and name he3 )  3.5  3.5  1.0 
assign (resid  20 and name hg* ) (resid  21 and name he3 )  4.5  4.5  1.0 
assign (resid  20 and name hg* ) (resid  21 and name hz3 )  3.5  3.5  1.0 
assign (resid  20 and name hd* ) (resid  21 and name hn  )  3.5  3.5  1.0
assign (resid  21 and name hd1 ) (resid  22 and name ha  )  4.5  4.5  0.0 
assign (resid  23 and name ha  ) (resid  24 and name hd1 )  2.5  2.5  0.5 
assign (resid  23 and name ha  ) (resid  24 and name hd2 )  2.5  2.5  0.5 
assign (resid  34 and name hg2*) (resid  35 and name hn  )  4.5  4.5  1.0
assign (resid  38 and name hg2*) (resid  39 and name hn  )  3.5  3.5  1.0
assign (resid  40 and name hg1*) (resid  41 and name ha  )  4.5  4.5  1.0
assign (resid  40 and name hg1*) (resid  41 and name hn  )  3.5  3.5  1.0
assign (resid  41 and name hg1*) (resid  42 and name hn  )  4.5  4.5  1.0
assign (resid  41 and name hg2*) (resid  42 and name hn  )  4.5  4.5  1.0
assign (resid  44 and name hg* ) (resid  45 and name hn  )  5.5  5.5  0.0
assign (resid  45 and name hg2*) (resid  46 and name hn  )  4.5  4.5  1.0
assign (resid  47 and name hg* ) (resid  48 and name hn  )  5.5  5.5  0.0
assign (resid  50 and name hg* ) (resid  51 and name hn  )  4.5  4.5  1.0
assign (resid  50 and name hd* ) (resid  51 and name hn  )  3.5  3.5  1.0
assign (resid  52 and name ha  ) (resid  53 and name ha  )  3.5  3.5  0.0
assign (resid  54 and name ha  ) (resid  55 and name hd1 )  2.5  2.5  0.5
assign (resid  54 and name ha  ) (resid  55 and name hd2 )  2.5  2.5  0.5
assign (resid  54 and name hd2*) (resid  55 and name hd1 )  4.5  4.5  0.5
assign (resid  54 and name hd2*) (resid  55 and name hd2 )  4.5  4.5  0.5
assign (resid  56 and name hg* ) (resid  57 and name hn  )  4.5  4.5  1.0
assign (resid  58 and name hg2*) (resid  59 and name hn  )  3.5  3.5  1.0
assign (resid  59 and name ha  ) (resid  60 and name hg2*)  4.5  4.5  1.0
assign (resid  60 and name hg1*) (resid  61 and name hn  )  3.5  3.5  1.0
assign (resid  61 and name hg1*) (resid  62 and name hn  )  3.5  3.5  1.0
assign (resid  62 and name hd2*) (resid  63 and name hn  )  5.5  5.5  1.0
assign (resid  62 and name hd1*) (resid  63 and name hn  )  3.5  3.5  1.0
assign (resid  62 and name hg  ) (resid  63 and name hn  )  3.5  3.5  0.0
assign (resid  74 and name hg1*) (resid  75 and name hn  )  4.5  4.5  1.0
assign (resid  75 and name hg1*) (resid  76 and name hn  )  3.5  3.5  1.0
assign (resid  76 and name ha  ) (resid  77 and name hd2 )  4.5  4.5  0.0
assign (resid  76 and name hg1*) (resid  77 and name hn  )  4.5  4.5  1.0
assign (resid  76 and name hg2*) (resid  77 and name hn  )  4.5  4.5  1.0
assign (resid  81 and name hn  ) (resid  82 and name hg2*)  4.5  4.5  1.0
assign (resid  82 and name hg1*) (resid  83 and name hn  )  4.5  4.5  1.0
assign (resid  82 and name hg2*) (resid  83 and name hn  )  4.5  4.5  1.0
assign (resid  88 and name hn  ) (resid  89 and name hd2 )  5.5  5.5  0.0
assign (resid  88 and name ha  ) (resid  89 and name hd2 )  5.5  5.5  0.0 
assign (resid  88 and name hb* ) (resid  89 and name hd2 )  2.5  2.5  1.0 
assign (resid  88 and name hg* ) (resid  89 and name hd2 )  5.5  5.5  1.0 
assign (resid  90 and name hd* ) (resid  91 and name hn  )  2.5  2.5  1.0
assign (resid  92 and name hg* ) (resid  93 and name hn  )  4.5  4.5  1.0
assign (resid  96 and name hg2*) (resid  97 and name hn  )  3.5  3.5  1.0
assign (resid  96 and name hd1*) (resid  97 and name hn  )  4.5  4.5  1.0
assign (resid 102 and name hg2*) (resid 103 and name hn  )  4.5  4.5  0.5
assign (resid 107 and name hg* ) (resid 108 and name hn  )  4.5  4.5  1.0
assign (resid 110 and name hg2*) (resid 111 and name hn  )  4.5  4.5  1.0
assign (resid 112 and name ha  ) (resid 113 and name hg  )  4.5  4.5  0.0
assign (resid 112 and name hg2*) (resid 113 and name hn  )  4.5  4.5  1.0
assign (resid 116 and name hg2*) (resid 117 and name hn  )  3.5  3.5  1.0
assign (resid 118 and name hg  ) (resid 119 and name hn  )  5.5  5.5  0.0
assign (resid 123 and name hg* ) (resid 124 and name hn  )  4.5  4.5  1.0
assign (resid 126 and name hg2*) (resid 127 and name hn  )  4.5  4.5  1.0
assign (resid 128 and name he* ) (resid 129 and name hn  )  4.5  4.5  1.0
assign (resid 128 and name hg* ) (resid 129 and name hn  )  4.5  4.5  1.0
assign (resid 128 and name he* ) (resid 129 and name hd1*)  3.5  3.5  2.0
assign (resid 128 and name he* ) (resid 129 and name hg11)  3.5  3.5  1.0
assign (resid 128 and name he* ) (resid 129 and name hg12)  3.5  3.5  1.0
assign (resid 131 and name hg  ) (resid 132 and name hn  )  5.5  5.5  0.0
assign (resid 132 and name ha  ) (resid 133 and name hd1 )  5.5  5.5  0.0
assign (resid 133 and name hd1 ) (resid 134 and name hn  )  4.5  4.5  0.5
assign (resid 137 and name hg2*) (resid 138 and name hn  )  3.5  3.5  1.0
assign (resid 138 and name hg* ) (resid 139 and name hn  )  4.5  4.5  1.0
assign (resid 147 and name hg2*) (resid 148 and name hn  )  4.5  4.5  1.0
assign (resid 148 and name ha  ) (resid 149 and name hd* )  2.5  2.5  1.0
assign (resid 152 and name hg2*) (resid 153 and name hn  )  3.5  3.5  1.0
assign (resid 152 and name ha  ) (resid 153 and name he1 )  5.5  5.5  1.0 
assign (resid 154 and name hg2*) (resid 155 and name hn  )  3.5  3.5  1.0
assign (resid 154 and name hg2*) (resid 155 and name ha  )  5.5  5.5  1.0 
assign (resid 157 and name ha  ) (resid 158 and name hd1 )  3.5  3.5  0.0 
! intraresidue noes
assign (resid   3 and name ha  ) (resid   3 and name hd* )  2.5  2.5  1.0
assign (resid   3 and name hn  ) (resid   3 and name hd* )  4.5  4.5  0.0
assign (resid   3 and name hd* ) (resid   3 and name hb1 )  3.5  3.5  0.0 
assign (resid   3 and name hd* ) (resid   3 and name hb2 )  3.5  3.5  0.0 
assign (resid  19 and name ha  ) (resid  19 and name hd* )  2.5  2.5  0.5
assign (resid  29 and name hd* ) (resid  29 and name ha  )  3.5  3.5  0.0 
assign (resid  29 and name hd* ) (resid  29 and name hb* )  3.5  3.5  0.0 
assign (resid  30 and name hd* ) (resid  30 and name ha  )  3.5  3.5  0.0
assign (resid  30 and name hd* ) (resid  30 and name hb1 )  2.5  2.5  0.5
assign (resid  30 and name hd* ) (resid  30 and name hb2 )  2.5  2.5  0.5
assign (resid  35 and name hg* ) (resid  35 and name hn  )  3.5  3.5  0.0
assign (resid  35 and name hg* ) (resid  35 and name ha  )  3.5  3.5  0.0
assign (resid  39 and name hb* ) (resid  39 and name he* )  3.5  3.5  1.0
assign (resid  46 and name hd* ) (resid  46 and name ha  )  2.5  2.5  0.0 
assign (resid  46 and name hd* ) (resid  46 and name hb* )  3.5  3.5  0.0 
assign (resid  46 and name hn  ) (resid  46 and name hd* )  5.5  5.5  0.0
assign (resid  49 and name hd* ) (resid  49 and name ha  )  2.5  2.5  0.5 
assign (resid  68 and name hd* ) (resid  68 and name ha  )  3.5  3.5  0.0 
assign (resid  68 and name hd* ) (resid  68 and name hb1 )  2.5  2.5  0.5 
assign (resid  68 and name hd* ) (resid  68 and name hb2 )  3.5  3.5  0.5 
assign (resid  68 and name hd* ) (resid  68 and name hn  )  5.5  5.5  0.0
assign (resid  79 and name hg* ) (resid  79 and name hn  )  2.5  2.5  1.0
assign (resid  79 and name hg* ) (resid  79 and name ha  )  2.5  2.5  1.0 
assign (resid  83 and name hd* ) (resid  83 and name ha  )  3.5  3.5  0.0
assign (resid  83 and name hd* ) (resid  83 and name hn  )  4.5  4.5  0.0
assign (resid  85 and name hd* ) (resid  85 and name ha  )  3.5  3.5  0.0 
assign (resid  85 and name hd* ) (resid  85 and name hb* )  3.5  3.5  0.0 
assign (resid  85 and name hd* ) (resid  85 and name hn  )  4.5  4.5  0.5
assign (resid  85 and name he* ) (resid  85 and name ha  )  5.5  5.5  0.0 
assign (resid  94 and name hd* ) (resid  94 and name hn  )  5.5  5.5  0.0
assign (resid  94 and name hd* ) (resid  94 and name ha  )  3.5  3.5  0.0
assign (resid  95 and name hg* ) (resid  95 and name hn  )  4.5  4.5  0.0
assign (resid  95 and name hg* ) (resid  95 and name ha  )  4.5  4.5  0.0
assign (resid 102 and name hg1*) (resid 102 and name ha  )  3.5  3.5  0.0
assign (resid 103 and name hd* ) (resid 103 and name ha  )  4.5  4.5  0.0
assign (resid 106 and name hd* ) (resid 106 and name ha  )  3.5  3.5  0.0
assign (resid 106 and name hd* ) (resid 106 and name hn  )  3.5  3.5  0.5
assign (resid 106 and name he* ) (resid 106 and name hn  )  5.5  5.5  0.0
assign (resid 110 and name hg* ) (resid 110 and name hn  )  3.5  3.5  0.0
assign (resid 110 and name hg* ) (resid 110 and name ha  )  3.5  3.5  0.0
assign (resid 115 and name hg* ) (resid 115 and name ha  )  3.5  3.5  0.0
assign (resid 115 and name hg* ) (resid 115 and name hn  )  3.5  3.5  0.0
assign (resid 117 and name ha  ) (resid 118 and name hd1*)  4.5  4.5  1.0
assign (resid 122 and name hd* ) (resid 122 and name ha  )  3.5  3.5  0.0 
assign (resid 136 and name hd* ) (resid 136 and name ha  )  3.5  3.5  0.0 
assign (resid 136 and name hn  ) (resid 136 and name hd* )  4.5  4.5  0.0 
assign (resid 139 and name hg* ) (resid 139 and name hn  )  3.5  3.5  0.0 
assign (resid 155 and name hb1 ) (resid 155 and name hd* )  3.5  3.5  0.0 
assign (resid 155 and name hb2 ) (resid 155 and name hd* )  3.5  3.5  0.0 
assign (resid 155 and name hd* ) (resid 155 and name ha  )  3.5  3.5  0.0 
assign (resid 155 and name hd* ) (resid 155 and name hn  )  4.5  4.5  0.0 
assign (resid 157 and name hg* ) (resid 157 and name hn  )  3.5  3.5  0.0 
assign (resid 157 and name hg* ) (resid 157 and name ha  )  3.5  3.5  0.0 
assign (resid   1 and name hg2*) (resid   1 and name ha  )  3.5  3.5  0.0
assign (resid   2 and name hb* ) (resid   2 and name ha  )  2.5  2.5  1.0
assign (resid   3 and name hb1 ) (resid   3 and name hn  )  4.5  4.5  0.0
assign (resid   3 and name hb2 ) (resid   3 and name hn  )  3.5  3.5  0.0
assign (resid   4 and name ha  ) (resid   4 and name hd1*)  2.5  2.5  1.0 
assign (resid   4 and name ha  ) (resid   4 and name hd2*)  5.5  5.5  1.0 
assign (resid   4 and name ha  ) (resid   4 and name hg  )  4.5  4.5  0.0
assign (resid   4 and name hb1 ) (resid   4 and name hn  )  3.5  3.5  0.0
assign (resid   4 and name hb2 ) (resid   4 and name hn  )  4.5  4.5  0.0
assign (resid   4 and name hd2*) (resid   4 and name hb1 )  4.5  4.5  1.0
assign (resid   4 and name hd2*) (resid   4 and name hb2 )  4.5  4.5  1.0
assign (resid   5 and name hn  ) (resid   5 and name hb* )  4.5  4.5  0.0
assign (resid   5 and name hn  ) (resid   5 and name he3 )  3.5  3.5  0.0
assign (resid   5 and name ha  ) (resid   5 and name he3 )  5.5  5.5  0.0 
assign (resid   5 and name hd1 ) (resid   5 and name hb* )  3.5  3.5  1.0 
assign (resid   5 and name he3 ) (resid   5 and name hb* )  3.5  3.5  1.0 
assign (resid   6 and name hb* ) (resid   6 and name hn  )  3.5  3.5  1.0
assign (resid   7 and name ha  ) (resid   7 and name hn  )  3.5  3.5  0.0
assign (resid   7 and name hb1 ) (resid   7 and name hn  )  3.5  3.5  0.0
assign (resid   7 and name hb2 ) (resid   7 and name hn  )  5.5  5.5  0.0
assign (resid   7 and name hb* ) (resid   7 and name he2*)  4.5  4.5  2.0
assign (resid   8 and name hb1 ) (resid   8 and name hn  )  3.5  3.5  0.0
assign (resid   8 and name hb2 ) (resid   8 and name hn  )  5.5  5.5  0.0
assign (resid   9 and name hb1 ) (resid   9 and name hn  )  3.5  3.5  0.0
assign (resid   9 and name hb2 ) (resid   9 and name hn  )  4.5  4.5  0.0
assign (resid   9 and name hg* ) (resid   9 and name hn  )  3.5  3.5  1.0
assign (resid   9 and name hd* ) (resid   9 and name hn  )  5.5  5.5  1.0
assign (resid  10 and name hb1 ) (resid  10 and name hn  )  4.5  4.5  0.0
assign (resid  10 and name hb2 ) (resid  10 and name hn  )  2.5  2.5  0.5
assign (resid  12 and name hb1 ) (resid  12 and name hn  )  3.5  3.5  0.0
assign (resid  12 and name hb2 ) (resid  12 and name hn  )  3.5  3.5  0.0
assign (resid  12 and name hd1*) (resid  12 and name ha  )  3.5  3.5  1.0
assign (resid  12 and name hd2*) (resid  12 and name ha  )  4.5  4.5  1.0
assign (resid  13 and name hg2*) (resid  13 and name ha  )  3.5  3.5  1.0
assign (resid  13 and name hd1*) (resid  13 and name hb  )  3.5  3.5  1.0
assign (resid  15 and name hb1 ) (resid  15 and name hn  )  3.5  3.5  0.0
assign (resid  15 and name hb2 ) (resid  15 and name hn  )  4.5  4.5  0.0
assign (resid  16 and name hb2 ) (resid  16 and name hn  )  3.5  3.5  0.0
assign (resid  16 and name hb1 ) (resid  16 and name hn  )  4.5  4.5  0.0
assign (resid  18 and name ha  ) (resid  18 and name hd2 )  5.5  5.5  0.0 
assign (resid  18 and name hb* ) (resid  18 and name hd2 )  4.5  4.5  1.0
assign (resid  19 and name ha  ) (resid  19 and name hg  )  2.5  2.5  0.5 
assign (resid  21 and name hb1 ) (resid  21 and name hn  )  4.5  4.5  0.0
assign (resid  21 and name hb2 ) (resid  21 and name hn  )  5.5  5.5  0.0
assign (resid  21 and name hd1 ) (resid  21 and name hb1 )  4.5  4.5  0.0 
assign (resid  21 and name hd1 ) (resid  21 and name hb2 )  3.5  3.5  0.0 
assign (resid  21 and name he3 ) (resid  21 and name hb1 )  3.5  3.5  0.0 
assign (resid  21 and name he3 ) (resid  21 and name hb2 )  4.5  4.5  0.0 
assign (resid  22 and name hb1 ) (resid  22 and name hn  )  3.5  3.5  0.0
assign (resid  22 and name hb2 ) (resid  22 and name hn  )  5.5  5.5  0.0
assign (resid  22 and name hb1 ) (resid  22 and name hd2 )  3.5  3.5  0.0 
assign (resid  22 and name hb2 ) (resid  22 and name hd2 )  4.5  4.5  0.0 
assign (resid  23 and name hb1 ) (resid  23 and name hn  )  4.5  4.5  0.0
assign (resid  23 and name hb2 ) (resid  23 and name hn  )  4.5  4.5  0.0
assign (resid  23 and name hd1*) (resid  23 and name ha  )  2.5  2.5  1.0
assign (resid  23 and name hd2*) (resid  23 and name ha  )  5.5  5.5  1.0
assign (resid  25 and name hb1 ) (resid  25 and name hn  )  4.5  4.5  0.0
assign (resid  25 and name hb2 ) (resid  25 and name hn  )  3.5  3.5  0.0
assign (resid  26 and name hb1 ) (resid  26 and name hn  )  2.5  2.5  0.5
assign (resid  26 and name hb2 ) (resid  26 and name hn  )  3.5  3.5  0.0
assign (resid  27 and name hb1 ) (resid  27 and name hn  )  4.5  4.5  0.0
assign (resid  27 and name hb2 ) (resid  27 and name hn  )  2.5  2.5  0.0
assign (resid  27 and name hd1*) (resid  27 and name ha  )  5.5  5.5  1.0
assign (resid  27 and name hd2*) (resid  27 and name ha  )  2.5  2.5  1.0
assign (resid  27 and name hd1*) (resid  27 and name hn  )  4.5  4.5  1.0
assign (resid  27 and name hd2*) (resid  27 and name hn  )  4.5  4.5  1.0
assign (resid  28 and name hb* ) (resid  28 and name hn  )  3.5  3.5  1.0
assign (resid  28 and name hd2 ) (resid  28 and name ha  )  5.5  5.5  0.0
assign (resid  28 and name hd2 ) (resid  28 and name hb* )  4.5  4.5  1.0
assign (resid  29 and name hb1 ) (resid  29 and name hn  )  4.5  4.5  0.0
assign (resid  29 and name hb2 ) (resid  29 and name hn  )  3.5  3.5  0.0
assign (resid  30 and name hb1 ) (resid  30 and name hn  )  3.5  3.5  0.0
assign (resid  30 and name hb2 ) (resid  30 and name hn  )  3.5  3.5  0.0
assign (resid  30 and name hb* ) (resid  30 and name hn  )  2.5  2.5  1.0
assign (resid  31 and name ha  ) (resid  31 and name hg* )  3.5  3.5  1.0
assign (resid  32 and name hb* ) (resid  32 and name ha  )  2.5  2.5  1.0
assign (resid  33 and name hb1 ) (resid  33 and name hn  )  4.5  4.5  0.0
assign (resid  33 and name hb2 ) (resid  33 and name hn  )  2.5  2.5  0.0
assign (resid  33 and name hg* ) (resid  33 and name hn  )  3.5  3.5  1.0
assign (resid  34 and name hb  ) (resid  34 and name hn  )  4.5  4.5  0.0
assign (resid  34 and name hg2*) (resid  34 and name hn  )  3.5  3.5  1.0
assign (resid  34 and name hg2*) (resid  34 and name ha  )  3.5  3.5  1.0
assign (resid  37 and name hb1 ) (resid  37 and name hn  )  4.5  4.5  0.0
assign (resid  37 and name hb2 ) (resid  37 and name hn  )  3.5  3.5  0.0
assign (resid  38 and name hb  ) (resid  38 and name hn  )  3.5  3.5  0.0
assign (resid  38 and name hg2*) (resid  38 and name hn  )  4.5  4.5  1.0
assign (resid  39 and name ha  ) (resid  39 and name hg* )  4.5  4.5  1.0
assign (resid  39 and name hb1 ) (resid  39 and name hn  )  4.5  4.5  0.0
assign (resid  39 and name hb2 ) (resid  39 and name hn  )  4.5  4.5  0.0
assign (resid  40 and name hb  ) (resid  40 and name hn  )  3.5  3.5  0.0
assign (resid  40 and name hg1*) (resid  40 and name hn  )  4.5  4.5  1.0
assign (resid  40 and name hg2*) (resid  40 and name hn  )  3.5  3.5  1.0
assign (resid  40 and name hg1*) (resid  40 and name ha  )  3.5  3.5  1.0
assign (resid  40 and name hg2*) (resid  40 and name ha  )  3.5  3.5  1.0
assign (resid  41 and name hg1*) (resid  41 and name hn  )  4.5  4.5  1.0
assign (resid  41 and name hg2*) (resid  41 and name hn  )  3.5  3.5  1.0
assign (resid  41 and name hg1*) (resid  41 and name ha  )  2.5  2.5  1.0
assign (resid  41 and name hg2*) (resid  41 and name ha  )  4.5  4.5  1.0
assign (resid  43 and name hb1 ) (resid  43 and name hn  )  3.5  3.5  0.5
assign (resid  43 and name hb2 ) (resid  43 and name hn  )  5.5  5.5  0.0
assign (resid  44 and name hb* ) (resid  44 and name hn  )  3.5  3.5  1.0
assign (resid  44 and name hn  ) (resid  44 and name hd* )  5.5  5.5  0.0
assign (resid  45 and name hb  ) (resid  45 and name hn  )  3.5  3.5  0.0
assign (resid  45 and name hg2*) (resid  45 and name ha  )  3.5  3.5  1.0
assign (resid  46 and name hb* ) (resid  46 and name hn  )  3.5  3.5  1.0
assign (resid  47 and name hb1 ) (resid  47 and name hn  )  4.5  4.5  0.0
assign (resid  47 and name hb2 ) (resid  47 and name hn  )  2.5  2.5  0.0
assign (resid  48 and name hb* ) (resid  48 and name hn  )  3.5  3.5  1.0
assign (resid  49 and name hb* ) (resid  49 and name hn  )  3.5  3.5  1.0
assign (resid  51 and name hb* ) (resid  51 and name hn  )  3.5  3.5  1.0
assign (resid  52 and name hb* ) (resid  52 and name hn  )  4.5  4.5  1.0
assign (resid  54 and name hb1 ) (resid  54 and name hn  )  4.5  4.5  0.0
assign (resid  54 and name hb2 ) (resid  54 and name hn  )  3.5  3.5  0.0
assign (resid  54 and name hd1*) (resid  54 and name hn  )  4.5  4.5  1.0
assign (resid  54 and name hd2*) (resid  54 and name hn  )  4.5  4.5  1.0
assign (resid  54 and name hd1*) (resid  54 and name ha  )  4.5  4.5  1.0
assign (resid  54 and name hd2*) (resid  54 and name ha  )  3.5  3.5  1.0
assign (resid  56 and name hb* ) (resid  56 and name hn  )  4.5  4.5  1.0
assign (resid  57 and name hb1 ) (resid  57 and name hn  )  4.5  4.5  1.0
assign (resid  57 and name hb2 ) (resid  57 and name hn  )  4.5  4.5  1.0
assign (resid  57 and name he  ) (resid  57 and name hn  )  4.5  4.5  0.5
assign (resid  58 and name hb  ) (resid  58 and name hn  )  4.5  4.5  0.0
assign (resid  58 and name hg2*) (resid  58 and name ha  )  2.5  2.5  1.0
assign (resid  58 and name hg2*) (resid  58 and name hn  )  4.5  4.5  1.0
assign (resid  59 and name hb2 ) (resid  59 and name hn  )  3.5  3.5  0.0
assign (resid  59 and name hb1 ) (resid  59 and name hn  )  4.5  4.5  0.0
assign (resid  59 and name hn  ) (resid  59 and name hd2*)  3.5  3.5  1.0
assign (resid  59 and name hd2*) (resid  59 and name ha  )  4.5  4.5  1.0
assign (resid  60 and name hn  ) (resid  60 and name hb  )  3.5  3.5  0.0
assign (resid  60 and name hn  ) (resid  60 and name hg1*)  4.5  4.5  1.0
assign (resid  60 and name hn  ) (resid  60 and name hg2*)  3.5  3.5  1.0
assign (resid  60 and name hg1*) (resid  60 and name ha  )  4.5  4.5  1.0
assign (resid  60 and name hg2*) (resid  60 and name ha  )  3.5  3.5  1.0
assign (resid  61 and name hn  ) (resid  61 and name hb  )  3.5  3.5  0.0
assign (resid  61 and name hn  ) (resid  61 and name hg1*)  4.5  4.5  1.0
assign (resid  61 and name hn  ) (resid  61 and name hg2*)  3.5  3.5  1.0
assign (resid  61 and name hg1*) (resid  61 and name ha  )  3.5  3.5  1.0
assign (resid  61 and name hg2*) (resid  61 and name ha  )  3.5  3.5  1.0
assign (resid  62 and name hb1 ) (resid  62 and name ha  )  3.5  3.5  0.0
assign (resid  62 and name hb2 ) (resid  62 and name ha  )  2.5  2.5  0.5
assign (resid  62 and name hb1 ) (resid  62 and name hn  )  3.5  3.5  0.0
assign (resid  62 and name hb2 ) (resid  62 and name hn  )  3.5  3.5  0.0
assign (resid  62 and name hd1*) (resid  62 and name ha  )  2.5  2.5  1.0
assign (resid  62 and name hd2*) (resid  62 and name ha  )  4.5  4.5  1.0
assign (resid  63 and name hb  ) (resid  63 and name hn  )  5.5  5.5  0.0
assign (resid  63 and name hg2*) (resid  63 and name hn  )  3.5  3.5  1.0
assign (resid  63 and name hg2*) (resid  63 and name ha  )  3.5  3.5  1.0
assign (resid  64 and name ha  ) (resid  64 and name hd2 )  4.5  4.5  0.0
assign (resid  64 and name hb1 ) (resid  64 and name hd2 )  4.5  4.5  0.0 
assign (resid  64 and name hb2 ) (resid  64 and name hd2 )  4.5  4.5  0.0 
assign (resid  65 and name ha  ) (resid  65 and name hg* )  5.5  5.5  1.0
assign (resid  65 and name he2*) (resid  65 and name hg* )  3.5  3.5  2.0
assign (resid  66 and name hb* ) (resid  66 and name hn  )  2.5  2.5  1.0
assign (resid  66 and name hg* ) (resid  66 and name hn  )  3.5  3.5  1.0
assign (resid  67 and name hb1 ) (resid  67 and name hn  )  4.5  4.5  0.0
assign (resid  67 and name hb2 ) (resid  67 and name hn  )  3.5  3.5  0.0
assign (resid  68 and name hb1 ) (resid  68 and name hn  )  3.5  3.5  0.0
assign (resid  68 and name hb2 ) (resid  68 and name hn  )  2.5  2.5  0.5
assign (resid  69 and name hb1 ) (resid  69 and name hn  )  4.5  4.5  0.0
assign (resid  69 and name hb2 ) (resid  69 and name hn  )  2.5  2.5  0.5
assign (resid  69 and name hg* ) (resid  69 and name hn  )  3.5  3.5  1.0
assign (resid  69 and name hg* ) (resid  69 and name he2*)  3.5  3.5  2.0
assign (resid  70 and name hb* ) (resid  70 and name ha  )  3.5  3.5  1.0
assign (resid  73 and name hb* ) (resid  73 and name ha  )  2.5  2.5  1.0
assign (resid  74 and name hb  ) (resid  74 and name hn  )  3.5  3.5  0.0
assign (resid  74 and name hg1*) (resid  74 and name hn  )  4.5  4.5  1.0
assign (resid  74 and name hg2*) (resid  74 and name hn  )  3.5  3.5  1.0
assign (resid  74 and name hg1*) (resid  74 and name ha  )  3.5  3.5  1.0
assign (resid  74 and name hg2*) (resid  74 and name ha  )  3.5  3.5  1.0
assign (resid  75 and name hb  ) (resid  75 and name hn  )  3.5  3.5  0.0
assign (resid  75 and name hg1*) (resid  75 and name hn  )  5.5  5.5  0.0
assign (resid  75 and name hg2*) (resid  75 and name hn  )  3.5  3.5  1.0
assign (resid  75 and name hg2*) (resid  75 and name ha  )  3.5  3.5  1.0
assign (resid  76 and name hb  ) (resid  76 and name hn  )  5.5  5.5  0.0
assign (resid  76 and name hg1*) (resid  76 and name hn  )  4.5  4.5  1.0
assign (resid  76 and name hg2*) (resid  76 and name hn  )  3.5  3.5  1.0
assign (resid  76 and name hg1*) (resid  76 and name ha  )  2.5  2.5  1.0
assign (resid  76 and name hg2*) (resid  76 and name ha  )  5.5  5.5  0.0
assign (resid  77 and name hb1 ) (resid  77 and name hn  )  4.5  4.5  0.0
assign (resid  77 and name hb2 ) (resid  77 and name hn  )  3.5  3.5  0.0
assign (resid  77 and name hd2 ) (resid  77 and name ha  )  4.5  4.5  0.0
assign (resid  77 and name hd2 ) (resid  77 and name hb1 )  5.5  5.5  0.0
assign (resid  77 and name hd2 ) (resid  77 and name hb2 )  3.5  3.5  0.0
assign (resid  78 and name hb* ) (resid  78 and name hn  )  4.5  4.5  1.0
assign (resid  79 and name ha  ) (resid  79 and name hb  )  3.5  3.5  0.0
assign (resid  79 and name hb  ) (resid  79 and name hn  )  3.5  3.5  0.0
assign (resid  80 and name hb* ) (resid  80 and name ha  )  2.5  2.5  1.0
assign (resid  81 and name hb* ) (resid  81 and name ha  )  2.5  2.5  1.0
assign (resid  82 and name hb  ) (resid  82 and name hn  )  3.5  3.5  0.0
assign (resid  82 and name hg1*) (resid  82 and name hn  )  4.5  4.5  1.0
assign (resid  82 and name hg2*) (resid  82 and name hn  )  2.5  2.5  1.0
assign (resid  82 and name hg1*) (resid  82 and name ha  )  2.5  2.5  1.0 
assign (resid  82 and name hg2*) (resid  82 and name ha  )  2.5  2.5  1.0 
assign (resid  83 and name hb1 ) (resid  83 and name hn  )  4.5  4.5  0.0
assign (resid  83 and name hb2 ) (resid  83 and name hn  )  2.5  2.5  0.0
assign (resid  84 and name hb* ) (resid  84 and name ha  )  2.5  2.5  1.0
assign (resid  85 and name hb1 ) (resid  85 and name hn  )  4.0  4.0  0.0
assign (resid  85 and name hb2 ) (resid  85 and name hn  )  3.5  3.5  0.0
assign (resid  86 and name hb* ) (resid  86 and name ha  )  3.5  3.5  1.0
assign (resid  87 and name hb* ) (resid  87 and name ha  )  2.5  2.5  1.0
assign (resid  87 and name hg* ) (resid  87 and name ha  )  4.5  4.5  1.0
assign (resid  88 and name hb* ) (resid  88 and name ha  )  2.5  2.5  1.0
assign (resid  88 and name he2*) (resid  88 and name hg* )  3.5  3.5  2.0
assign (resid  88 and name he2*) (resid  88 and name ha  )  4.5  4.5  1.0
assign (resid  89 and name hb1 ) (resid  89 and name hn  )  4.5  4.5  0.0
assign (resid  89 and name hb2 ) (resid  89 and name hn  )  3.5  3.5  0.0
assign (resid  89 and name hd2 ) (resid  89 and name ha  )  3.5  3.5  0.0
assign (resid  89 and name hd2 ) (resid  89 and name hn  )  4.5  4.5  0.0
assign (resid  89 and name hb1 ) (resid  89 and name hd2 )  3.5  3.5  0.5 
assign (resid  89 and name hb2 ) (resid  89 and name hd2 )  5.5  5.5  0.0 
assign (resid  91 and name hb* ) (resid  91 and name hn  )  3.5  3.5  1.0
assign (resid  92 and name hb1 ) (resid  92 and name hn  )  4.5  4.5  0.0
assign (resid  92 and name hb2 ) (resid  92 and name hn  )  2.5  2.5  0.0
assign (resid  92 and name hg* ) (resid  92 and name he2*)  3.5  3.5  2.0
assign (resid  93 and name hb1 ) (resid  93 and name hn  )  4.5  4.5  0.0
assign (resid  93 and name hb2 ) (resid  93 and name hn  )  3.5  3.5  0.0
assign (resid  94 and name hb* ) (resid  94 and name hn  )  2.5  2.5  1.0
assign (resid  95 and name hb  ) (resid  95 and name hn  )  3.5  3.5  0.0
assign (resid  96 and name hn  ) (resid  96 and name hd1*)  3.5  3.5  1.0
assign (resid  96 and name hb  ) (resid  96 and name hd1*)  3.5  3.5  1.0
assign (resid  96 and name hd1*) (resid  96 and name ha  )  2.5  2.5  1.0
assign (resid  96 and name hg2*) (resid  96 and name ha  )  3.5  3.5  1.0
assign (resid  96 and name hn  ) (resid  96 and name hb  )  3.5  3.5  0.0
assign (resid  96 and name hn  ) (resid  96 and name hg1*)  3.5  3.5  1.0
assign (resid  96 and name hn  ) (resid  96 and name hg2*)  4.5  4.5  1.0
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assign (resid 101 and name hb2 ) (resid 101 and name hn  )  3.5  3.5  0.0
assign (resid 101 and name hg1 ) (resid 101 and name he2*)  3.5  3.5  1.0
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assign (resid 102 and name hb  ) (resid 102 and name hn  )  3.5  3.5  0.0
assign (resid 102 and name hg* ) (resid 102 and name hn  )  3.5  3.5  1.0
assign (resid 102 and name hn  ) (resid 102 and name hd1*)  4.5  4.5  1.0
assign (resid 103 and name hb1 ) (resid 103 and name hn  )  4.5  4.5  0.0
assign (resid 103 and name hb2 ) (resid 103 and name hn  )  3.5  3.5  0.0
assign (resid 104 and name hb  ) (resid 104 and name hn  )  3.5  3.5  0.0
assign (resid 104 and name hg2*) (resid 104 and name ha  )  3.5  3.5  1.0
assign (resid 104 and name hg2*) (resid 104 and name hn  )  4.5  4.5  1.0
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assign (resid 106 and name hb1 ) (resid 106 and name hn  )  4.5  4.5  0.0
assign (resid 106 and name hb2 ) (resid 106 and name hn  )  2.5  2.5  0.5
assign (resid 107 and name hb* ) (resid 107 and name hn  )  3.5  3.5  1.0
assign (resid 107 and name hg* ) (resid 107 and name hn  )  3.5  3.5  1.0
assign (resid 107 and name hd* ) (resid 107 and name hn  )  4.5  4.5  1.0
assign (resid 108 and name hb1 ) (resid 108 and name hn  )  3.5  3.5  0.0
assign (resid 108 and name hb2 ) (resid 108 and name hn  )  3.5  3.5  0.0
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assign (resid 109 and name hb2 ) (resid 109 and name hn  )  3.5  3.5  0.0
assign (resid 110 and name ha  ) (resid 110 and name hg2*)  3.5  3.5  0.0
assign (resid 110 and name hb  ) (resid 110 and name hn  )  3.5  3.5  0.0
assign (resid 111 and name hb1 ) (resid 111 and name hn  )  4.5  4.5  0.0
assign (resid 111 and name hb2 ) (resid 111 and name hn  )  4.5  4.5  0.0
assign (resid 112 and name hb  ) (resid 112 and name hn  )  3.5  3.5  0.0
assign (resid 112 and name hg2*) (resid 112 and name hn  )  4.5  4.5  1.0
assign (resid 112 and name hg2*) (resid 112 and name ha  )  2.5  2.5  1.0
assign (resid 113 and name hb* ) (resid 113 and name hn  )  3.5  3.5  1.0
assign (resid 113 and name hd1*) (resid 113 and name ha  )  4.5  4.5  1.0
assign (resid 113 and name hd2*) (resid 113 and name ha  )  3.5  3.5  0.0
assign (resid 113 and name hd1*) (resid 113 and name hn  )  4.5  4.5  1.0
assign (resid 113 and name hd2*) (resid 113 and name hn  )  4.5  4.5  1.0
assign (resid 113 and name hg  ) (resid 113 and name hn  )  3.5  3.5  0.0
assign (resid 114 and name hb1 ) (resid 114 and name hn  )  4.5  4.5  0.0
assign (resid 114 and name hb2 ) (resid 114 and name hn  )  3.5  3.5  0.0
assign (resid 114 and name hg  ) (resid 114 and name hn  )  3.5  3.5  0.5
assign (resid 114 and name hg  ) (resid 114 and name ha  )  3.5  3.5  0.0
assign (resid 114 and name hd1*) (resid 114 and name ha  )  5.5  5.5  1.0
assign (resid 114 and name hd2*) (resid 114 and name ha  )  3.5  3.5  1.0
assign (resid 114 and name hd1*) (resid 114 and name hn  )  4.5  4.5  1.0
assign (resid 114 and name hd2*) (resid 114 and name hn  )  4.5  4.5  1.0
assign (resid 114 and name hd1*) (resid 114 and name hb1 )  3.5  3.5  0.5 
assign (resid 114 and name hd2*) (resid 114 and name hb1 )  3.5  3.5  0.5
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assign (resid 114 and name hd2*) (resid 114 and name hb2 )  5.5  5.5  0.5
assign (resid 116 and name hb  ) (resid 116 and name hn  )  3.5  3.5  0.0
assign (resid 116 and name hg2*) (resid 116 and name hn  )  4.5  4.5  1.0
assign (resid 116 and name hg2*) (resid 116 and name ha  )  2.5  2.5  1.0
assign (resid 116 and name hg2*) (resid 116 and name hg1 )  2.5  2.5  1.0
assign (resid 117 and name hb1 ) (resid 117 and name hn  )  4.5  4.5  0.0
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assign (resid 118 and name hd1*) (resid 118 and name ha  )  3.5  3.5  1.0
assign (resid 118 and name hd2*) (resid 118 and name ha  )  4.5  4.5  1.0
assign (resid 118 and name hd1*) (resid 118 and name hb1 )  4.5  4.5  1.0
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assign (resid 118 and name hd1*) (resid 118 and name hn  )  3.5  3.5  1.0
assign (resid 118 and name hd2*) (resid 118 and name hn  )  5.5  5.5  0.0 
assign (resid 119 and name hb* ) (resid 119 and name ha  )  2.5  2.5  1.0 
assign (resid 121 and name hb* ) (resid 121 and name hn  )  3.5  3.5  1.0 
assign (resid 122 and name hb1 ) (resid 122 and name hn  )  4.5  4.5  0.0
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assign (resid 123 and name hb* ) (resid 123 and name hn  )  3.5  3.5  1.0 
assign (resid 123 and name hg* ) (resid 123 and name hn  )  4.5  4.5  1.0 
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assign (resid 125 and name hb2 ) (resid 125 and name hn  )  4.5  4.5  0.0 
assign (resid 126 and name hb  ) (resid 126 and name hn  )  3.5  3.5  0.0
assign (resid 126 and name hg2*) (resid 126 and name ha  )  2.5  2.5  1.0
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assign (resid 127 and name hb2 ) (resid 127 and name hn  )  3.5  3.5  0.0 
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assign (resid 128 and name he* ) (resid 128 and name ha  )  4.5  4.5  1.0 
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assign (resid 129 and name hg1*) (resid 129 and name hn  )  2.5  2.5  1.0 
assign (resid 129 and name hg2*) (resid 129 and name hn  )  3.5  3.5  1.0 
assign (resid 129 and name hg2*) (resid 129 and name ha  )  3.5  3.5  1.0 
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assign (resid 131 and name hb2 ) (resid 131 and name hn  )  2.5  2.5  0.0 
assign (resid 131 and name hg  ) (resid 131 and name hn  )  3.5  3.5  0.0 
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assign (resid 131 and name hd2*) (resid 131 and name ha  )  4.5  4.5  1.0 
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assign (resid 133 and name hd1 ) (resid 133 and name hn  )  2.5  2.5  0.0 
assign (resid 133 and name hd1 ) (resid 133 and name ha  )  4.5  4.5  0.0 
assign (resid 133 and name he3 ) (resid 133 and name ha  )  4.5  4.5  0.0
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assign (resid 137 and name hg2*) (resid 137 and name hn  )  4.5  4.5  1.0 
assign (resid 137 and name hg2*) (resid 137 and name ha  )  3.5  3.5  1.0 
assign (resid 137 and name hn  ) (resid 137 and name hb  )  3.5  3.5  0.0 
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assign (resid 138 and name hg1 ) (resid 138 and name hn  )  5.5  5.5  0.0 
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assign (resid 142 and name hb* ) (resid 142 and name hn  )  3.5  3.5  1.0 
assign (resid 142 and name hg* ) (resid 142 and name hn  )  4.5  4.5  1.0 
assign (resid 143 and name hb  ) (resid 143 and name hn  )  3.5  3.5  0.0 
assign (resid 143 and name hg2*) (resid 143 and name ha  )  2.5  2.5  1.0 
assign (resid 143 and name hg2*) (resid 143 and name hn  )  4.5  4.5  1.0 
assign (resid 144 and name hb  ) (resid 144 and name hn  )  3.5  3.5  0.0 
assign (resid 144 and name hb  ) (resid 144 and name ha  )  3.5  3.5  0.0 
assign (resid 144 and name hg1*) (resid 144 and name ha  )  4.5  4.5  1.0 
assign (resid 144 and name hg2*) (resid 144 and name ha  )  2.5  2.5  1.0 
assign (resid 145 and name hb* ) (resid 145 and name hn  )  2.5  2.5  1.0 
assign (resid 145 and name hg* ) (resid 145 and name hn  )  3.5  3.5  1.0 
assign (resid 146 and name hb1 ) (resid 146 and name hn  )  3.5  3.5  0.0 
assign (resid 146 and name hb2 ) (resid 146 and name hn  )  3.5  3.5  0.0 
assign (resid 146 and name hb2 ) (resid 146 and name ha  )  3.5  3.5  0.0 
assign (resid 147 and name hb  ) (resid 147 and name hn  )  3.5  3.5  1.0 
assign (resid 147 and name hg2*) (resid 147 and name hn  )  3.5  3.5  1.0 
assign (resid 147 and name hg2*) (resid 147 and name ha  )  3.5  3.5  1.0 
assign (resid 148 and name hb1 ) (resid 148 and name hn  )  3.5  3.5  0.0 
assign (resid 148 and name hb2 ) (resid 148 and name hn  )  3.5  3.5  0.0 
assign (resid 148 and name hb1 ) (resid 148 and name hd2*)  4.5  4.5  1.0 
assign (resid 148 and name hb2 ) (resid 148 and name hd2*)  2.5  2.5  1.0 
assign (resid 148 and name hb1 ) (resid 148 and name ha  )  3.5  3.5  0.0 
assign (resid 148 and name hb2 ) (resid 148 and name ha  )  3.5  3.5  0.0 
assign (resid 150 and name hb* ) (resid 150 and name ha  )  2.5  2.5  1.0 
assign (resid 151 and name hb1 ) (resid 151 and name hn  )  4.5  4.5  0.0 
assign (resid 151 and name hb2 ) (resid 151 and name hn  )  3.5  3.5  0.0 
assign (resid 151 and name hg  ) (resid 151 and name hn  )  3.5  3.5  0.0 
assign (resid 151 and name hd1*) (resid 151 and name hn  )  4.5  4.5  1.0 
assign (resid 151 and name hd2*) (resid 151 and name hn  )  4.5  4.5  1.0 
assign (resid 151 and name hd1*) (resid 151 and name ha  )  5.5  5.5  1.0 
assign (resid 151 and name hd2*) (resid 151 and name ha  )  2.5  2.5  1.0 
assign (resid 152 and name hb  ) (resid 152 and name hn  )  4.5  4.5  0.0 
assign (resid 152 and name hg2*) (resid 152 and name hn  )  4.5  4.5  1.0 
assign (resid 152 and name hg2*) (resid 152 and name ha  )  3.5  3.5  1.0 
assign (resid 153 and name hb1 ) (resid 153 and name hn  )  4.5  4.5  0.0 
assign (resid 153 and name hb2 ) (resid 153 and name hn  )  4.5  4.5  0.0 
assign (resid 153 and name hd2 ) (resid 153 and name hb* )  4.5  4.5  1.0 
assign (resid 153 and name hb1 ) (resid 153 and name ha  )  2.5  2.5  0.5 
assign (resid 153 and name hb2 ) (resid 153 and name ha  )  2.5  2.5  0.5 
assign (resid 154 and name hb  ) (resid 154 and name hn  )  3.5  3.5  0.0 
assign (resid 154 and name hg2*) (resid 154 and name hn  )  5.5  5.5  0.0 
assign (resid 154 and name hg2*) (resid 154 and name ha  )  2.5  2.5  1.0 
assign (resid 155 and name hb1 ) (resid 155 and name hn  )  4.5  4.5  0.0 
assign (resid 155 and name hb2 ) (resid 155 and name hn  )  3.5  3.5  0.0 
assign (resid 156 and name hn  ) (resid 156 and name hg* )  4.5  4.5  1.0 
assign (resid 156 and name hb1 ) (resid 156 and name hn  )  4.5  4.5  0.0 
assign (resid 156 and name hb2 ) (resid 156 and name hn  )  5.5  5.5  0.0 
assign (resid 157 and name hb  ) (resid 157 and name hn  )  3.5  3.5  0.0 
assign (resid 158 and name hn  ) (resid 158 and name hd1 )  3.5  3.5  0.0 
assign (resid 158 and name ha  ) (resid 158 and name hd1 )  5.5  5.5  0.0 
assign (resid 158 and name hb1 ) (resid 158 and name hn  )  4.5  4.5  0.0 
assign (resid 158 and name hb2 ) (resid 158 and name hn  )  3.5  3.5  0.0 
assign (resid 158 and name hb1 ) (resid 158 and name ha  )  3.5  3.5  0.0 
assign (resid 158 and name hb2 ) (resid 158 and name ha  )  4.5  4.5  0.0 
assign (resid 158 and name hd1 ) (resid 158 and name hb1 )  5.5  5.5  0.0 
assign (resid 158 and name hd1 ) (resid 158 and name hb2 )  3.5  3.5  0.0  
assign (resid 159 and name hb1 ) (resid 159 and name hn  )  4.5  4.5  0.0 
assign (resid 159 and name hb2 ) (resid 159 and name hn  )  3.5  3.5  0.0 
assign (resid 159 and name hb1 ) (resid 159 and name ha  )  3.5  3.5  0.0 
assign (resid 159 and name hb2 ) (resid 159 and name ha  )  3.5  3.5  0.0 
assign (resid 159 and name hg* ) (resid 159 and name he2*)  3.5  3.5  2.0 
assign (resid 160 and name hb* ) (resid 160 and name hn  )  3.5  3.5  1.0 
!intra-tmq noes 
assign (resid 170 and name hm* ) (resid 170 and name h91 )  2.5  2.5  0.5
assign (resid 170 and name hm* ) (resid 170 and name h92 )  2.5  2.5  0.5
assign (resid 170 and name h7  ) (resid 170 and name h91 )  4.5  4.5  0.0
assign (resid 170 and name h7  ) (resid 170 and name h92 )  4.5  4.5  0.0
assign (resid 170 and name hp2 ) (resid 170 and name h91 )  5.5  5.5  0.0
assign (resid 170 and name hp2 ) (resid 170 and name h92 )  3.5  3.5  0.0
assign (resid 170 and name hp2 ) (resid 170 and name h7  )  3.5  3.5  0.5
assign (resid 170 and name hp2 ) (resid 170 and name hm* )  5.5  5.5  1.0
assign (resid 170 and name hp6 ) (resid 170 and name h1n )  3.5  3.5  0.0
assign (resid 170 and name hw2*) (resid 170 and name h1n )  5.5  5.5  0.0
assign (resid 170 and name h91 ) (resid 170 and name h1n )  2.5  2.5  0.0
assign (resid 170 and name h92 ) (resid 170 and name h1n )  3.5  3.5  0.0
!tmq-dhfr noes 
assign (resid 170 and name h1  ) (resid   6 and name hb* )  2.5  2.5  1.0
assign (resid 170 and name h1  ) (resid  26 and name ha  )  5.5  5.5  1.5
assign (resid 170 and name h1  ) (resid  26 and name hb1 )  5.5  5.5  1.5
assign (resid 170 and name h1  ) (resid  26 and name hb2 )  5.5  5.5  1.5
assign (resid 170 and name h1  ) (resid  27 and name ha  )  3.5  3.5  1.5
assign (resid 170 and name h1  ) (resid  27 and name hd2*)  3.5  3.5  1.0
assign (resid 170 and name h1  ) (resid  29 and name hb1 )  5.5  5.5  1.0
assign (resid 170 and name h1  ) (resid  30 and name ha  )  5.5  5.5  1.5
assign (resid 170 and name h1  ) (resid  30 and name hb1 )  5.5  5.5  1.5
assign (resid 170 and name h1  ) (resid  30 and name hb2 )  5.5  3.5  1.0
assign (resid 170 and name h1  ) (resid  30 and name hd* )  4.5  4.5  1.0
assign (resid 170 and name h1  ) (resid 116 and name hg1 )  5.5  5.5  1.0
assign (resid 170 and name hn2*) (resid   4 and name hg  )  4.5  4.5  1.0
assign (resid 170 and name hn2*) (resid   4 and name hd1*)  3.5  3.5  1.0
assign (resid 170 and name hn2*) (resid   5 and name ha  )  5.5  1.0  1.0
assign (resid 170 and name hn2*) (resid   5 and name hn  )  4.5  4.5  1.0
assign (resid 170 and name hn2*) (resid   6 and name hb* )  3.5  3.5  1.0
assign (resid 170 and name hn2*) (resid  29 and name hd* )  4.5  4.5  1.0
assign (resid 170 and name hn2*) (resid  29 and name he* )  5.5  5.5  1.0
assign (resid 170 and name hn2*) (resid 116 and name hb  )  4.5  4.5  1.0
assign (resid 170 and name hn2*) (resid 116 and name hg1 )  2.5  2.5  1.0
assign (resid 170 and name hn2*) (resid 116 and name hg2*)  4.5  4.5  1.0
assign (resid 170 and name hn4*) (resid   4 and name hg  )  2.5  2.5  1.0
assign (resid 170 and name hn4*) (resid   5 and name ha  )  2.5  2.5  1.0
assign (resid 170 and name hn4*) (resid   5 and name hb* )  5.5  5.5  1.0
assign (resid 170 and name hn4*) (resid  30 and name he* )  3.5  3.5  1.0
assign (resid 170 and name hn4*) (resid  97 and name ha  )  2.5  2.5  1.0
assign (resid 170 and name hn4*) (resid  97 and name hb* )  3.5  3.5  1.0
assign (resid 170 and name hm* ) (resid  30 and name hd* )  5.5  5.5  0.0
assign (resid 170 and name hm* ) (resid  30 and name he* )  3.5  3.5  0.0
assign (resid 170 and name hm* ) (resid  30 and name hz  )  5.5  5.5  0.5
assign (resid 170 and name hm* ) (resid  41 and name hg1*)  5.5  5.5  1.0
assign (resid 170 and name hm* ) (resid  45 and name hg2*)  2.5  2.5  0.5
assign (resid 170 and name hm* ) (resid  49 and name hd* )  5.5  5.5  0.0
assign (resid 170 and name hm* ) (resid  49 and name he* )  3.5  3.5  0.5
assign (resid 170 and name hm* ) (resid  49 and name hz  )  3.5  3.5  0.5
assign (resid 170 and name hm* ) (resid  97 and name ha  )  5.5  5.5  0.0
assign (resid 170 and name hm* ) (resid  97 and name hb* )  2.5  2.5  0.5
assign (resid 170 and name h7  ) (resid  19 and name hg  )  5.5  5.5  0.0
assign (resid 170 and name h7  ) (resid  19 and name hd* )  3.5  3.5  0.0
assign (resid 170 and name h7  ) (resid  27 and name hg  )  5.5  1.0  2.0
assign (resid 170 and name h7  ) (resid  27 and name hd2*)  2.5  2.5  1.0
assign (resid 170 and name h8  ) (resid   6 and name hb* )  5.5  5.5  0.0
assign (resid 170 and name h8  ) (resid  19 and name hd* )  3.5  3.5  0.0
assign (resid 170 and name h8  ) (resid  27 and name ha  )  4.5  4.5  0.0
assign (resid 170 and name h8  ) (resid  27 and name hg  )  5.5  1.5  0.5
assign (resid 170 and name h8  ) (resid  27 and name hd2*)  3.5  3.5  0.0
assign (resid 170 and name h9* ) (resid  19 and name hd* )  5.5  5.5  0.0
assign (resid 170 and name h9* ) (resid  45 and name hg2*)  5.5  5.5  0.0
assign (resid 170 and name h9* ) (resid  49 and name he* )  3.5  3.5  0.0
assign (resid 170 and name h1n ) (resid  19 and name hb* )  5.5  5.5  0.0
assign (resid 170 and name h1n ) (resid  19 and name hg  )  4.5  4.5  0.0
assign (resid 170 and name h1n ) (resid  19 and name hd* )  5.5  5.5  0.0
assign (resid 170 and name hp2 ) (resid  49 and name hd* )  4.5  4.5  0.0
assign (resid 170 and name hp2 ) (resid  49 and name he* )  3.5  3.5  0.0
assign (resid 170 and name hp6 ) (resid  19 and name hg  )  5.5  5.5  0.0
assign (resid 170 and name hp6 ) (resid  19 and name hd* )  3.5  3.5  1.0
assign (resid 170 and name hp6 ) (resid  19 and name hb* )  5.5  5.5  0.0
assign (resid 170 and name hp6 ) (resid  27 and name hd2*)  5.5  5.5  0.5
assign (resid 170 and name hw1*) (resid  27 and name hd2*)  4.5  4.5  0.0
assign (resid 170 and name hw1*) (resid  30 and name hd* )  3.5  3.5  0.0
assign (resid 170 and name hw1*) (resid  30 and name he* )  5.5  5.5  0.0
assign (resid 170 and name hw1*) (resid  49 and name he* )  4.5  4.5  0.0
assign (resid 170 and name hw1*) (resid  54 and name hd1*)  3.5  3.5  0.0
assign (resid 170 and name hw1*) (resid  54 and name hd2*)  5.5  5.5  0.0
assign (resid 170 and name hw2*) (resid  18 and name he1 )  5.5  5.5  1.0
assign (resid 170 and name hw2*) (resid  27 and name hd1*)  3.5  3.5  0.0
assign (resid 170 and name hw2*) (resid  27 and name hd2*)  5.5  5.5  0.0
assign (resid 170 and name hw2*) (resid  50 and name hg* )  5.5  5.5  1.0
assign (resid 170 and name hi* ) (resid  27 and name hb1 )  2.5  2.5  1.0
assign (resid 170 and name hi* ) (resid  27 and name hd1*)  2.5  2.5  1.0
assign (resid 170 and name hi* ) (resid  27 and name hd2*)  3.5  3.5  1.0
!Constraints for Asp-26 - TMQ interaction
assign (resid 170 and name h1 )   (resid  26 and name od1)  2.00  0.40  0.40
assign (resid 170 and name n1)    (resid  26 and name od1)  3.00  0.40  0.40
assign (resid 170 and name hn2*)  (resid  26 and name od2)  2.00  0.40  0.40
assign (resid 170 and name n24)   (resid  26 and name od2)  3.00  0.40  0.40
! ambiguous noes
assign ((resid   5 and name hh2 ) or (resid 133 and name hh2 ))  (resid 128 and name he* )  5.5  5.5  0.0
assign ((resid   5 and name hh2 ) or (resid 133 and name hh2 ))  (resid 131 and name hd1*)  2.5  2.5  0.5
assign ((resid  13 and name hg1*) or (resid 129 and name hg2*))  (resid 103 and name hd* )  4.5  4.5  0.0
assign ((resid  24 and name hb* ) or (resid  27 and name hb2 ))  (resid  28 and name hd2 )  4.5  4.5  0.0
assign ((resid  40 and name hb  ) or (resid  60 and name hb  ))  (resid  40 and name ha  )  2.5  2.5  0.0
assign ((resid  40 and name hb  ) or (resid  79 and name hb  ))  (resid 106 and name hd* )  5.5  5.5  0.0
assign ((resid  40 and name hb  ) or (resid  79 and name hb  ))  (resid 106 and name he* )  4.5  4.5  0.0
assign ((resid  42 and name ha* ) or (resid  61 and name ha  ))  (resid  62 and name hn  )  2.5  2.5  0.0
assign ((resid  49 and name hz  ) or (resid  49 and name he* ))  (resid  39 and name he* )  2.5  2.5  0.0
assign ((resid  49 and name hz  ) or (resid  49 and name he* ))  (resid  41 and name hg1*)  2.5  2.5  0.5
assign ((resid  49 and name hz  ) or (resid  49 and name he* ))  (resid  41 and name hg2*)  2.5  2.5  0.5
assign ((resid  49 and name hz  ) or (resid  49 and name he* ))  (resid  54 and name hg  )  4.5  4.5  0.0
assign ((resid  54 and name hb* ) or (resid  54 and name  hg ))  (resid  49 and name hd* )  4.5  4.5  0.0
assign ((resid  60 and name hg1*) or (resid  74 and name hg2*))  (resid  85 and name hd* )  5.5  5.5  0.0
assign ((resid  60 and name hg1*) or (resid  74 and name hg2*))  (resid  85 and name he* )  3.5  3.5  0.0
assign ((resid  61 and name ha  ) or (resid  42 and name ha* ))  (resid  62 and name hn  )  2.5  2.5  0.0
assign ((resid  62 and name hd1*) or (resid 110 and name hg* ))  (resid 106 and name he* )  3.5  3.5  0.0
assign ((resid  62 and name hd1*) or (resid 110 and name hg* ))  (resid 106 and name hz  )  5.5  5.5  0.0
assign ((resid  79 and name hg1*) or (resid 102 and name hg2*))  (resid 106 and name hd* )  3.5  3.5  0.0
assign ((resid  79 and name hg1*) or (resid 102 and name hg2*))  (resid 106 and name he* )  2.5  2.5  0.0
assign ((resid  79 and name hg1*) or (resid 102 and name hg2*))  (resid 106 and name hz  )  3.5  3.5  0.0
assign ((resid  82 and name hg1*) or (resid  94 and name hd* ))  (resid 106 and name hd* )  5.5  5.5  0.0
assign ((resid  82 and name hg1*) or (resid  94 and name hd* ))  (resid 106 and name he* )  3.5  3.5  0.0
assign ((resid  82 and name hg1*) or (resid  94 and name hd* ))  (resid 106 and name hz  )  2.5  2.5  0.0
assign ((resid  83 and name hd* ) or (resid  83 and name he* ))  (resid  94 and name hd* )  2.5  2.5  0.0
assign ((resid  83 and name hd* ) or (resid  83 and name he* ))  (resid   1 and name hg2*)  5.5  5.5  0.0
assign ((resid 100 and name ha  ) or (resid 103 and name ha  ))  (resid 103 and name hd* )  2.5  2.5  0.0
assign ((resid 102 and name hd1*) or (resid 102 and name hg1*))  (resid  42 and name ha* )  3.5  3.5  0.0
assign ((resid 102 and name hg* ) or (resid  62 and name hd2*))  (resid 105 and name hb* )  3.5  3.5  0.0
assign ((resid 113 and name hg  ) or (resid 139 and name hg2*))  (resid 158 and name ha  )  3.5  3.5  0.0
assign ((resid 131 and name hd1*) or (resid 110 and name hg* ))  (resid   3 and name hd* )  4.5  4.5  0.0
assign ((resid 136 and name hd* ) or (resid 136 and name hz  ))  (resid 133 and name ha  )  2.5  2.5  0.0
assign ((resid 146 and name hb* ) or (resid 151 and name hb* ))  (resid 153 and name he1 )  5.5  5.5  0.0
! Hydrogen bond restraints
! Donors (nh) in protein are found from slow H->D exchange rate constants
assign (resid   3 and name hn )   (resid 112 and name o )   2.30  0.80  0.20
assign (resid   3 and name n )    (resid 112 and name o )   3.30  0.70  0.20
assign (resid   4 and name hn )   (resid  96 and name o )   2.30  0.80  0.20
assign (resid   4 and name n )    (resid  96 and name o )   3.30  0.70  0.20
assign (resid   5 and name hn )   (resid 114 and name o )   2.30  0.80  0.20
assign (resid   5 and name n )    (resid 114 and name o )   3.30  0.70  0.20
assign (resid   7 and name hn )   (resid 116 and name o )   2.30  0.80  0.20
assign (resid   7 and name n )    (resid 116 and name o )   3.30  0.70  0.20
assign (resid  38 and name hn )   (resid  93 and name o )   2.30  0.80  0.20
assign (resid  38 and name n )    (resid  93 and name o )   3.30  0.70  0.20
assign (resid  39 and name hn )   (resid  58 and name o )   2.30  0.80  0.20
assign (resid  39 and name n )    (resid  58 and name o )   3.30  0.70  0.20
assign (resid  40 and name hn )   (resid  95 and name o )   2.30  0.80  0.20
assign (resid  40 and name n )    (resid  95 and name o )   3.30  0.70  0.20
assign (resid  41 and name hn )   (resid  60 and name o )   2.30  0.80  0.20
assign (resid  41 and name n )    (resid  60 and name o )   3.30  0.70  0.20
assign (resid  42 and name hn )   (resid  98 and name o )   2.30  0.80  0.20
assign (resid  42 and name n )    (resid  98 and name o )   3.30  0.70  0.20
assign (resid  60 and name hn )   (resid  39 and name o )   2.30  0.80  0.20
assign (resid  60 and name n )    (resid  39 and name o )   3.30  0.70  0.20
assign (resid  61 and name hn )   (resid  74 and name o )   2.30  0.80  0.20
assign (resid  61 and name n )    (resid  74 and name o )   3.30  0.70  0.20
assign (resid  62 and name hn )   (resid  41 and name o )   2.30  0.80  0.20
assign (resid  62 and name n )    (resid  41 and name o )   3.30  0.70  0.20
assign (resid  63 and name hn )   (resid  76 and name o )   2.30  0.80  0.20
assign (resid  63 and name n )    (resid  76 and name o )   3.30  0.70  0.20
assign (resid  74 and name hn )   (resid  59 and name o )   2.30  0.80  0.20
assign (resid  74 and name n )    (resid  59 and name o )   3.30  0.70  0.20
assign (resid  76 and name hn )   (resid  61 and name o )   2.30  0.80  0.20
assign (resid  76 and name n )    (resid  61 and name o )   3.30  0.70  0.20
assign (resid  95 and name hn )   (resid  38 and name o )   2.30  0.80  0.20
assign (resid  95 and name n )    (resid  38 and name o )   3.30  0.70  0.20
assign (resid  96 and name hn )   (resid   2 and name o )   2.30  0.80  0.20
assign (resid  96 and name n )    (resid   2 and name o )   3.30  0.70  0.20
assign (resid  97 and name hn )   (resid  40 and name o )   2.30  0.80  0.20
assign (resid  97 and name n )    (resid  40 and name o )   3.30  0.70  0.20
assign (resid 112 and name hn )   (resid   1 and name o )   2.30  0.80  0.20
assign (resid 112 and name n )    (resid   1 and name o )   3.30  0.70  0.20
assign (resid 113 and name hn )   (resid 158 and name o )   2.30  0.80  0.20
assign (resid 113 and name n )    (resid 158 and name o )   3.30  0.70  0.20
assign (resid 114 and name hn )   (resid   3 and name o )   2.30  0.80  0.20
assign (resid 114 and name n )    (resid   3 and name o )   3.30  0.70  0.20
assign (resid 115 and name hn )   (resid 156 and name o )   2.30  0.80  0.20
assign (resid 115 and name n )    (resid 156 and name o )   3.30  0.70  0.20
assign (resid 116 and name hn )   (resid   5 and name o )   2.30  0.80  0.20
assign (resid 116 and name n )    (resid   5 and name o )   3.30  0.70  0.20
assign (resid 117 and name hn )   (resid 154 and name o )   2.30  0.80  0.20
assign (resid 117 and name n )    (resid 154 and name o )   3.30  0.70  0.20
assign (resid 119 and name hn )   (resid 152 and name o )   2.30  0.80  0.20
assign (resid 119 and name n )    (resid 152 and name o )   3.30  0.70  0.20
assign (resid 137 and name hn )   (resid 159 and name o )   2.30  0.80  0.20
assign (resid 137 and name n )    (resid 159 and name o )   3.30  0.70  0.20
assign (resid 139 and name hn )   (resid 157 and name o )   2.30  0.80  0.20
assign (resid 139 and name n )    (resid 157 and name o )   3.30  0.70  0.20
assign (resid 142 and name hn )   (resid 155 and name o )   2.30  0.80  0.20
assign (resid 142 and name n )    (resid 155 and name o )   3.30  0.70  0.20
assign (resid 144 and name hn )   (resid 153 and name o )   2.30  0.80  0.20
assign (resid 144 and name n )    (resid 153 and name o )   3.30  0.70  0.20
assign (resid 153 and name hn )   (resid 144 and name o )   2.30  0.80  0.20
assign (resid 153 and name n )    (resid 144 and name o )   3.30  0.70  0.20
assign (resid 154 and name hn )   (resid 117 and name o )   2.30  0.80  0.20
assign (resid 154 and name n )    (resid 117 and name o )   3.30  0.70  0.20
assign (resid 155 and name hn )   (resid 142 and name o )   2.30  0.80  0.20
assign (resid 155 and name n )    (resid 142 and name o )   3.30  0.70  0.20
assign (resid 156 and name hn )   (resid 115 and name o )   2.30  0.80  0.20
assign (resid 156 and name n )    (resid 115 and name o )   3.30  0.70  0.20
assign (resid 157 and name hn )   (resid 140 and name o )   2.30  0.80  0.20
assign (resid 157 and name n )    (resid 140 and name o )   3.30  0.70  0.20
assign (resid 158 and name hn )   (resid 113 and name o )   2.30  0.80  0.20
assign (resid 158 and name n )    (resid 113 and name o )   3.30  0.70  0.20
assign (resid 159 and name hn )   (resid 137 and name o )   2.30  0.80  0.20
assign (resid 159 and name n )    (resid 137 and name o )   3.30  0.70  0.20
assign (resid  27 and name hn )   (resid  23 and name o )   2.30  0.80  0.20
assign (resid  27 and name n  )   (resid  23 and name o )   3.30  0.70  0.20
assign (resid  29 and name hn )   (resid  25 and name o )   2.30  0.80  0.20
assign (resid  29 and name n  )   (resid  25 and name o )   3.30  0.70  0.20
assign (resid  33 and name hn )   (resid  29 and name o )   2.30  0.80  0.20
assign (resid  33 and name n  )   (resid  29 and name o )   3.30  0.70  0.20
assign (resid  46 and name hn )   (resid  42 and name o )   2.30  0.80  0.20
assign (resid  46 and name n  )   (resid  42 and name o )   3.30  0.70  0.20
assign (resid  47 and name hn )   (resid  43 and name o )   2.30  0.80  0.20
assign (resid  47 and name n  )   (resid  43 and name o )   3.30  0.70  0.20
assign (resid  82 and name hn )   (resid  78 and name o )   2.30  0.80  0.20
assign (resid  82 and name n  )   (resid  78 and name o )   3.30  0.70  0.20
assign (resid  83 and name hn )   (resid  79 and name o )   2.30  0.80  0.20
assign (resid  83 and name n  )   (resid  79 and name o )   3.30  0.70  0.20
assign (resid  84 and name hn )   (resid  80 and name o )   2.30  0.80  0.20
assign (resid  84 and name n  )   (resid  80 and name o )   3.30  0.70  0.20
assign (resid  85 and name hn )   (resid  81 and name o )   2.30  0.80  0.20
assign (resid  85 and name n  )   (resid  81 and name o )   3.30  0.70  0.20
assign (resid  86 and name hn )   (resid  82 and name o )   2.30  0.80  0.20
assign (resid  86 and name n  )   (resid  82 and name o )   3.30  0.70  0.20
assign (resid  87 and name hn )   (resid  83 and name o )   2.30  0.80  0.20
assign (resid  87 and name n  )   (resid  83 and name o )   3.30  0.70  0.20
assign (resid 102 and name hn )   (resid  99 and name o )   2.30  0.80  0.20
assign (resid 102 and name n  )   (resid  99 and name o )   3.30  0.70  0.20
assign (resid 104 and name hn )   (resid 100 and name o )   2.30  0.80  0.20
assign (resid 104 and name n  )   (resid 100 and name o )   3.30  0.70  0.20
assign (resid 105 and name hn )   (resid 101 and name o )   2.30  0.80  0.20
assign (resid 105 and name n  )   (resid 101 and name o )   3.30  0.70  0.20
assign (resid 106 and name hn )   (resid 102 and name o )   2.30  0.80  0.20
assign (resid 106 and name n  )   (resid 102 and name o )   3.30  0.70  0.20
assign (resid 107 and name hn )   (resid 103 and name o )   2.30  0.80  0.20
assign (resid 107 and name n  )   (resid 103 and name o )   3.30  0.70  0.20
assign (resid   8 and name hn )   (resid  12 and name o )   2.30  0.80  0.50
assign (resid   8 and name n )    (resid  12 and name o )   3.30  0.70  0.50
assign (resid   9 and name hn )   (resid 118 and name o )   2.30  0.80  0.50
assign (resid   9 and name n )    (resid 118 and name o )   3.30  0.70  0.50
assign (resid  12 and name hn )   (resid   8 and name o )   2.30  0.80  0.50
assign (resid  12 and name n )    (resid   8 and name o )   3.30  0.70  0.50
assign (resid  13 and name hn )   (resid 126 and name o )   2.30  0.80  0.50
assign (resid  13 and name n )    (resid 126 and name o )   3.30  0.70  0.50
assign (resid  37 and name hn )   (resid  34 and name o )   2.30  0.80  0.50
assign (resid  37 and name n )    (resid  34 and name o )   3.30  0.70  0.50
assign (resid  92 and name hn )   (resid  89 and name o )   2.30  0.80  0.50
assign (resid  92 and name n )    (resid  89 and name o )   3.30  0.70  0.50
assign (resid 109 and name hn )   (resid 106 and name o )   2.30  0.80  0.50
assign (resid 109 and name n  )   (resid 106 and name o )   3.30  0.70  0.50
assign (resid 110 and name hn )   (resid 107 and name o )   2.30  0.80  0.50
assign (resid 110 and name n  )   (resid 107 and name o )   3.30  0.70  0.50
assign (resid 120 and name hn )   (resid 150 and name o )   2.30  0.80  0.50
assign (resid 120 and name n  )   (resid 150 and name o )   3.30  0.70  0.50
assign (resid 128 and name hn )   (resid  11 and name o )   2.30  0.80  0.50
assign (resid 128 and name n  )   (resid  11 and name o )   3.30  0.70  0.50
assign (resid 133 and name hn )   (resid 131 and name o )   2.30  0.80  0.50
assign (resid 133 and name n  )   (resid 131 and name o )   3.30  0.70  0.50
assign (resid 135 and name hn )   (resid 132 and name o )   2.30  0.80  0.50
assign (resid 135 and name n  )   (resid 132 and name o )   3.30  0.70  0.50
assign (resid 151 and name hn )   (resid 148 and name o )   2.30  0.80  0.50
assign (resid 151 and name n  )   (resid 148 and name o )   3.30  0.70  0.50
assign (resid 152 and name hn )   (resid 149 and name o )   2.30  0.80  0.50
assign (resid 152 and name n  )   (resid 149 and name o )   3.30  0.70  0.50
assign (resid  34 and name hg1)   (resid  30 and name o )   2.30  0.80  0.20
assign (resid  34 and name og1)   (resid  30 and name o )   3.30  0.70  0.20
! Dihedral angle restraints
! Phi restraints 
assign (resid   1 and name c) (resid   2 and name n)
       (resid   2 and name ca)(resid   2 and name c) 1.0 -120.0 40.0 2   
assign (resid   2 and name c) (resid   3 and name n)
       (resid   3 and name ca)(resid   3 and name c) 1.0 -100.0 40.0 2   
assign (resid   3 and name c) (resid   4 and name n)                     
       (resid   4 and name ca)(resid   4 and name c) 1.0 -140.0 40.0 2   
assign (resid   4 and name c) (resid   5 and name n)                     
       (resid   5 and name ca)(resid   5 and name c) 1.0 -140.0 30.0 2   
assign (resid   5 and name c) (resid   6 and name n)                     
       (resid   6 and name ca)(resid   6 and name c) 1.0 -120.0 40.0 2   
assign (resid   7 and name c) (resid   8 and name n)                     
       (resid   8 and name ca)(resid   8 and name c) 1.0 -120.0 50.0 2   
assign (resid   8 and name c) (resid   9 and name n)                    
       (resid   9 and name ca)(resid   9 and name c) 1.0 -60.0 50.0 2  
assign (resid   9 and name c) (resid  10 and name n)
       (resid  10 and name ca)(resid  10 and name c) 1.0 -111.0 50.0 2
assign (resid  11 and name c) (resid  12 and name n)
       (resid  12 and name ca)(resid  12 and name c) 1.0 -90.0 40.0 2
assign (resid  12 and name c) (resid  13 and name n)
       (resid  13 and name ca)(resid  13 and name c) 1.0 -120.0 30.0 2
assign (resid  14 and name c) (resid  15 and name n)
       (resid  15 and name ca)(resid  15 and name c) 1.0 -140.0 40.0 2
assign (resid  15 and name c) (resid  16 and name n)
       (resid  16 and name ca)(resid  16 and name c) 1.0  60.0 30.0 2
assign (resid  17 and name c) (resid  18 and name n)
       (resid  18 and name ca)(resid  18 and name c) 1.0 -87.0 50.0 2
assign (resid  22 and name c) (resid  23 and name n)
       (resid  23 and name ca)(resid  23 and name c) 1.0 -120.0 40.0 2
assign (resid  24 and name c) (resid  25 and name n)
       (resid  25 and name ca)(resid  25 and name c) 1.0 -60.0 30.0 2    
assign (resid  25 and name c) (resid  26 and name n)                     
       (resid  26 and name ca)(resid  26 and name c) 1.0 -87.0 40.0 2    
assign (resid  26 and name c) (resid  27 and name n)                     
       (resid  27 and name ca)(resid  27 and name c) 1.0 -66.0 30.0 2    
assign (resid  27 and name c) (resid  28 and name n)                     
       (resid  28 and name ca)(resid  28 and name c) 1.0 -60.0 40.0 2    
assign (resid  28 and name c) (resid  29 and name n)                     
       (resid  29 and name ca)(resid  29 and name c) 1.0 -69.0 40.0 2    
assign (resid  29 and name c) (resid  30 and name n)                     
       (resid  30 and name ca)(resid  30 and name c) 1.0 -69.0 30.0 2    
assign (resid  30 and name c) (resid  31 and name n)                     
       (resid  31 and name ca)(resid  31 and name c) 1.0 -60.0 30.0 2    
assign (resid  31 and name c) (resid  32 and name n)                     
       (resid  32 and name ca)(resid  32 and name c) 1.0 -60.0 40.0 2    
assign (resid  32 and name c) (resid  33 and name n)                     
       (resid  33 and name ca)(resid  33 and name c) 1.0 -87.0 40.0 2    
assign (resid  33 and name c) (resid  34 and name n)
       (resid  34 and name ca)(resid  34 and name c) 1.0 -120.0 40.0 2
assign (resid  34 and name c) (resid  35 and name n)
       (resid  35 and name ca)(resid  35 and name c) 1.0 -60.0 30.0 2
assign (resid  36 and name c) (resid  37 and name n)
       (resid  37 and name ca)(resid  37 and name c) 1.0 -140.0 30.0 2
assign (resid  37 and name c) (resid  38 and name n)
       (resid  38 and name ca)(resid  38 and name c) 1.0 -110.0 40.0 2
assign (resid  38 and name c) (resid  39 and name n)
       (resid  39 and name ca)(resid  39 and name c) 1.0  -93.0 50.0 2
assign (resid  39 and name c) (resid  40 and name n)
       (resid  40 and name ca)(resid  40 and name c) 1.0 -123.0 30.0 2
assign (resid  40 and name c) (resid  41 and name n)
       (resid  41 and name ca)(resid  41 and name c) 1.0 -120.0 40.0 2
assign (resid  42 and name c) (resid  43 and name n)                     
       (resid  43 and name ca)(resid  43 and name c) 1.0 -69.0 30.0 2    
assign (resid  43 and name c) (resid  44 and name n)                     
       (resid  44 and name ca)(resid  44 and name c) 1.0 -69.0 30.0 2    
assign (resid  44 and name c) (resid  45 and name n)                     
       (resid  45 and name ca)(resid  45 and name c) 1.0 -69.0 30.0 2    
assign (resid  46 and name c) (resid  47 and name n)                     
       (resid  47 and name ca)(resid  47 and name c) 1.0 -75.0 30.0 2    
assign (resid  47 and name c) (resid  48 and name n)                     
       (resid  48 and name ca)(resid  48 and name c) 1.0 -69.0 30.0 2    
assign (resid  48 and name c) (resid  49 and name n)                     
       (resid  49 and name ca)(resid  49 and name c) 1.0 -69.0 30.0 2    
assign (resid  50 and name c) (resid  51 and name n)
       (resid  51 and name ca)(resid  51 and name c) 1.0 -120.0 40.0 2
assign (resid  51 and name c) (resid  52 and name n)
       (resid  52 and name ca)(resid  52 and name c) 1.0 -110.0 40.0 2
assign (resid  53 and name c) (resid  54 and name n)
       (resid  54 and name ca)(resid  54 and name c) 1.0 -75.0 40.0 2
assign (resid  55 and name c) (resid  56 and name n)
       (resid  56 and name ca)(resid  56 and name c) 1.0  60.0 40.0 2
assign (resid  56 and name c) (resid  57 and name n)
       (resid  57 and name ca)(resid  57 and name c) 1.0 -141.0 50.0 2
assign (resid  57 and name c) (resid  58 and name n)
       (resid  58 and name ca)(resid  58 and name c) 1.0 -108.0 40.0 2
assign (resid  59 and name c) (resid  60 and name n)
       (resid  60 and name ca)(resid  60 and name c) 1.0 -120.0 30.0 2
assign (resid  60 and name c) (resid  61 and name n)
       (resid  61 and name ca)(resid  61 and name c) 1.0 -100.0 40.0 2
assign (resid  61 and name c) (resid  62 and name n)
       (resid  62 and name ca)(resid  62 and name c) 1.0 -120.0 50.0 2
assign (resid  62 and name c) (resid  63 and name n)
       (resid  63 and name ca)(resid  63 and name c) 1.0 -120.0 50.0 2
assign (resid  64 and name c) (resid  65 and name n)
       (resid  65 and name ca)(resid  65 and name c) 1.0 -120.0 50.0 2
assign (resid  66 and name c) (resid  67 and name n)
       (resid  67 and name ca)(resid  67 and name c) 1.0 -110.0 40.0 2
assign (resid  67 and name c) (resid  68 and name n)
       (resid  68 and name ca)(resid  68 and name c) 1.0 -90.0 40.0 2
assign (resid  68 and name c) (resid  69 and name n)
       (resid  69 and name ca)(resid  69 and name c) 1.0 -120.0 40.0 2
assign (resid  69 and name c) (resid  70 and name n)
       (resid  70 and name ca)(resid  70 and name c) 1.0 -110.0 30.0 2
assign (resid  70 and name c) (resid  71 and name n)
       (resid  71 and name ca)(resid  71 and name c) 1.0  -69.0 40.0 2
assign (resid  72 and name c) (resid  73 and name n)
       (resid  73 and name ca)(resid  73 and name c) 1.0 -120.0 40.0 2
assign (resid  73 and name c) (resid  74 and name n)
       (resid  74 and name ca)(resid  74 and name c) 1.0 -110.0 50.0 2
assign (resid  74 and name c) (resid  75 and name n)
       (resid  75 and name ca)(resid  75 and name c) 1.0 -110.0 50.0 2
assign (resid  75 and name c) (resid  76 and name n)
       (resid  76 and name ca)(resid  76 and name c) 1.0 -120.0 40.0 2
assign (resid  76 and name c) (resid  77 and name n)
       (resid  77 and name ca)(resid  77 and name c) 1.0 -120.0 40.0 2
assign (resid  77 and name c) (resid  78 and name n)                   
       (resid  78 and name ca)(resid  78 and name c) 1.0 -140.0 40.0 2
assign (resid  78 and name c) (resid  79 and name n)                      
       (resid  79 and name ca)(resid  79 and name c) 1.0 -60.0 30.0 2    
assign (resid  79 and name c) (resid  80 and name n)                     
       (resid  80 and name ca)(resid  80 and name c) 1.0 -60.0 30.0 2    
assign (resid  80 and name c) (resid  81 and name n)                     
       (resid  81 and name ca)(resid  81 and name c) 1.0 -60.0 30.0 2    
assign (resid  81 and name c) (resid  82 and name n)                     
       (resid  82 and name ca)(resid  82 and name c) 1.0 -60.0 30.0 2    
assign (resid  82 and name c) (resid  83 and name n)                     
       (resid  83 and name ca)(resid  83 and name c) 1.0 -60.0 30.0 2    
assign (resid  83 and name c) (resid  84 and name n)                     
       (resid  84 and name ca)(resid  84 and name c) 1.0 -60.0 30.0 2    
assign (resid  84 and name c) (resid  85 and name n)                     
       (resid  85 and name ca)(resid  85 and name c) 1.0 -60.0 40.0 2    
assign (resid  85 and name c) (resid  86 and name n)                     
       (resid  86 and name ca)(resid  86 and name c) 1.0 -69.0 30.0 2    
assign (resid  86 and name c) (resid  87 and name n)                     
       (resid  87 and name ca)(resid  87 and name c) 1.0 -69.0 30.0 2    
assign (resid  88 and name c) (resid  89 and name n)                     
       (resid  89 and name ca)(resid  89 and name c) 1.0 -120.0 30.0 2
assign (resid  91 and name c) (resid  92 and name n)     
       (resid  92 and name ca)(resid  92 and name c) 1.0 -120.0 40.0 2
assign (resid  92 and name c) (resid  93 and name n)     
       (resid  93 and name ca)(resid  93 and name c) 1.0 -120.0 40.0 2
assign (resid  95 and name c) (resid  96 and name n)
       (resid  96 and name ca)(resid  96 and name c) 1.0 -120.0 50.0 2
assign (resid  96 and name c) (resid  97 and name n)
       (resid  97 and name ca)(resid  97 and name c) 1.0 -100.0 50.0 2
assign (resid  99 and name c) (resid 100 and name n)                     
       (resid 100 and name ca)(resid 100 and name c) 1.0 -60.0 40.0 2    
assign (resid 100 and name c) (resid 101 and name n)                     
       (resid 101 and name ca)(resid 101 and name c) 1.0 -69.0 30.0 2    
assign (resid 101 and name c) (resid 102 and name n)                     
       (resid 102 and name ca)(resid 102 and name c) 1.0 -78.0 30.0 2    
assign (resid 102 and name c) (resid 103 and name n)                     
       (resid 103 and name ca)(resid 103 and name c) 1.0 -51.0 30.0 2    
assign (resid 104 and name c) (resid 105 and name n)                     
       (resid 105 and name ca)(resid 105 and name c) 1.0 -63.0 30.0 2    
assign (resid 105 and name c) (resid 106 and name n)                  
       (resid 106 and name ca)(resid 106 and name c) 1.0 -120.0 40.0 2  
assign (resid 106 and name c) (resid 107 and name n)                   
       (resid 107 and name ca)(resid 107 and name c) 1.0  -78.0 40.0 2
assign (resid 107 and name c) (resid 108 and name n)       
       (resid 108 and name ca)(resid 108 and name c) 1.0 -93.0 30.0 2
assign (resid 108 and name c) (resid 109 and name n)
       (resid 109 and name ca)(resid 109 and name c) 1.0 -120.0 40.0 2
assign (resid 109 and name c) (resid 110 and name n)
       (resid 110 and name ca)(resid 110 and name c) 1.0 -111.0 40.0 2
assign (resid 110 and name c) (resid 111 and name n)
       (resid 111 and name ca)(resid 111 and name c) 1.0 -120.0 30.0 2
assign (resid 111 and name c) (resid 112 and name n)
       (resid 112 and name ca)(resid 112 and name c) 1.0 -120.0 40.0 2
assign (resid 112 and name c) (resid 113 and name n)
       (resid 113 and name ca)(resid 113 and name c) 1.0 -120.0 30.0 2
assign (resid 113 and name c) (resid 114 and name n)
       (resid 114 and name ca)(resid 114 and name c) 1.0 -120.0 50.0 2
assign (resid 115 and name c) (resid 116 and name n)
       (resid 116 and name ca)(resid 116 and name c) 1.0 -120.0 30.0 2
assign (resid 116 and name c) (resid 117 and name n)
       (resid 117 and name ca)(resid 117 and name c) 1.0 -120.0 40.0 2
assign (resid 117 and name c) (resid 118 and name n)
       (resid 118 and name ca)(resid 118 and name c) 1.0 -93.0 40.0 2
assign (resid 120 and name c) (resid 121 and name n)
       (resid 121 and name ca)(resid 121 and name c) 1.0 -100.0 40.0 2
assign (resid 121 and name c) (resid 122 and name n)
       (resid 122 and name ca)(resid 122 and name c) 1.0 -120.0 30.0 2
assign (resid 124 and name c) (resid 125 and name n)
       (resid 125 and name ca)(resid 125 and name c) 1.0 -120.0 30 2 
assign (resid 125 and name c) (resid 126 and name n)
       (resid 126 and name ca)(resid 126 and name c) 1.0 -110.0 50.0 2
assign (resid 126 and name c) (resid 127 and name n)
       (resid 127 and name ca)(resid 127 and name c) 1.0 -120.0 30.0 2 
assign (resid 127 and name c) (resid 128 and name n)
       (resid 128 and name ca)(resid 128 and name c) 1.0 -90.0 40.0 2 
assign (resid 128 and name c) (resid 129 and name n)
       (resid 129 and name ca)(resid 129 and name c) 1.0 -60.0 40.0 2 
assign (resid 130 and name c) (resid 131 and name n)
       (resid 131 and name ca)(resid 131 and name c) 1.0 -100.0 40.0 2
assign (resid 131 and name c) (resid 132 and name n)
       (resid 132 and name ca)(resid 132 and name c) 1.0 -100.0 40.0 2
assign (resid 132 and name c) (resid 133 and name n)
       (resid 133 and name ca)(resid 133 and name c) 1.0 -60.0 30.0 2
assign (resid 133 and name c) (resid 134 and name n)
       (resid 134 and name ca)(resid 134 and name c) 1.0 -75.0 30.0 2
assign (resid 135 and name c) (resid 136 and name n)
       (resid 136 and name ca)(resid 136 and name c) 1.0 -120.0 50.0 2
assign (resid 136 and name c) (resid 137 and name n)
       (resid 137 and name ca)(resid 137 and name c) 1.0 -120.0 40.0 2
assign (resid 137 and name c) (resid 138 and name n)
       (resid 138 and name ca)(resid 138 and name c) 1.0 -90.0 40.0 2
assign (resid 138 and name c) (resid 139 and name n)
       (resid 139 and name ca)(resid 139 and name c) 1.0 -120.0 30.0 2
assign (resid 140 and name c) (resid 141 and name n)
       (resid 141 and name ca)(resid 141 and name c) 1.0 -140.0 30.0 2
assign (resid 141 and name c) (resid 142 and name n)
       (resid 142 and name ca)(resid 142 and name c) 1.0 -120.0 40.0 2
assign (resid 142 and name c) (resid 143 and name n)
       (resid 143 and name ca)(resid 143 and name c) 1.0 -90.0 50.0 2
assign (resid 143 and name c) (resid 144 and name n)
       (resid 144 and name ca)(resid 144 and name c) 1.0 -140.0 30.0 2
assign (resid 144 and name c) (resid 145 and name n)
       (resid 145 and name ca)(resid 145 and name c) 1.0 -120.0 30.0 2
assign (resid 145 and name c) (resid 146 and name n)
       (resid 146 and name ca)(resid 146 and name c) 1.0 -120.0 40.0 2
assign (resid 146 and name c) (resid 147 and name n)
       (resid 147 and name ca)(resid 147 and name c) 1.0 -78.0 40.0 2
assign (resid 147 and name c) (resid 148 and name n)
       (resid 148 and name ca)(resid 148 and name c) 1.0 -90.0 50.0 2
assign (resid 149 and name c) (resid 150 and name n)
       (resid 150 and name ca)(resid 150 and name c) 1.0 -69.0 30.0 2
assign (resid 150 and name c) (resid 151 and name n)
       (resid 151 and name ca)(resid 151 and name c) 1.0 -110.0 40.0 2
assign (resid 151 and name c) (resid 152 and name n)
       (resid 152 and name ca)(resid 152 and name c) 1.0 -63.0 30.0 2
assign (resid 152 and name c) (resid 153 and name n)
       (resid 153 and name ca)(resid 153 and name c) 1.0 -120.0 60.0 2
assign (resid 153 and name c) (resid 154 and name n)
       (resid 154 and name ca)(resid 154 and name c) 1.0 -120.0 30.0 2
assign (resid 154 and name c) (resid 155 and name n)
       (resid 155 and name ca)(resid 155 and name c) 1.0 -110.0 40.0 2
assign (resid 155 and name c) (resid 156 and name n)
       (resid 156 and name ca)(resid 156 and name c) 1.0 -110.0 40.0 2
assign (resid 157 and name c) (resid 158 and name n)
       (resid 158 and name ca)(resid 158 and name c) 1.0 -120.0 30.0 2
assign (resid 158 and name c) (resid 159 and name n)
       (resid 159 and name ca)(resid 159 and name c) 1.0 -120.0 30.0 2
assign (resid 159 and name c) (resid 160 and name n)
       (resid 160 and name ca)(resid 160 and name c) 1.0 -69.0 30.0 2
assign (resid 160 and name c) (resid 161 and name n)
       (resid 161 and name ca)(resid 161 and name c) 1.0 -120.0 60.0 2
assign (resid 161 and name c) (resid 162 and name n)
       (resid 162 and name ca)(resid 162 and name c) 1.0 -120.0 60.0 2
! Psi restraints 
assign (resid   2 and name n) (resid   2 and name ca) 
       (resid   2 and name c) (resid   3 and name n) 1.0 135.0 40.0 2 
assign (resid   3 and name n) (resid   3 and name ca)
       (resid   3 and name c) (resid   4 and name n) 1.0 120.0 50.0 2
assign (resid   4 and name n) (resid   4 and name ca)
       (resid   4 and name c) (resid   5 and name n) 1.0 120.0 40.0 2
assign (resid   5 and name n) (resid   5 and name ca)
       (resid   5 and name c) (resid   6 and name n) 1.0 140.0 40.0 2
assign (resid   6 and name n) (resid   6 and name ca)
       (resid   6 and name c) (resid   7 and name n) 1.0 120.0 40.0 2
assign (resid   7 and name n) (resid   7 and name ca)
       (resid   7 and name c) (resid   8 and name n) 1.0 140.0 40.0 2
assign (resid   8 and name n) (resid   8 and name ca)
       (resid   8 and name c) (resid   9 and name n) 1.0 140.0 60.0 3 
assign (resid   9 and name n) (resid   9 and name ca)
       (resid   9 and name c) (resid  10 and name n) 1.0 -30.0 50.0 3 
assign (resid  10 and name n) (resid  10 and name ca)
       (resid  10 and name c) (resid  11 and name n) 1.0 -18.0 50.0 2
assign (resid  12 and name n) (resid  12 and name ca)
       (resid  12 and name c) (resid  13 and name n) 1.0 135.0 50.0 2
assign (resid  13 and name n) (resid  13 and name ca)
       (resid  13 and name c) (resid  14 and name n) 1.0 -18.0 50.0 2
assign (resid  15 and name n) (resid  15 and name ca)
       (resid  15 and name c) (resid  16 and name n) 1.0 123.0 50.0 2
assign (resid  18 and name n) (resid  18 and name ca)
       (resid  18 and name c) (resid  19 and name n) 1.0 144.0 50.0 2
assign (resid  21 and name n) (resid  21 and name ca)
       (resid  21 and name c) (resid  22 and name n) 1.0 160.0 40.0 2
assign (resid  22 and name n) (resid  22 and name ca)
       (resid  22 and name c) (resid  23 and name n) 1.0 120.0 40.0 2
assign (resid  25 and name n) (resid  25 and name ca)
       (resid  25 and name c) (resid  26 and name n) 1.0 -60.0 40.0 2
assign (resid  26 and name n) (resid  26 and name ca)
       (resid  26 and name c) (resid  27 and name n) 1.0 -30.0 40.0 2
assign (resid  27 and name n) (resid  27 and name ca)
       (resid  27 and name c) (resid  28 and name n) 1.0 -50.0 40.0 2
assign (resid  28 and name n) (resid  28 and name ca)
       (resid  28 and name c) (resid  29 and name n) 1.0 -39.0 40.0 2 
assign (resid  29 and name n) (resid  29 and name ca)
       (resid  29 and name c) (resid  30 and name n) 1.0 -39.0 40.0 2
assign (resid  30 and name n) (resid  30 and name ca)
       (resid  30 and name c) (resid  31 and name n) 1.0 -60.0 40.0 2
assign (resid  31 and name n) (resid  31 and name ca)
       (resid  31 and name c) (resid  32 and name n) 1.0 -30.0 40.0 2
assign (resid  32 and name n) (resid  32 and name ca)
       (resid  32 and name c) (resid  33 and name n) 1.0 -39.0 40.0 2
assign (resid  33 and name n) (resid  33 and name ca)
       (resid  33 and name c) (resid  34 and name n) 1.0  25.0 50.0 2
assign (resid  34 and name n) (resid  34 and name ca)
       (resid  34 and name c) (resid  35 and name n) 1.0 3.0 40.0 2
assign (resid  35 and name n) (resid  35 and name ca)
       (resid  35 and name c) (resid  36 and name n) 1.0 140.0 40.0 2
assign (resid  38 and name n) (resid  38 and name ca)
       (resid  38 and name c) (resid  39 and name n) 1.0 117.0 40.0 2
assign (resid  39 and name n) (resid  39 and name ca)
       (resid  39 and name c) (resid  40 and name n) 1.0 120.0 50.0 2
assign (resid  40 and name n) (resid  40 and name ca)
       (resid  40 and name c) (resid  41 and name n) 1.0 120.0 40.0 2
assign (resid  41 and name n) (resid  41 and name ca)
       (resid  41 and name c) (resid  42 and name n) 1.0 155.0 40.0 2
assign (resid  43 and name n) (resid  43 and name ca)
       (resid  43 and name c) (resid  44 and name n) 1.0 -39.0 40.0 2
assign (resid  44 and name n) (resid  44 and name ca)
       (resid  44 and name c) (resid  45 and name n) 1.0 -60.0 30.0 2 
assign (resid  45 and name n) (resid  45 and name ca)
       (resid  45 and name c) (resid  46 and name n) 1.0 -50.0 40.0 2
assign (resid  46 and name n) (resid  46 and name ca)
       (resid  46 and name c) (resid  47 and name n) 1.0 -60.0 40.0 2
assign (resid  47 and name n) (resid  47 and name ca)
       (resid  47 and name c) (resid  48 and name n) 1.0 -30.0 40.0 2 
assign (resid  48 and name n) (resid  48 and name ca)
       (resid  48 and name c) (resid  49 and name n) 1.0 -30.0 40.0 2
assign (resid  51 and name n) (resid  51 and name ca)
       (resid  51 and name c) (resid  52 and name n) 1.0 120.0 50.0 2
assign (resid  52 and name n) (resid  52 and name ca)
       (resid  52 and name c) (resid  53 and name n) 1.0 140.0 40.0 2
assign (resid  56 and name n) (resid  56 and name ca)
       (resid  56 and name c) (resid  57 and name n) 1.0 51.0 40.0 2
assign (resid  57 and name n) (resid  57 and name ca)
       (resid  57 and name c) (resid  58 and name n) 1.0 151.0 40.0 2
assign (resid  58 and name n) (resid  58 and name ca)
       (resid  58 and name c) (resid  59 and name n) 1.0 120.0 40.0 2
assign (resid  59 and name n) (resid  59 and name ca)
       (resid  59 and name c) (resid  60 and name n) 1.0 120.0 40.0 2
assign (resid  60 and name n) (resid  60 and name ca)
       (resid  60 and name c) (resid  61 and name n) 1.0 120.0 40.0 2
assign (resid  61 and name n) (resid  61 and name ca)
       (resid  61 and name c) (resid  62 and name n) 1.0 140.0 40.0 2
assign (resid  62 and name n) (resid  62 and name ca)
       (resid  62 and name c) (resid  63 and name n) 1.0 120.0 40.0 2
assign (resid  65 and name n) (resid  65 and name ca)
       (resid  65 and name c) (resid  66 and name n) 1.0 141.0 40.0 2
assign (resid  66 and name n) (resid  66 and name ca)
       (resid  66 and name c) (resid  67 and name n) 1.0  48.0 40.0 2
assign (resid  67 and name n) (resid  67 and name ca)
       (resid  67 and name c) (resid  68 and name n) 1.0  10.0 60.0 2
assign (resid  69 and name n) (resid  69 and name ca)
       (resid  69 and name c) (resid  70 and name n) 1.0 120.0 50.0 2
assign (resid  70 and name n) (resid  70 and name ca)
       (resid  70 and name c) (resid  71 and name n) 1.0 120.0 50.0 2
assign (resid  71 and name n) (resid  71 and name ca)
       (resid  71 and name c) (resid  72 and name n) 1.0 120.0 40.0 2
assign (resid  73 and name n) (resid  73 and name ca)
       (resid  73 and name c) (resid  74 and name n) 1.0 135.0 40.0 2
assign (resid  74 and name n) (resid  74 and name ca)
       (resid  74 and name c) (resid  75 and name n) 1.0 123.0 40.0 2
assign (resid  75 and name n) (resid  75 and name ca)
       (resid  75 and name c) (resid  76 and name n) 1.0 111.0 40.0 2
assign (resid  76 and name n) (resid  76 and name ca)
       (resid  76 and name c) (resid  77 and name n) 1.0 147.0 40.0 2
assign (resid  77 and name n) (resid  77 and name ca)
       (resid  77 and name c) (resid  78 and name n) 1.0 30.0 30.0 2
assign (resid  80 and name n) (resid  80 and name ca)
       (resid  80 and name c) (resid  81 and name n) 1.0 -45.0 30.0 2
assign (resid  81 and name n) (resid  81 and name ca)
       (resid  81 and name c) (resid  82 and name n) 1.0 -45.0 30.0 2
assign (resid  82 and name n) (resid  82 and name ca)
       (resid  82 and name c) (resid  83 and name n) 1.0 -51.0 30.0 2
assign (resid  83 and name n) (resid  83 and name ca)
       (resid  83 and name c) (resid  84 and name n) 1.0 -51.0 30.0 2 
assign (resid  84 and name n) (resid  84 and name ca)
       (resid  84 and name c) (resid  85 and name n) 1.0 -45.0 30.0 2
assign (resid  86 and name n) (resid  86 and name ca)
       (resid  86 and name c) (resid  87 and name n) 1.0 -45.0 30.0 2
assign (resid  87 and name n) (resid  87 and name ca)
       (resid  87 and name c) (resid  88 and name n) 1.0 -51.0 40.0 2
assign (resid  88 and name n) (resid  88 and name ca)
       (resid  88 and name c) (resid  89 and name n) 1.0  -15.0 50.0 2
assign (resid  91 and name n) (resid  91 and name ca)
       (resid  91 and name c) (resid  92 and name n) 1.0 -24.0 40.0 2
assign (resid  92 and name n) (resid  92 and name ca)
       (resid  92 and name c) (resid  93 and name n) 1.0 140.0 40.0 2
assign (resid  93 and name n) (resid  93 and name ca)
       (resid  93 and name c) (resid  94 and name n) 1.0 162.0 40.0 2
assign (resid  94 and name n) (resid  94 and name ca)
       (resid  94 and name c) (resid  95 and name n) 1.0 120.0 40.0 2
assign (resid  95 and name n) (resid  95 and name ca)
       (resid  95 and name c) (resid  96 and name n) 1.0 120.0 40.0 2
assign (resid  96 and name n) (resid  96 and name ca)
       (resid  96 and name c) (resid  97 and name n) 1.0 120.0 50.0 2
assign (resid  97 and name n) (resid  97 and name ca)
       (resid  97 and name c) (resid  98 and name n) 1.0 -36.0 40.0 2
assign (resid 100 and name n) (resid 100 and name ca)
       (resid 100 and name c) (resid 101 and name n) 1.0 -36.0 40.0 2
assign (resid 101 and name n) (resid 101 and name ca)
       (resid 101 and name c) (resid 102 and name n) 1.0 -36.0 30.0 2
assign (resid 102 and name n) (resid 102 and name ca)
       (resid 102 and name c) (resid 103 and name n) 1.0 -54.0 30.0 2
assign (resid 103 and name n) (resid 103 and name ca)
       (resid 103 and name c) (resid 104 and name n) 1.0 -60.0 40.0 2
assign (resid 104 and name n) (resid 104 and name ca)
       (resid 104 and name c) (resid 105 and name n) 1.0 -39.0 30.0 2
assign (resid 105 and name n) (resid 105 and name ca)
       (resid 105 and name c) (resid 106 and name n) 1.0 -45.0 30.0 2
assign (resid 106 and name n) (resid 106 and name ca)
       (resid 106 and name c) (resid 107 and name n) 1.0  12.0 40.0 2
assign (resid 107 and name n) (resid 107 and name ca)
       (resid 107 and name c) (resid 108 and name n) 1.0 -30.0 50.0 2
assign (resid 109 and name n) (resid 109 and name ca)
       (resid 109 and name c) (resid 110 and name n) 1.0 33.0 50.0 2
assign (resid 110 and name n) (resid 110 and name ca)
       (resid 110 and name c) (resid 111 and name n) 1.0 140.0 30.0 2
assign (resid 111 and name n) (resid 111 and name ca)
       (resid 111 and name c) (resid 112 and name n) 1.0 -30.0 50.0 2
assign (resid 112 and name n) (resid 112 and name ca)
       (resid 112 and name c) (resid 113 and name n) 1.0 147.0 40.0 2
assign (resid 113 and name n) (resid 113 and name ca)
       (resid 113 and name c) (resid 114 and name n) 1.0 120.0 50.0 2
assign (resid 114 and name n) (resid 114 and name ca)
       (resid 114 and name c) (resid 115 and name n) 1.0 120.0 60.0 2
assign (resid 115 and name n) (resid 115 and name ca)
       (resid 115 and name c) (resid 116 and name n) 1.0 140.0 50.0 2
assign (resid 116 and name n) (resid 116 and name ca)
       (resid 116 and name c) (resid 117 and name n) 1.0 120.0 40.0 2
assign (resid 117 and name n) (resid 117 and name ca)
       (resid 117 and name c) (resid 118 and name n) 1.0 135.0 40.0 2
assign (resid 118 and name n) (resid 118 and name ca)
       (resid 118 and name c) (resid 119 and name n) 1.0 144.0 50.0 2
assign (resid 122 and name n) (resid 122 and name ca)
       (resid 122 and name c) (resid 123 and name n) 1.0 120.0 40.0 2
assign (resid 123 and name n) (resid 123 and name ca)
       (resid 123 and name c) (resid 124 and name n) 1.0 140.0 40.0 2
assign (resid 125 and name n) (resid 125 and name ca)
       (resid 125 and name c) (resid 126 and name n) 1.0 -30.0 40.0 2
assign (resid 126 and name n) (resid 126 and name ca)
       (resid 126 and name c) (resid 127 and name n) 1.0 135.0 50.0 2
assign (resid 127 and name n) (resid 127 and name ca)
       (resid 127 and name c) (resid 128 and name n) 1.0 140.0 40.0 2
assign (resid 131 and name n) (resid 131 and name ca) 
       (resid 131 and name c) (resid 132 and name n) 1.0 153.0 30.0 2
assign (resid 132 and name n) (resid 132 and name ca)
       (resid 132 and name c) (resid 133 and name n) 1.0 112.0 50.0 2
assign (resid 133 and name n) (resid 133 and name ca)
       (resid 133 and name c) (resid 134 and name n) 1.0 -30.0 40.0 2
assign (resid 134 and name n) (resid 134 and name ca)
       (resid 134 and name c) (resid 135 and name n) 1.0 -30.0 40.0 2
assign (resid 136 and name n) (resid 136 and name ca)
       (resid 136 and name c) (resid 137 and name n) 1.0 140.0 40.0 2
assign (resid 137 and name n) (resid 137 and name ca)
       (resid 137 and name c) (resid 138 and name n) 1.0 140.0 40.0 2
assign (resid 138 and name n) (resid 138 and name ca)
       (resid 138 and name c) (resid 139 and name n) 1.0 120.0 40.0 2
assign (resid 139 and name n) (resid 139 and name ca)
       (resid 139 and name c) (resid 140 and name n) 1.0 -60.0 40.0 2
assign (resid 140 and name n) (resid 140 and name ca)
       (resid 140 and name c) (resid 141 and name n) 1.0 158.0 40.0 2
assign (resid 141 and name n) (resid 141 and name ca)
       (resid 141 and name c) (resid 142 and name n) 1.0 120.0 40.0 2
assign (resid 142 and name n) (resid 142 and name ca)
       (resid 142 and name c) (resid 143 and name n) 1.0 120.0 40.0 2
assign (resid 144 and name n) (resid 144 and name ca)
       (resid 144 and name c) (resid 145 and name n) 1.0 140.0 40.0 2
assign (resid 145 and name n) (resid 145 and name ca)
       (resid 145 and name c) (resid 146 and name n) 1.0 120.0 40.0 2
assign (resid 146 and name n) (resid 146 and name ca)
       (resid 146 and name c) (resid 147 and name n) 1.0 140.0 60.0 2
assign (resid 147 and name n) (resid 147 and name ca)
       (resid 147 and name c) (resid 148 and name n) 1.0 -45.0 30.0 2
assign (resid 148 and name n) (resid 148 and name ca)
       (resid 148 and name c) (resid 149 and name n) 1.0 140.0 40.0 2
assign (resid 150 and name n) (resid 150 and name ca)
       (resid 150 and name c) (resid 151 and name n) 1.0 -21.0 40.0 2
assign (resid 151 and name n) (resid 151 and name ca)
       (resid 151 and name c) (resid 152 and name n) 1.0   3.0 30.0 2
assign (resid 152 and name n) (resid 152 and name ca)
       (resid 152 and name c) (resid 153 and name n) 1.0 120.0 40.0 2
assign (resid 153 and name n) (resid 153 and name ca)
       (resid 153 and name c) (resid 154 and name n) 1.0 155.0 40.0 2
assign (resid 154 and name n) (resid 154 and name ca)
       (resid 154 and name c) (resid 155 and name n) 1.0 120.0 40.0 2 
assign (resid 155 and name n) (resid 155 and name ca)
       (resid 155 and name c) (resid 156 and name n) 1.0 120.0 50.0 2 
assign (resid 156 and name n) (resid 156 and name ca)
       (resid 156 and name c) (resid 157 and name n) 1.0 120.0 30.0 2 
assign (resid 158 and name n) (resid 158 and name ca)
       (resid 158 and name c) (resid 159 and name n) 1.0 140.0 40.0 2
assign (resid 159 and name n) (resid 159 and name ca)
       (resid 159 and name c) (resid 160 and name n) 1.0 140.0 40.0 2
assign (resid 160 and name n) (resid 160 and name ca)
       (resid 160 and name c) (resid 161 and name n) 1.0 120.0 30.0 2
assign (resid 161 and name n) (resid 161 and name ca)
       (resid 161 and name c) (resid 162 and name n) 1.0 140.0 50.0 2
! Chi-1 restraints 
assign (resid   3 and name n)  (resid   3 and name ca)
       (resid   3 and name cb) (resid   3 and name cg) 1.0 -93.0 30.0 2
assign (resid   4 and name n)  (resid   4 and name ca)
       (resid   4 and name cb) (resid   4 and name cg) 1.0 180.0 40.0 2
assign (resid   5 and name n)  (resid   5 and name ca)
       (resid   5 and name cb) (resid   5 and name cg) 1.0 75.0 30.0 2 
assign (resid   7 and name n)  (resid   7 and name ca)
       (resid   7 and name cb) (resid   7 and name cg) 1.0 60.0 30.0 2
assign (resid   8 and name n)  (resid   8 and name ca)
       (resid   8 and name cb) (resid   8 and name cg) 1.0 60.0 30.0 2 
assign (resid   9 and name n)  (resid   9 and name ca)
       (resid   9 and name cb) (resid   9 and name cg) 1.0 60.0 30.0 2 
assign (resid  10 and name n)  (resid  10 and name ca)
       (resid  10 and name cb) (resid  10 and name cg) 1.0 -75.0 30.0 2
assign (resid  12 and name n)  (resid  12 and name ca)
       (resid  12 and name cb) (resid  12 and name cg) 1.0 180.0 40.0 2
assign (resid  13 and name n)  (resid  13 and name ca)
       (resid  13 and name cb) (resid  13 and name cg1) 1.0 60.0 30.0 2
assign (resid  15 and name n)  (resid  15 and name ca)
       (resid  15 and name cb) (resid  15 and name cg) 1.0 180.0 30.0 2
assign (resid  16 and name n)  (resid  16 and name ca)
       (resid  16 and name cb) (resid  16 and name cg) 1.0 -75.0 40.0 2
assign (resid  18 and name n)  (resid  18 and name ca)
       (resid  18 and name cb) (resid  18 and name cg) 1.0 60.0 30.0 2
assign (resid  19 and name n)  (resid  19 and name ca)
       (resid  19 and name cb) (resid  19 and name cg) 1.0 -60.0 40.0 2
assign (resid  21 and name n)  (resid  21 and name ca)
       (resid  21 and name cb) (resid  21 and name cg) 1.0 60.0 30.0 2
assign (resid  22 and name n)  (resid  22 and name ca)
       (resid  22 and name cb) (resid  22 and name cg) 1.0 180.0 30.0 2
assign (resid  23 and name n)  (resid  23 and name ca)
       (resid  23 and name cb) (resid  23 and name cg) 1.0 180.0 40.0 2
assign (resid  25 and name n)  (resid  25 and name ca)
       (resid  25 and name cb) (resid  25 and name cg) 1.0 180.0 40.0 2
assign (resid  26 and name n)  (resid  26 and name ca)
       (resid  26 and name cb) (resid  26 and name cg) 1.0 180.0 30.0 2
assign (resid  27 and name n)  (resid  27 and name ca)
       (resid  27 and name cb) (resid  27 and name cg) 1.0 -75.0 30.0 2 
assign (resid  28 and name n)  (resid  28 and name ca)
       (resid  28 and name cb) (resid  28 and name cg) 1.0 -60.0 40.0 2
assign (resid  29 and name n)  (resid  29 and name ca)
       (resid  29 and name cb) (resid  29 and name cg) 1.0 180.0 30.0 2
assign (resid  30 and name n)  (resid  30 and name ca)
       (resid  30 and name cb) (resid  30 and name cg) 1.0 180.0 30.0 2
assign (resid  31 and name n)  (resid  31 and name ca)
       (resid  31 and name cb) (resid  31 and name cg) 1.0 180.0 40.0 2
assign (resid  33 and name n)  (resid  33 and name ca)
       (resid  33 and name cb) (resid  33 and name cg) 1.0 -75.0 30.0 2
assign (resid  34 and name n)  (resid  34 and name ca)
       (resid  34 and name cb) (resid  34 and name og1) 1.0 60.0 30.0 2
assign (resid  35 and name n)  (resid  35 and name ca)
       (resid  35 and name cb) (resid  35 and name cg1) 1.0 -60.0  30.0 2 
assign (resid  37 and name n)  (resid  37 and name ca)
       (resid  37 and name cb) (resid  37 and name cg)  1.0 -60.0 40.0 2
assign (resid  38 and name n)  (resid  38 and name ca)
       (resid  38 and name cb) (resid  38 and name cg1) 1.0 -60.0 30.0 2
assign (resid  39 and name n)  (resid  39 and name ca)
       (resid  39 and name cb) (resid  39 and name cg) 1.0 180.0 30.0 2 
assign (resid  40 and name n)  (resid  40 and name ca)
       (resid  40 and name cb) (resid  40 and name cg1) 1.0 180.0 30.0 2
assign (resid  41 and name n)  (resid  41 and name ca)
       (resid  41 and name cb) (resid  41 and name cg1) 1.0 -60.0  30.0 2 
assign (resid  45 and name n)  (resid  45 and name ca)
       (resid  45 and name cb) (resid  45 and name og1) 1.0 -63.0 30.0 2
assign (resid  46 and name n)  (resid  46 and name ca)
       (resid  46 and name cb) (resid  46 and name cg)  1.0 180.0 30.0 2
assign (resid  47 and name n)  (resid  47 and name ca)
       (resid  47 and name cb) (resid  47 and name cg) 1.0 -66.0 30.0 2
assign (resid  49 and name n)  (resid  49 and name ca)
       (resid  49 and name cb) (resid  49 and name cg) 1.0 -60.0 30.0 2
assign (resid  54 and name n)  (resid  54 and name ca)
       (resid  54 and name cb) (resid  54 and name cg) 1.0 -60.0 30.0 2
assign (resid  56 and name n)  (resid  56 and name ca)
       (resid  56 and name cb) (resid  56 and name cg) 1.0 -60.0 40.0 2 
assign (resid  57 and name n)  (resid  57 and name ca)
       (resid  57 and name cb) (resid  57 and name cg) 1.0  60.0 40.0 2 
assign (resid  58 and name n)  (resid  58 and name ca)
       (resid  58 and name cb) (resid  58 and name og1) 1.0 -60.0 40.0 2 
assign (resid  59 and name n)  (resid  59 and name ca)
       (resid  59 and name cb) (resid  59 and name cg) 1.0 -60.0 40.0 2
assign (resid  60 and name n)  (resid  60 and name ca)
       (resid  60 and name cb) (resid  60 and name cg1) 1.0 180.0 30.0 2 
assign (resid  61 and name n)  (resid  61 and name ca)
       (resid  61 and name cb) (resid  61 and name cg1) 1.0 180.0 30.0 2 
assign (resid  62 and name n)  (resid  62 and name ca)
       (resid  62 and name cb) (resid  62 and name cg)  1.0 180.0 30.0 2 
assign (resid  63 and name n)  (resid  63 and name ca)
       (resid  63 and name cb) (resid  63 and name og1) 1.0 180.0 30.0 2 
assign (resid  68 and name n)  (resid  68 and name ca)
       (resid  68 and name cb) (resid  68 and name cg) 1.0 180.0 40.0 2
assign (resid  69 and name n)  (resid  69 and name ca)
       (resid  69 and name cb) (resid  69 and name cg) 1.0 -60.0 40.0 2
assign (resid  71 and name n)  (resid  71 and name ca)
       (resid  71 and name cb) (resid  71 and name cg)  1.0 -60.0 30.0 2
assign (resid  74 and name n)  (resid  74 and name ca)
       (resid  74 and name cb) (resid  74 and name cg1) 1.0 180.0 30.0 2
assign (resid  75 and name n)  (resid  75 and name ca)
       (resid  75 and name cb) (resid  75 and name cg1) 1.0 180.0 30.0 2 
assign (resid  76 and name n)  (resid  76 and name ca)
       (resid  76 and name cb) (resid  76 and name cg1) 1.0 -60.0 30.0 2 
assign (resid  77 and name n)  (resid  77 and name ca)
       (resid  77 and name cb) (resid  77 and name cg) 1.0 -60.0 30.0 2
assign (resid  79 and name n)  (resid  79 and name ca)
       (resid  79 and name cb) (resid  79 and name cg1) 1.0 180.0 30.0 2 
assign (resid  82 and name n)  (resid  82 and name ca)
       (resid  82 and name cb) (resid  82 and name cg1) 1.0 180.0 40.0 2 
assign (resid  83 and name n)  (resid  83 and name ca)
       (resid  83 and name cb) (resid  83 and name cg) 1.0 -60.0 30.0 2
assign (resid  85 and name n)  (resid  85 and name ca)
       (resid  85 and name cb) (resid  85 and name cg) 1.0 180.0 30.0 2
assign (resid  89 and name n)  (resid  89 and name ca)
       (resid  89 and name cb) (resid  89 and name cg) 1.0 -66.0 30.0 2
assign (resid  93 and name n)  (resid  93 and name ca)
       (resid  93 and name cb) (resid  93 and name cg)  1.0 -60.0 30.0 2
assign (resid  94 and name n)  (resid  94 and name ca)
       (resid  94 and name cb) (resid  94 and name cg)  1.0 180.0 40.0 2
assign (resid  95 and name n)  (resid  95 and name ca)
       (resid  95 and name cb) (resid  95 and name cg1) 1.0 180.0 30.0 2
assign (resid  96 and name n)  (resid  96 and name ca)
       (resid  96 and name cb) (resid  96 and name cg1) 1.0 -60.0 30.0 2
assign (resid 102 and name n)  (resid 102 and name ca)
       (resid 102 and name cb) (resid 102 and name cg1) 1.0 -60.0 30.0 2
assign (resid 103 and name n)  (resid 103 and name ca)
       (resid 103 and name cb) (resid 103 and name cg) 1.0 -60.0 30.0 2
assign (resid 106 and name n)  (resid 106 and name ca)
       (resid 106 and name cb) (resid 106 and name cg) 1.0 -63.0 30.0 2
assign (resid 108 and name n)  (resid 108 and name ca)
       (resid 108 and name cb) (resid 108 and name cg) 1.0 180.0 40.0 2
assign (resid 109 and name n)  (resid 109 and name ca)
       (resid 109 and name cb) (resid 109 and name cg) 1.0 -66.0 30.0 2
assign (resid 110 and name n)  (resid 110 and name ca)
       (resid 110 and name cb) (resid 110 and name cg1) 1.0 60.0 30.0 2 
assign (resid 112 and name n)  (resid 112 and name ca)
       (resid 112 and name cb) (resid 112 and name og1) 1.0 -60.0 40.0 2
assign (resid 113 and name n)  (resid 113 and name ca)
       (resid 113 and name cb) (resid 113 and name cg) 1.0 -60.0 30.0 2
assign (resid 114 and name n)  (resid 114 and name ca)
       (resid 114 and name cb) (resid 114 and name cg) 1.0 -60.0 30.0 2
assign (resid 116 and name n)  (resid 116 and name ca)
       (resid 116 and name cb) (resid 116 and name og1) 1.0 -39.0 30.0 2
assign (resid 117 and name n)  (resid 117 and name ca)
       (resid 117 and name cb) (resid 117 and name cg)  1.0 -60.0 30.0 2
assign (resid 118 and name n)  (resid 118 and name ca)
       (resid 118 and name cb) (resid 118 and name cg) 1.0 -80.0 30.0 2
assign (resid 122 and name n)  (resid 122 and name ca)
       (resid 122 and name cb) (resid 122 and name cg) 1.0 -60.0 30.0 2
assign (resid 126 and name n)  (resid 126 and name ca)
       (resid 126 and name cb) (resid 126 and name og1) 1.0 -60.0 30.0 2
assign (resid 127 and name n)  (resid 127 and name ca)
       (resid 127 and name cb) (resid 127 and name cg) 1.0 -60.0 30.0 2
assign (resid 128 and name n)  (resid 128 and name ca)
       (resid 128 and name cb) (resid 128 and name cg) 1.0 180.0 40.0 2
assign (resid 129 and name n)  (resid 129 and name ca)
       (resid 129 and name cb) (resid 129 and name cg1) 1.0 63.0 30.0 2
assign (resid 131 and name n)  (resid 131 and name ca)
       (resid 131 and name cb) (resid 131 and name cg) 1.0 -75.0 30.0 2
assign (resid 132 and name n)  (resid 132 and name ca)
       (resid 132 and name cb) (resid 132 and name cg) 1.0 180.0 30.0 2
assign (resid 133 and name n)  (resid 133 and name ca)
       (resid 133 and name cb) (resid 133 and name cg) 1.0 -60.0 30.0 2
assign (resid 136 and name n)  (resid 136 and name ca)
       (resid 136 and name cb) (resid 136 and name cg) 1.0 -60.0 30.0 2
assign (resid 137 and name n)  (resid 137 and name ca)
       (resid 137 and name cb) (resid 137 and name og1) 1.0 -60.0 30.0 2
assign (resid 138 and name n)  (resid 138 and name ca)
       (resid 138 and name cb) (resid 138 and name cg) 1.0 -165.0 30.0 2
assign (resid 139 and name n)  (resid 139 and name ca)
       (resid 139 and name cb) (resid 139 and name cg1) 1.0 -60.0 40.0 2
assign (resid 142 and name n)  (resid 142 and name ca)
       (resid 142 and name cb) (resid 142 and name cg) 1.0 180.0 40.0 2
assign (resid 143 and name n)  (resid 143 and name ca)
       (resid 143 and name cb) (resid 143 and name og1) 1.0 -60.0 40.0 2
assign (resid 146 and name n)  (resid 146 and name ca)
       (resid 146 and name cb) (resid 146 and name cg) 1.0 -171.0 30.0 2
assign (resid 147 and name n)  (resid 147 and name ca)
       (resid 147 and name cb) (resid 147 and name og1) 1.0 60.0 30.0 2
assign (resid 148 and name n)  (resid 148 and name ca)
       (resid 148 and name cb) (resid 148 and name cg) 1.0 180.0 40.0 2
assign (resid 151 and name n)  (resid 151 and name ca)
       (resid 151 and name cb) (resid 151 and name cg) 1.0 -60.0 30.0 2
assign (resid 153 and name n)  (resid 153 and name ca)
       (resid 153 and name cb) (resid 153 and name cg) 1.0 60.0 30.0 2
assign (resid 155 and name n)  (resid 155 and name ca)
       (resid 155 and name cb) (resid 155 and name cg) 1.0 -60.0 30.0 2
assign (resid 156 and name n)  (resid 156 and name ca)
       (resid 156 and name cb) (resid 156 and name cg) 1.0 -60.0 30.0 2
assign (resid 157 and name n)  (resid 157 and name ca)
       (resid 157 and name cb) (resid 157 and name cg1) 1.0 180.0 30.0 2
assign (resid 158 and name n)  (resid 158 and name ca)
       (resid 158 and name cb) (resid 158 and name cg) 1.0 -60.0 30.0 2
assign (resid 159 and name n)  (resid 159 and name ca)
       (resid 159 and name cb) (resid 159 and name cg) 1.0 -60.0 30.0 2
assign (resid 160 and name n)  (resid 160 and name ca)
       (resid 160 and name cb) (resid 160 and name cg) 1.0 180.0 30.0 2
!Chi-2 constraints
assign (resid  19 and name ca)  (resid  19 and name cb)
       (resid  19 and name cg)  (resid  19 and name cd1) 1.0 180.0 40.0 2
assign (resid  54 and name ca)  (resid  54 and name cb)
       (resid  54 and name cg)  (resid  54 and name cd1) 1.0 180.0 40.0 2
assign (resid  57 and name ca)  (resid  57 and name cb)
       (resid  57 and name cg)  (resid  57 and name cd ) 1.0 180.0 40.0 2
assign (resid 102 and name ca)  (resid 102 and name cb)
       (resid 102 and name cg1) (resid 102 and name cd1) 1.0 -60.0 40.0 2
!Constraints for TMQ residue - results of AngleSearch analysis
assign (resid 170 and name c5 ) (resid 170 and name c6 )
       (resid 170 and name c9 ) (resid 170 and name n10)  1.0  170.0 30.0 2
assign (resid 170 and name c6 ) (resid 170 and name c9 )
       (resid 170 and name n10) (resid 170 and name c11)  1.0   90.0 30.0 2
!Constraints to keep TMQ trimethoxyphenyl substituents almost planar
assign (resid 170 and name c21) (resid 170 and name o18)
       (resid 170 and name c13) (resid 170 and name c12)  1.0   0.0 20.0 2
assign (resid 170 and name c23) (resid 170 and name o20)
       (resid 170 and name c15) (resid 170 and name c16)  1.0   0.0 20.0 2
assign (resid 170 and name c9 ) (resid 170 and name n10)
       (resid 170 and name c11) (resid 170 and name c12)  1.0   0.0 20.0 2
!Constraints to specifiy geometry TMQ/Asp-26 interaction
assign (resid  26 and name od2) (resid  26 and name cg )
       (resid  26 and name od1) (resid 170 and name n1 )  1.0   0.0 30.0 2
assign (resid  26 and name od1) (resid  26 and name cg )
       (resid  26 and name od2) (resid 170 and name n24)  1.0   0.0 30.0 2
assign (resid 170 and name n24) (resid 170 and name c2 )
       (resid  26 and name n1 ) (resid  26 and name od1)  1.0   0.0 30.0 2
assign (resid 170 and name n1 ) (resid 170 and name c2 )
       (resid  26 and name n24) (resid  26 and name od2)  1.0   0.0 30.0 2


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    THR   1           HT1      THR   1  -2.726   6.409   4.751
    2   2H    THR   1           HT3      THR   1  -3.588   7.208   3.528
    3   3H    THR   1           HT2      THR   1  -4.426   6.399   4.766
    4    HA   THR   1           HA       THR   1  -4.274   4.425   3.772
    5    HB   THR   1           HB       THR   1  -3.191   5.945   1.395
    6    HG1  THR   1           HG1      THR   1  -5.034   6.916   2.689
    7   1HG2  THR   1          HG23      THR   1  -4.913   3.516   1.845
    8   2HG2  THR   1          HG22      THR   1  -4.986   4.402   0.322
    9   3HG2  THR   1          HG21      THR   1  -3.468   3.675   0.847
   10    H    ALA   2           HN       ALA   2  -2.865   2.758   2.756
   11    HA   ALA   2           HA       ALA   2   0.047   3.366   3.032
   12   1HB   ALA   2           HB3      ALA   2  -1.460   0.989   4.154
   13   2HB   ALA   2           HB2      ALA   2   0.297   1.060   4.034
   14   3HB   ALA   2           HB1      ALA   2  -0.563   2.206   5.063
   15    H    PHE   3           HN       PHE   3   1.261   2.571   1.362
   16    HA   PHE   3           HA       PHE   3  -0.153   0.895  -0.663
   17   1HB   PHE   3           HB2      PHE   3   2.107   2.877  -0.810
   18   2HB   PHE   3           HB1      PHE   3   1.922   1.654  -2.067
   19    HD1  PHE   3           HD1      PHE   3  -0.436   3.812  -0.085
   20    HD2  PHE   3           HD2      PHE   3   0.843   2.460  -3.956
   21    HE1  PHE   3           HE1      PHE   3  -2.221   5.167  -1.148
   22    HE2  PHE   3           HE2      PHE   3  -0.942   3.815  -5.019
   23    HZ   PHE   3           HZ       PHE   3  -2.474   5.168  -3.614
   24    H    LEU   4           HN       LEU   4   1.000  -0.909  -1.599
   25    HA   LEU   4           HA       LEU   4   3.562  -1.772  -0.522
   26   1HB   LEU   4           HB2      LEU   4   1.998  -2.329   1.357
   27   2HB   LEU   4           HB1      LEU   4   1.100  -3.368   0.249
   28    HG   LEU   4           HG       LEU   4   3.485  -4.416  -0.204
   29   1HD1  LEU   4          HD11      LEU   4   3.796  -2.825   2.306
   30   2HD1  LEU   4          HD13      LEU   4   4.553  -4.417   2.243
   31   3HD1  LEU   4          HD12      LEU   4   4.983  -3.187   1.054
   32   1HD2  LEU   4          HD21      LEU   4   1.887  -4.919   2.328
   33   2HD2  LEU   4          HD23      LEU   4   1.562  -5.624   0.745
   34   3HD2  LEU   4          HD22      LEU   4   3.038  -6.047   1.613
   35    H    TRP   5           HN       TRP   5   4.377  -2.430  -2.464
   36    HA   TRP   5           HA       TRP   5   2.891  -4.539  -3.932
   37   1HB   TRP   5           HB2      TRP   5   3.292  -3.424  -6.091
   38   2HB   TRP   5           HB1      TRP   5   2.320  -2.400  -5.037
   39    HD1  TRP   5           HD1      TRP   5   5.362  -2.363  -7.102
   40    HE1  TRP   5           HE1      TRP   5   6.756  -0.243  -6.656
   41    HE3  TRP   5           HE3      TRP   5   3.078  -0.677  -2.852
   42    HZ2  TRP   5           HZ2      TRP   5   6.889   1.884  -4.752
   43    HZ3  TRP   5           HZ3      TRP   5   3.864   1.395  -1.745
   44    HH2  TRP   5           HH2      TRP   5   5.762   2.677  -2.688
   45    H    ALA   6           HN       ALA   6   4.257  -5.989  -5.046
   46    HA   ALA   6           HA       ALA   6   7.121  -5.812  -4.264
   47   1HB   ALA   6           HB3      ALA   6   5.518  -8.116  -5.419
   48   2HB   ALA   6           HB2      ALA   6   7.202  -8.203  -4.903
   49   3HB   ALA   6           HB1      ALA   6   5.932  -7.900  -3.718
   50    H    GLN   7           HN       GLN   7   8.331  -4.757  -5.771
   51    HA   GLN   7           HA       GLN   7   7.925  -5.504  -8.638
   52   1HB   GLN   7           HB2      GLN   7   8.581  -3.152  -9.213
   53   2HB   GLN   7           HB1      GLN   7   7.052  -3.253  -8.340
   54   1HG   GLN   7           HG2      GLN   7   8.002  -2.476  -6.332
   55   2HG   GLN   7           HG1      GLN   7   9.643  -2.863  -6.852
   56   1HE2  GLN   7          HE22      GLN   7  10.161   0.315  -8.260
   57   2HE2  GLN   7          HE21      GLN   7  10.830  -1.140  -7.700
   58    H    ASP   8           HN       ASP   8   9.852  -5.616  -9.885
   59    HA   ASP   8           HA       ASP   8  12.320  -5.907  -8.249
   60   1HB   ASP   8           HB2      ASP   8  13.196  -7.061 -10.326
   61   2HB   ASP   8           HB1      ASP   8  11.820  -7.862  -9.568
   62    H    ARG   9           HN       ARG   9  14.388  -5.261  -9.524
   63    HA   ARG   9           HA       ARG   9  14.336  -2.448 -10.000
   64   1HB   ARG   9           HB2      ARG   9  16.648  -2.803 -10.911
   65   2HB   ARG   9           HB1      ARG   9  16.396  -3.552  -9.334
   66   1HG   ARG   9           HG2      ARG   9  16.223  -5.722 -10.262
   67   2HG   ARG   9           HG1      ARG   9  15.957  -5.095 -11.890
   68   1HD   ARG   9           HD2      ARG   9  18.217  -5.821 -11.889
   69   2HD   ARG   9           HD1      ARG   9  18.309  -4.070 -11.698
   70    HE   ARG   9           HE       ARG   9  18.935  -6.076  -9.624
   71   1HH1  ARG   9          HH11      ARG   9  18.347  -2.760 -10.476
   72   2HH1  ARG   9          HH12      ARG   9  19.122  -2.134  -9.060
   73   1HH2  ARG   9          HH21      ARG   9  19.937  -5.252  -7.788
   74   2HH2  ARG   9          HH22      ARG   9  20.017  -3.538  -7.546
   75    H    ASP  10           HN       ASP  10  13.601  -5.117 -12.067
   76    HA   ASP  10           HA       ASP  10  14.126  -3.731 -14.580
   77   1HB   ASP  10           HB2      ASP  10  12.730  -6.288 -13.810
   78   2HB   ASP  10           HB1      ASP  10  12.612  -5.661 -15.456
   79    H    GLY  11           HN       GLY  11  12.140  -2.733 -12.357
   80   1HA   GLY  11           HA2      GLY  11  10.166  -1.466 -12.360
   81   2HA   GLY  11           HA1      GLY  11  10.355  -1.352 -14.111
   82    H    LEU  12           HN       LEU  12  10.002  -4.348 -12.256
   83    HA   LEU  12           HA       LEU  12   7.515  -4.901 -13.812
   84   1HB   LEU  12           HB2      LEU  12   9.699  -6.442 -13.704
   85   2HB   LEU  12           HB1      LEU  12   8.900  -7.034 -12.247
   86    HG   LEU  12           HG       LEU  12   6.790  -7.257 -13.707
   87   1HD1  LEU  12          HD11      LEU  12   7.867  -5.862 -15.562
   88   2HD1  LEU  12          HD13      LEU  12   8.834  -7.289 -15.936
   89   3HD1  LEU  12          HD12      LEU  12   7.076  -7.352 -16.074
   90   1HD2  LEU  12          HD23      LEU  12   8.337  -9.124 -12.910
   91   2HD2  LEU  12          HD22      LEU  12   7.416  -9.476 -14.373
   92   3HD2  LEU  12          HD21      LEU  12   9.118  -9.030 -14.488
   93    H    ILE  13           HN       ILE  13   5.876  -6.269 -12.567
   94    HA   ILE  13           HA       ILE  13   5.878  -5.760  -9.645
   95    HB   ILE  13           HB       ILE  13   3.549  -4.866  -9.767
   96   1HG1  ILE  13          HG12      ILE  13   3.182  -3.888 -12.258
   97   2HG1  ILE  13          HG11      ILE  13   4.054  -5.367 -12.661
   98   1HG2  ILE  13          HG21      ILE  13   5.555  -3.373  -9.659
   99   2HG2  ILE  13          HG23      ILE  13   5.532  -3.275 -11.419
  100   3HG2  ILE  13          HG22      ILE  13   4.185  -2.629 -10.482
  101   1HD1  ILE  13          HD11      ILE  13   1.878  -5.618 -10.649
  102   2HD1  ILE  13          HD13      ILE  13   1.381  -5.313 -12.313
  103   3HD1  ILE  13          HD12      ILE  13   2.359  -6.730 -11.931
  104    H    GLY  14           HN       GLY  14   4.700  -7.468 -12.452
  105   1HA   GLY  14           HA2      GLY  14   4.181  -9.859 -10.919
  106   2HA   GLY  14           HA1      GLY  14   2.670  -9.082 -11.396
  107    H    LYS  15           HN       LYS  15   2.575 -11.281 -12.585
  108    HA   LYS  15           HA       LYS  15   3.005 -10.815 -15.392
  109   1HB   LYS  15           HB2      LYS  15   5.351 -11.375 -14.613
  110   2HB   LYS  15           HB1      LYS  15   4.751 -12.978 -14.189
  111   1HG   LYS  15           HG2      LYS  15   3.903 -13.160 -16.583
  112   2HG   LYS  15           HG1      LYS  15   4.835 -11.704 -16.932
  113   1HD   LYS  15           HD2      LYS  15   6.892 -12.823 -16.164
  114   2HD   LYS  15           HD1      LYS  15   5.965 -14.281 -15.800
  115   1HE   LYS  15           HE2      LYS  15   5.367 -14.547 -18.141
  116   2HE   LYS  15           HE1      LYS  15   6.138 -13.014 -18.548
  117   1HZ   LYS  15           HZ1      LYS  15   8.180 -14.168 -17.419
  118   2HZ   LYS  15           HZ3      LYS  15   7.359 -15.586 -17.858
  119   3HZ   LYS  15           HZ2      LYS  15   7.804 -14.460 -19.050
  120    H    ASP  16           HN       ASP  16   1.255 -11.814 -16.240
  121    HA   ASP  16           HA       ASP  16  -0.454 -13.381 -16.584
  122   1HB   ASP  16           HB2      ASP  16   1.880 -14.984 -15.670
  123   2HB   ASP  16           HB1      ASP  16   0.305 -15.778 -15.594
  124    H    GLY  17           HN       GLY  17  -0.419 -11.789 -14.128
  125   1HA   GLY  17           HA2      GLY  17  -2.051 -11.694 -12.384
  126   2HA   GLY  17           HA1      GLY  17  -2.318 -13.428 -12.571
  127    H    HIS  18           HN       HIS  18  -0.133 -14.710 -12.075
  128    HA   HIS  18           HA       HIS  18   0.502 -14.118  -9.292
  129   1HB   HIS  18           HB2      HIS  18   1.962 -16.149  -9.491
  130   2HB   HIS  18           HB1      HIS  18   0.294 -16.442  -9.978
  131    HD1  HIS  18           HD1      HIS  18   3.775 -16.211 -11.325
  132    HD2  HIS  18           HD2      HIS  18  -0.078 -16.813 -12.799
  133    HE1  HIS  18           HE1      HIS  18   4.038 -17.002 -13.717
  134    H    LEU  19           HN       LEU  19   3.018 -14.402  -8.749
  135    HA   LEU  19           HA       LEU  19   4.342 -12.142 -10.073
  136   1HB   LEU  19           HB2      LEU  19   4.955 -13.877  -7.689
  137   2HB   LEU  19           HB1      LEU  19   6.201 -12.830  -8.370
  138    HG   LEU  19           HG       LEU  19   3.458 -11.771  -7.691
  139   1HD1  LEU  19          HD13      LEU  19   5.887 -12.045  -5.900
  140   2HD1  LEU  19          HD12      LEU  19   4.546 -10.952  -5.558
  141   3HD1  LEU  19          HD11      LEU  19   4.272 -12.693  -5.615
  142   1HD2  LEU  19          HD21      LEU  19   6.149 -10.672  -8.412
  143   2HD2  LEU  19          HD23      LEU  19   4.550 -10.154  -8.944
  144   3HD2  LEU  19          HD22      LEU  19   5.125  -9.725  -7.333
  145    HA   PRO  20           HA       PRO  20   6.924 -14.603 -12.744
  146   1HB   PRO  20           HB2      PRO  20   9.047 -12.801 -12.967
  147   2HB   PRO  20           HB1      PRO  20   7.566 -12.776 -13.934
  148   1HG   PRO  20           HG2      PRO  20   8.426 -10.897 -11.939
  149   2HG   PRO  20           HG1      PRO  20   6.986 -10.835 -12.966
  150   1HD   PRO  20           HD2      PRO  20   7.197 -11.573 -10.153
  151   2HD   PRO  20           HD1      PRO  20   5.748 -11.239 -11.117
  152    H    TRP  21           HN       TRP  21   8.318 -13.243  -9.806
  153    HA   TRP  21           HA       TRP  21  10.469 -15.312  -9.877
  154   1HB   TRP  21           HB2      TRP  21  11.500 -13.942  -8.044
  155   2HB   TRP  21           HB1      TRP  21  11.320 -13.058  -9.559
  156    HD1  TRP  21           HD1      TRP  21   9.682 -13.419  -6.103
  157    HE1  TRP  21           HE1      TRP  21   8.344 -11.272  -5.603
  158    HE3  TRP  21           HE3      TRP  21  10.190 -11.002 -10.574
  159    HZ2  TRP  21           HZ2      TRP  21   7.590  -8.851  -6.925
  160    HZ3  TRP  21           HZ3      TRP  21   9.152  -8.780 -10.925
  161    HH2  TRP  21           HH2      TRP  21   7.855  -7.702  -9.108
  162    H    HIS  22           HN       HIS  22  10.983 -16.249  -7.646
  163    HA   HIS  22           HA       HIS  22   8.423 -16.805  -6.199
  164   1HB   HIS  22           HB2      HIS  22   9.603 -18.712  -7.471
  165   2HB   HIS  22           HB1      HIS  22  10.840 -18.615  -6.218
  166    HD1  HIS  22           HD1      HIS  22   7.013 -18.699  -6.232
  167    HD2  HIS  22           HD2      HIS  22  10.239 -20.361  -4.180
  168    HE1  HIS  22           HE1      HIS  22   6.029 -20.232  -4.472
  169    H    LEU  23           HN       LEU  23   8.468 -15.548  -4.383
  170    HA   LEU  23           HA       LEU  23  10.936 -15.671  -2.700
  171   1HB   LEU  23           HB2      LEU  23  10.413 -13.427  -3.951
  172   2HB   LEU  23           HB1      LEU  23   9.161 -13.240  -2.722
  173    HG   LEU  23           HG       LEU  23  10.904 -13.588  -0.962
  174   1HD1  LEU  23          HD12      LEU  23  12.632 -13.756  -3.421
  175   2HD1  LEU  23          HD11      LEU  23  13.307 -13.171  -1.900
  176   3HD1  LEU  23          HD13      LEU  23  12.630 -14.796  -1.997
  177   1HD2  LEU  23          HD22      LEU  23  10.258 -11.309  -2.277
  178   2HD2  LEU  23          HD21      LEU  23  11.408 -11.350  -0.939
  179   3HD2  LEU  23          HD23      LEU  23  11.990 -11.359  -2.604
  180    HA   PRO  24           HA       PRO  24   7.309 -17.620  -0.460
  181   1HB   PRO  24           HB2      PRO  24   9.421 -18.560   1.317
  182   2HB   PRO  24           HB1      PRO  24   8.285 -19.499   0.340
  183   1HG   PRO  24           HG2      PRO  24  11.055 -18.984  -0.166
  184   2HG   PRO  24           HG1      PRO  24   9.924 -19.951  -1.123
  185   1HD   PRO  24           HD2      PRO  24  11.054 -17.496  -1.877
  186   2HD   PRO  24           HD1      PRO  24   9.692 -18.309  -2.664
  187    H    ASP  25           HN       ASP  25  10.153 -15.901   0.820
  188    HA   ASP  25           HA       ASP  25   9.058 -15.256   3.379
  189   1HB   ASP  25           HB2      ASP  25  11.490 -14.964   2.402
  190   2HB   ASP  25           HB1      ASP  25  10.900 -13.365   1.948
  191    H    ASP  26           HN       ASP  26   9.138 -13.360   0.347
  192    HA   ASP  26           HA       ASP  26   7.639 -11.140   1.347
  193   1HB   ASP  26           HB2      ASP  26   8.962 -11.123  -0.774
  194   2HB   ASP  26           HB1      ASP  26   7.748 -12.175  -1.503
  195    H    LEU  27           HN       LEU  27   6.677 -14.262   0.043
  196    HA   LEU  27           HA       LEU  27   3.880 -13.587  -0.304
  197   1HB   LEU  27           HB2      LEU  27   5.255 -16.272   0.028
  198   2HB   LEU  27           HB1      LEU  27   3.569 -16.058  -0.444
  199    HG   LEU  27           HG       LEU  27   5.929 -14.910  -1.962
  200   1HD1  LEU  27          HD12      LEU  27   4.324 -17.442  -2.286
  201   2HD1  LEU  27          HD11      LEU  27   5.104 -16.681  -3.671
  202   3HD1  LEU  27          HD13      LEU  27   6.076 -17.239  -2.310
  203   1HD2  LEU  27          HD23      LEU  27   2.968 -14.725  -2.181
  204   2HD2  LEU  27          HD22      LEU  27   4.207 -13.571  -2.677
  205   3HD2  LEU  27          HD21      LEU  27   3.845 -14.965  -3.693
  206    H    HIS  28           HN       HIS  28   5.858 -14.563   2.390
  207    HA   HIS  28           HA       HIS  28   3.546 -15.304   4.060
  208   1HB   HIS  28           HB2      HIS  28   6.526 -15.148   4.525
  209   2HB   HIS  28           HB1      HIS  28   5.399 -15.396   5.858
  210    HD1  HIS  28           HD1      HIS  28   3.395 -17.326   4.766
  211    HD2  HIS  28           HD2      HIS  28   7.458 -17.670   3.895
  212    HE1  HIS  28           HE1      HIS  28   3.782 -19.737   4.095
  213    H    TYR  29           HN       TYR  29   5.502 -12.510   3.380
  214    HA   TYR  29           HA       TYR  29   4.838 -11.052   5.807
  215   1HB   TYR  29           HB2      TYR  29   6.832 -10.624   4.252
  216   2HB   TYR  29           HB1      TYR  29   5.681  -9.839   3.169
  217    HD1  TYR  29           HD1      TYR  29   6.290  -9.891   6.879
  218    HD2  TYR  29           HD2      TYR  29   5.653  -7.523   3.352
  219    HE1  TYR  29           HE1      TYR  29   6.413  -7.824   8.244
  220    HE2  TYR  29           HE2      TYR  29   5.776  -5.456   4.717
  221    HH   TYR  29           HH       TYR  29   6.483  -4.646   6.764
  222    H    PHE  30           HN       PHE  30   3.309 -11.585   2.726
  223    HA   PHE  30           HA       PHE  30   1.589  -9.301   2.660
  224   1HB   PHE  30           HB2      PHE  30   1.977 -10.939   0.770
  225   2HB   PHE  30           HB1      PHE  30   0.934 -12.073   1.628
  226    HD1  PHE  30           HD2      PHE  30   0.976  -8.511   0.449
  227    HD2  PHE  30           HD1      PHE  30  -1.363 -12.033   1.211
  228    HE1  PHE  30           HE2      PHE  30  -1.025  -7.386  -0.492
  229    HE2  PHE  30           HE1      PHE  30  -3.363 -10.908   0.272
  230    HZ   PHE  30           HZ       PHE  30  -3.194  -8.586  -0.580
  231    H    ARG  31           HN       ARG  31   1.139 -12.559   4.044
  232    HA   ARG  31           HA       ARG  31  -1.529 -12.132   4.989
  233   1HB   ARG  31           HB2      ARG  31  -0.167 -14.339   4.816
  234   2HB   ARG  31           HB1      ARG  31   0.464 -13.897   6.404
  235   1HG   ARG  31           HG2      ARG  31  -2.065 -13.532   7.005
  236   2HG   ARG  31           HG1      ARG  31  -2.354 -14.576   5.613
  237   1HD   ARG  31           HD2      ARG  31  -0.493 -15.303   7.890
  238   2HD   ARG  31           HD1      ARG  31  -2.180 -15.809   7.809
  239    HE   ARG  31           HE       ARG  31   0.016 -16.840   6.148
  240   1HH1  ARG  31          HH21      ARG  31  -3.409 -16.488   6.610
  241   2HH1  ARG  31          HH22      ARG  31  -3.805 -17.837   5.599
  242   1HH2  ARG  31          HH11      ARG  31  -0.510 -18.588   4.837
  243   2HH2  ARG  31          HH12      ARG  31  -2.171 -19.020   4.600
  244    H    ALA  32           HN       ALA  32   1.592 -11.174   6.219
  245    HA   ALA  32           HA       ALA  32   0.597 -10.546   8.903
  246   1HB   ALA  32           HB2      ALA  32   3.201  -9.993   7.463
  247   2HB   ALA  32           HB1      ALA  32   2.875  -9.415   9.097
  248   3HB   ALA  32           HB3      ALA  32   2.912 -11.146   8.765
  249    H    GLN  33           HN       GLN  33   1.023  -8.893   5.846
  250    HA   GLN  33           HA       GLN  33   0.313  -6.294   7.123
  251   1HB   GLN  33           HB2      GLN  33   1.418  -6.980   4.386
  252   2HB   GLN  33           HB1      GLN  33   0.912  -5.356   4.852
  253   1HG   GLN  33           HG2      GLN  33   2.878  -6.905   6.533
  254   2HG   GLN  33           HG1      GLN  33   3.416  -5.969   5.137
  255   1HE2  GLN  33          HE22      GLN  33   2.179  -2.843   6.684
  256   2HE2  GLN  33          HE21      GLN  33   1.978  -3.658   5.209
  257    H    THR  34           HN       THR  34  -1.643  -8.435   6.772
  258    HA   THR  34           HA       THR  34  -3.576  -6.947   5.067
  259    HB   THR  34           HB       THR  34  -4.430  -9.193   4.241
  260    HG1  THR  34           HG1      THR  34  -2.657 -10.798   4.305
  261   1HG2  THR  34          HG21      THR  34  -1.712  -8.114   3.513
  262   2HG2  THR  34          HG23      THR  34  -2.421  -9.472   2.639
  263   3HG2  THR  34          HG22      THR  34  -3.239  -7.910   2.657
  264    H    VAL  35           HN       VAL  35  -2.968  -9.323   7.611
  265    HA   VAL  35           HA       VAL  35  -5.766  -9.495   8.416
  266    HB   VAL  35           HB       VAL  35  -4.821 -10.682  10.413
  267   1HG1  VAL  35          HG11      VAL  35  -5.300 -11.790   8.175
  268   2HG1  VAL  35          HG13      VAL  35  -3.577 -11.647   7.827
  269   3HG1  VAL  35          HG12      VAL  35  -4.123 -12.625   9.189
  270   1HG2  VAL  35          HG21      VAL  35  -2.216  -9.935   9.051
  271   2HG2  VAL  35          HG23      VAL  35  -2.728  -9.503  10.683
  272   3HG2  VAL  35          HG22      VAL  35  -2.343 -11.179  10.294
  273    H    GLY  36           HN       GLY  36  -6.817  -8.152   9.809
  274   1HA   GLY  36           HA2      GLY  36  -6.942  -6.738  11.778
  275   2HA   GLY  36           HA1      GLY  36  -5.221  -6.390  11.598
  276    H    LYS  37           HN       LYS  37  -5.438  -5.895   8.707
  277    HA   LYS  37           HA       LYS  37  -6.768  -3.220   8.838
  278   1HB   LYS  37           HB2      LYS  37  -4.476  -4.147   7.076
  279   2HB   LYS  37           HB1      LYS  37  -5.162  -2.522   7.103
  280   1HG   LYS  37           HG2      LYS  37  -4.459  -2.185   9.388
  281   2HG   LYS  37           HG1      LYS  37  -3.965  -3.872   9.537
  282   1HD   LYS  37           HD2      LYS  37  -2.324  -3.444   7.646
  283   2HD   LYS  37           HD1      LYS  37  -2.701  -1.729   7.813
  284   1HE   LYS  37           HE2      LYS  37  -1.656  -3.506  10.038
  285   2HE   LYS  37           HE1      LYS  37  -0.685  -2.356   9.118
  286   1HZ   LYS  37           HZ1      LYS  37  -3.076  -1.193  10.181
  287   2HZ   LYS  37           HZ3      LYS  37  -2.066  -1.810  11.395
  288   3HZ   LYS  37           HZ2      LYS  37  -1.466  -0.659  10.297
  289    H    ILE  38           HN       ILE  38  -7.548  -2.454   6.624
  290    HA   ILE  38           HA       ILE  38  -9.192  -4.584   5.434
  291    HB   ILE  38           HB       ILE  38  -9.030  -1.648   4.692
  292   1HG1  ILE  38          HG12      ILE  38 -11.010  -3.015   6.537
  293   2HG1  ILE  38          HG11      ILE  38  -9.607  -2.114   7.114
  294   1HG2  ILE  38          HG22      ILE  38 -10.096  -3.343   3.090
  295   2HG2  ILE  38          HG21      ILE  38 -11.324  -3.585   4.331
  296   3HG2  ILE  38          HG23      ILE  38 -11.118  -1.997   3.592
  297   1HD1  ILE  38          HD11      ILE  38 -11.614  -0.892   5.215
  298   2HD1  ILE  38          HD13      ILE  38 -11.824  -0.821   6.965
  299   3HD1  ILE  38          HD12      ILE  38 -10.417  -0.069   6.215
  300    H    MET  39           HN       MET  39  -8.615  -5.671   3.621
  301    HA   MET  39           HA       MET  39  -6.228  -4.774   2.118
  302   1HB   MET  39           HB2      MET  39  -6.577  -7.181   2.884
  303   2HB   MET  39           HB1      MET  39  -7.854  -7.287   1.672
  304   1HG   MET  39           HG2      MET  39  -6.155  -6.517  -0.043
  305   2HG   MET  39           HG1      MET  39  -4.918  -6.717   1.199
  306   1HE   MET  39           HE1      MET  39  -7.804  -8.030  -0.573
  307   2HE   MET  39           HE3      MET  39  -7.471  -9.717  -0.987
  308   3HE   MET  39           HE2      MET  39  -8.159  -9.312   0.583
  309    H    VAL  40           HN       VAL  40  -6.715  -3.266   0.582
  310    HA   VAL  40           HA       VAL  40  -9.256  -3.496  -0.933
  311    HB   VAL  40           HB       VAL  40  -7.134  -1.333  -1.068
  312   1HG1  VAL  40          HG12      VAL  40 -10.018  -1.477  -1.996
  313   2HG1  VAL  40          HG11      VAL  40  -9.035  -0.013  -2.013
  314   3HG1  VAL  40          HG13      VAL  40  -8.588  -1.387  -3.024
  315   1HG2  VAL  40          HG21      VAL  40  -9.585  -1.674   0.667
  316   2HG2  VAL  40          HG23      VAL  40  -7.942  -1.273   1.164
  317   3HG2  VAL  40          HG22      VAL  40  -8.920  -0.079   0.312
  318    H    VAL  41           HN       VAL  41  -9.247  -4.529  -2.859
  319    HA   VAL  41           HA       VAL  41  -6.766  -4.449  -4.513
  320    HB   VAL  41           HB       VAL  41  -7.185  -6.846  -5.123
  321   1HG1  VAL  41          HG11      VAL  41  -6.651  -6.115  -2.235
  322   2HG1  VAL  41          HG13      VAL  41  -6.447  -7.753  -2.855
  323   3HG1  VAL  41          HG12      VAL  41  -5.470  -6.435  -3.504
  324   1HG2  VAL  41          HG23      VAL  41  -9.218  -6.584  -2.886
  325   2HG2  VAL  41          HG22      VAL  41  -9.535  -7.030  -4.563
  326   3HG2  VAL  41          HG21      VAL  41  -8.645  -8.131  -3.511
  327    H    GLY  42           HN       GLY  42  -7.242  -4.992  -6.827
  328   1HA   GLY  42           HA2      GLY  42  -9.815  -3.775  -7.622
  329   2HA   GLY  42           HA1      GLY  42  -8.455  -4.113  -8.695
  330    H    ARG  43           HN       ARG  43 -10.221  -5.041 -10.084
  331    HA   ARG  43           HA       ARG  43 -11.447  -7.553  -9.193
  332   1HB   ARG  43           HB2      ARG  43 -12.312  -7.625 -11.548
  333   2HB   ARG  43           HB1      ARG  43 -12.715  -6.128 -10.705
  334   1HG   ARG  43           HG2      ARG  43 -10.652  -5.096 -11.744
  335   2HG   ARG  43           HG1      ARG  43 -10.502  -6.552 -12.729
  336   1HD   ARG  43           HD2      ARG  43 -12.901  -6.141 -13.481
  337   2HD   ARG  43           HD1      ARG  43 -12.775  -4.556 -12.718
  338    HE   ARG  43           HE       ARG  43 -10.566  -4.594 -14.339
  339   1HH1  ARG  43          HH21      ARG  43 -13.922  -5.330 -14.859
  340   2HH1  ARG  43          HH22      ARG  43 -13.891  -4.852 -16.524
  341   1HH2  ARG  43          HH11      ARG  43 -10.539  -3.978 -16.500
  342   2HH2  ARG  43          HH12      ARG  43 -11.985  -4.091 -17.448
  343    H    ARG  44           HN       ARG  44  -8.823  -6.546 -11.358
  344    HA   ARG  44           HA       ARG  44  -8.250  -9.173 -12.386
  345   1HB   ARG  44           HB2      ARG  44  -6.036  -8.162 -13.000
  346   2HB   ARG  44           HB1      ARG  44  -7.414  -7.203 -13.542
  347   1HG   ARG  44           HG2      ARG  44  -7.182  -5.729 -11.592
  348   2HG   ARG  44           HG1      ARG  44  -5.835  -6.703 -11.001
  349   1HD   ARG  44           HD2      ARG  44  -4.876  -4.816 -12.139
  350   2HD   ARG  44           HD1      ARG  44  -4.656  -6.212 -13.195
  351    HE   ARG  44           HE       ARG  44  -6.518  -3.959 -13.664
  352   1HH1  ARG  44          HH11      ARG  44  -5.325  -7.096 -14.562
  353   2HH1  ARG  44          HH12      ARG  44  -5.984  -7.019 -16.163
  354   1HH2  ARG  44          HH21      ARG  44  -7.367  -3.871 -15.742
  355   2HH2  ARG  44          HH22      ARG  44  -7.134  -5.201 -16.826
  356    H    THR  45           HN       THR  45  -7.223  -7.401  -9.516
  357    HA   THR  45           HA       THR  45  -5.188  -9.368  -8.779
  358    HB   THR  45           HB       THR  45  -6.454  -7.328  -6.942
  359    HG1  THR  45           HG1      THR  45  -5.135  -5.822  -7.800
  360   1HG2  THR  45          HG22      THR  45  -3.746  -8.671  -7.114
  361   2HG2  THR  45          HG21      THR  45  -4.106  -7.333  -6.024
  362   3HG2  THR  45          HG23      THR  45  -4.955  -8.869  -5.846
  363    H    TYR  46           HN       TYR  46  -8.595  -8.858  -8.178
  364    HA   TYR  46           HA       TYR  46  -8.859 -10.527  -5.858
  365   1HB   TYR  46           HB2      TYR  46 -10.571  -8.881  -6.914
  366   2HB   TYR  46           HB1      TYR  46 -11.006 -10.237  -7.954
  367    HD1  TYR  46           HD2      TYR  46 -10.383  -9.486  -4.328
  368    HD2  TYR  46           HD1      TYR  46 -12.646 -11.720  -7.216
  369    HE1  TYR  46           HE2      TYR  46 -11.766 -10.444  -2.505
  370    HE2  TYR  46           HE1      TYR  46 -14.029 -12.677  -5.393
  371    HH   TYR  46           HH       TYR  46 -13.776 -11.521  -2.096
  372    H    GLU  47           HN       GLU  47  -9.650 -11.253  -9.280
  373    HA   GLU  47           HA       GLU  47  -9.993 -14.067  -8.845
  374   1HB   GLU  47           HB2      GLU  47  -9.334 -12.495 -11.353
  375   2HB   GLU  47           HB1      GLU  47  -9.731 -14.215 -11.345
  376   1HG   GLU  47           HG2      GLU  47 -11.894 -13.641 -10.198
  377   2HG   GLU  47           HG1      GLU  47 -11.507 -11.936 -10.431
  378    H    SER  48           HN       SER  48  -7.182 -12.068  -9.393
  379    HA   SER  48           HA       SER  48  -5.358 -14.083 -10.278
  380   1HB   SER  48           HB2      SER  48  -4.827 -11.679 -10.379
  381   2HB   SER  48           HB1      SER  48  -4.823 -11.598  -8.619
  382    HG   SER  48           HG       SER  48  -3.234 -13.542  -9.826
  383    H    PHE  49           HN       PHE  49  -6.768 -13.438  -7.178
  384    HA   PHE  49           HA       PHE  49  -4.784 -14.606  -5.484
  385   1HB   PHE  49           HB2      PHE  49  -7.782 -14.304  -5.232
  386   2HB   PHE  49           HB1      PHE  49  -6.809 -15.053  -3.966
  387    HD1  PHE  49           HD1      PHE  49  -4.424 -13.581  -3.704
  388    HD2  PHE  49           HD2      PHE  49  -8.320 -12.095  -4.734
  389    HE1  PHE  49           HE1      PHE  49  -3.791 -11.336  -2.862
  390    HE2  PHE  49           HE2      PHE  49  -7.687  -9.850  -3.892
  391    HZ   PHE  49           HZ       PHE  49  -5.422  -9.470  -2.957
  392    HA   PRO  50           HA       PRO  50  -5.280 -18.961  -6.245
  393   1HB   PRO  50           HB2      PRO  50  -4.689 -19.887  -3.670
  394   2HB   PRO  50           HB1      PRO  50  -3.509 -19.495  -4.926
  395   1HG   PRO  50           HG2      PRO  50  -3.992 -18.120  -2.461
  396   2HG   PRO  50           HG1      PRO  50  -2.792 -17.751  -3.708
  397   1HD   PRO  50           HD2      PRO  50  -5.343 -16.432  -3.164
  398   2HD   PRO  50           HD1      PRO  50  -3.994 -15.887  -4.174
  399    H    LYS  51           HN       LYS  51  -6.353 -18.636  -2.850
  400    HA   LYS  51           HA       LYS  51  -8.922 -19.946  -3.654
  401   1HB   LYS  51           HB2      LYS  51  -8.991 -20.757  -1.266
  402   2HB   LYS  51           HB1      LYS  51  -7.659 -21.422  -2.211
  403   1HG   LYS  51           HG2      LYS  51  -6.071 -20.323  -0.994
  404   2HG   LYS  51           HG1      LYS  51  -7.067 -18.879  -0.812
  405   1HD   LYS  51           HD2      LYS  51  -8.339 -19.875   0.963
  406   2HD   LYS  51           HD1      LYS  51  -7.634 -21.463   0.658
  407   1HE   LYS  51           HE2      LYS  51  -6.382 -20.714   2.490
  408   2HE   LYS  51           HE1      LYS  51  -5.359 -20.257   1.128
  409   1HZ   LYS  51           HZ1      LYS  51  -7.377 -18.415   2.261
  410   2HZ   LYS  51           HZ3      LYS  51  -5.798 -18.498   2.875
  411   3HZ   LYS  51           HZ2      LYS  51  -6.057 -18.044   1.258
  412    H    ARG  52           HN       ARG  52  -9.615 -17.663  -4.097
  413    HA   ARG  52           HA       ARG  52  -9.897 -15.835  -1.837
  414   1HB   ARG  52           HB2      ARG  52 -11.260 -14.495  -3.460
  415   2HB   ARG  52           HB1      ARG  52  -9.659 -14.908  -4.074
  416   1HG   ARG  52           HG2      ARG  52 -10.535 -16.664  -5.445
  417   2HG   ARG  52           HG1      ARG  52 -12.110 -16.582  -4.656
  418   1HD   ARG  52           HD2      ARG  52 -12.601 -14.461  -5.635
  419   2HD   ARG  52           HD1      ARG  52 -10.932 -14.238  -6.158
  420    HE   ARG  52           HE       ARG  52 -11.419 -15.538  -8.060
  421   1HH1  ARG  52          HH11      ARG  52 -13.784 -16.070  -5.572
  422   2HH1  ARG  52          HH12      ARG  52 -14.791 -17.059  -6.575
  423   1HH2  ARG  52          HH21      ARG  52 -12.734 -16.823  -9.353
  424   2HH2  ARG  52          HH22      ARG  52 -14.198 -17.483  -8.705
  425    HA   PRO  53           HA       PRO  53 -11.409 -14.095  -1.488
  426   1HB   PRO  53           HB2      PRO  53 -12.854 -13.550   0.850
  427   2HB   PRO  53           HB1      PRO  53 -13.320 -13.085  -0.792
  428   1HG   PRO  53           HG2      PRO  53 -14.576 -14.998   0.927
  429   2HG   PRO  53           HG1      PRO  53 -15.049 -14.513  -0.708
  430   1HD   PRO  53           HD2      PRO  53 -13.664 -16.935   0.164
  431   2HD   PRO  53           HD1      PRO  53 -14.438 -16.586  -1.391
  432    H    LEU  54           HN       LEU  54 -10.219 -13.077   0.402
  433    HA   LEU  54           HA       LEU  54  -8.735 -15.172   1.852
  434   1HB   LEU  54           HB2      LEU  54  -8.302 -12.173   1.768
  435   2HB   LEU  54           HB1      LEU  54  -7.184 -13.366   2.431
  436    HG   LEU  54           HG       LEU  54  -8.132 -13.402  -0.444
  437   1HD1  LEU  54          HD13      LEU  54  -6.761 -11.336   0.329
  438   2HD1  LEU  54          HD12      LEU  54  -5.418 -12.469   0.482
  439   3HD1  LEU  54          HD11      LEU  54  -6.192 -12.224  -1.084
  440   1HD2  LEU  54          HD23      LEU  54  -5.984 -14.838   1.134
  441   2HD2  LEU  54          HD22      LEU  54  -7.328 -15.549   0.240
  442   3HD2  LEU  54          HD21      LEU  54  -5.991 -14.795  -0.628
  443    HA   PRO  55           HA       PRO  55 -11.334 -14.252   5.463
  444   1HB   PRO  55           HB2      PRO  55 -10.287 -16.395   6.941
  445   2HB   PRO  55           HB1      PRO  55 -11.739 -16.434   5.933
  446   1HG   PRO  55           HG2      PRO  55  -9.245 -17.759   5.488
  447   2HG   PRO  55           HG1      PRO  55 -10.705 -17.805   4.489
  448   1HD   PRO  55           HD2      PRO  55  -8.226 -16.321   4.054
  449   2HD   PRO  55           HD1      PRO  55  -9.557 -16.636   2.927
  450    H    GLU  56           HN       GLU  56 -10.756 -14.120   7.927
  451    HA   GLU  56           HA       GLU  56  -9.469 -13.108   9.603
  452   1HB   GLU  56           HB2      GLU  56  -7.092 -14.044   7.966
  453   2HB   GLU  56           HB1      GLU  56  -7.105 -13.638   9.682
  454   1HG   GLU  56           HG2      GLU  56  -8.840 -15.826   8.520
  455   2HG   GLU  56           HG1      GLU  56  -7.214 -16.129   9.134
  456    H    ARG  57           HN       ARG  57 -10.222 -11.659   7.084
  457    HA   ARG  57           HA       ARG  57  -8.933  -9.172   7.636
  458   1HB   ARG  57           HB2      ARG  57  -7.610  -8.939   5.534
  459   2HB   ARG  57           HB1      ARG  57  -6.964 -10.189   6.598
  460   1HG   ARG  57           HG2      ARG  57  -8.529 -11.784   5.219
  461   2HG   ARG  57           HG1      ARG  57  -8.470 -10.497   4.016
  462   1HD   ARG  57           HD2      ARG  57  -6.611 -11.686   3.352
  463   2HD   ARG  57           HD1      ARG  57  -5.853 -10.640   4.553
  464    HE   ARG  57           HE       ARG  57  -6.677 -12.853   6.012
  465   1HH1  ARG  57          HH21      ARG  57  -4.732 -12.322   3.183
  466   2HH1  ARG  57          HH22      ARG  57  -3.731 -13.707   3.465
  467   1HH2  ARG  57          HH11      ARG  57  -5.371 -14.648   6.367
  468   2HH2  ARG  57          HH12      ARG  57  -4.093 -15.017   5.260
  469    H    THR  58           HN       THR  58  -9.770  -7.461   6.261
  470    HA   THR  58           HA       THR  58 -12.413  -8.067   5.198
  471    HB   THR  58           HB       THR  58 -10.904  -5.464   4.889
  472    HG1  THR  58           HG1      THR  58 -12.630  -5.866   7.021
  473   1HG2  THR  58          HG22      THR  58 -13.118  -5.886   3.708
  474   2HG2  THR  58          HG21      THR  58 -13.852  -5.984   5.308
  475   3HG2  THR  58          HG23      THR  58 -13.083  -4.487   4.781
  476    H    ASN  59           HN       ASN  59 -13.055  -8.023   3.024
  477    HA   ASN  59           HA       ASN  59 -10.831  -7.944   1.020
  478   1HB   ASN  59           HB2      ASN  59 -13.364  -9.614   0.924
  479   2HB   ASN  59           HB1      ASN  59 -12.072  -9.618  -0.276
  480   1HD2  ASN  59          HD22      ASN  59  -9.754 -11.083   2.257
  481   2HD2  ASN  59          HD21      ASN  59  -9.775  -9.668   1.321
  482    H    VAL  60           HN       VAL  60 -11.136  -5.812   0.332
  483    HA   VAL  60           HA       VAL  60 -13.868  -5.016  -0.543
  484    HB   VAL  60           HB       VAL  60 -11.358  -3.326  -0.350
  485   1HG1  VAL  60          HG13      VAL  60 -14.299  -2.664  -0.676
  486   2HG1  VAL  60          HG12      VAL  60 -13.045  -1.468  -0.346
  487   3HG1  VAL  60          HG11      VAL  60 -13.018  -2.383  -1.854
  488   1HG2  VAL  60          HG22      VAL  60 -13.575  -3.911   1.620
  489   2HG2  VAL  60          HG21      VAL  60 -11.832  -4.006   1.878
  490   3HG2  VAL  60          HG23      VAL  60 -12.616  -2.434   1.717
  491    H    VAL  61           HN       VAL  61 -14.197  -4.218  -2.696
  492    HA   VAL  61           HA       VAL  61 -11.996  -4.740  -4.636
  493    HB   VAL  61           HB       VAL  61 -14.855  -5.677  -5.018
  494   1HG1  VAL  61          HG12      VAL  61 -12.310  -5.918  -6.637
  495   2HG1  VAL  61          HG11      VAL  61 -13.711  -6.955  -6.912
  496   3HG1  VAL  61          HG13      VAL  61 -13.847  -5.210  -7.136
  497   1HG2  VAL  61          HG22      VAL  61 -12.363  -7.059  -4.043
  498   2HG2  VAL  61          HG21      VAL  61 -14.009  -7.173  -3.419
  499   3HG2  VAL  61          HG23      VAL  61 -13.584  -7.967  -4.935
  500    H    LEU  62           HN       LEU  62 -11.723  -2.910  -5.801
  501    HA   LEU  62           HA       LEU  62 -13.971  -0.978  -6.000
  502   1HB   LEU  62           HB2      LEU  62 -11.627  -0.285  -5.263
  503   2HB   LEU  62           HB1      LEU  62 -11.115  -0.584  -6.924
  504    HG   LEU  62           HG       LEU  62 -13.001   0.980  -7.643
  505   1HD1  LEU  62          HD12      LEU  62 -13.028   1.351  -4.652
  506   2HD1  LEU  62          HD11      LEU  62 -13.517   2.661  -5.727
  507   3HD1  LEU  62          HD13      LEU  62 -14.393   1.131  -5.749
  508   1HD2  LEU  62          HD21      LEU  62 -10.511   1.548  -7.432
  509   2HD2  LEU  62          HD23      LEU  62 -11.624   2.915  -7.380
  510   3HD2  LEU  62          HD22      LEU  62 -10.917   2.297  -5.888
  511    H    THR  63           HN       THR  63 -15.217  -1.104  -7.792
  512    HA   THR  63           HA       THR  63 -13.945  -1.455 -10.433
  513    HB   THR  63           HB       THR  63 -14.416  -3.764  -9.824
  514    HG1  THR  63           HG1      THR  63 -16.495  -3.807 -11.356
  515   1HG2  THR  63          HG21      THR  63 -16.110  -3.190  -8.067
  516   2HG2  THR  63          HG23      THR  63 -17.273  -2.871  -9.354
  517   3HG2  THR  63          HG22      THR  63 -16.624  -4.496  -9.134
  518    H    HIS  64           HN       HIS  64 -15.163  -0.492 -12.080
  519    HA   HIS  64           HA       HIS  64 -17.539   1.050 -11.150
  520   1HB   HIS  64           HB2      HIS  64 -17.129   2.419 -13.215
  521   2HB   HIS  64           HB1      HIS  64 -15.776   2.437 -12.085
  522    HD1  HIS  64           HD1      HIS  64 -13.560   1.890 -13.085
  523    HD2  HIS  64           HD2      HIS  64 -16.687   0.305 -15.340
  524    HE1  HIS  64           HE1      HIS  64 -12.502   0.812 -15.119
  525    H    GLN  65           HN       GLN  65 -17.627  -1.803 -11.907
  526    HA   GLN  65           HA       GLN  65 -19.484  -1.574 -14.243
  527   1HB   GLN  65           HB2      GLN  65 -17.610  -3.846 -13.516
  528   2HB   GLN  65           HB1      GLN  65 -18.851  -3.948 -14.767
  529   1HG   GLN  65           HG2      GLN  65 -16.869  -1.689 -14.821
  530   2HG   GLN  65           HG1      GLN  65 -16.404  -3.275 -15.439
  531   1HE2  GLN  65          HE22      GLN  65 -17.907  -2.477 -18.519
  532   2HE2  GLN  65          HE21      GLN  65 -16.550  -3.077 -17.693
  533    H    GLU  66           HN       GLU  66 -21.524  -2.326 -13.866
  534    HA   GLU  66           HA       GLU  66 -22.141  -3.387 -11.185
  535   1HB   GLU  66           HB2      GLU  66 -23.799  -2.444 -13.523
  536   2HB   GLU  66           HB1      GLU  66 -24.537  -3.296 -12.167
  537   1HG   GLU  66           HG2      GLU  66 -23.827  -1.619 -10.610
  538   2HG   GLU  66           HG1      GLU  66 -22.773  -0.863 -11.806
  539    H    ASP  67           HN       ASP  67 -20.636  -5.047 -13.126
  540    HA   ASP  67           HA       ASP  67 -22.603  -7.281 -13.450
  541   1HB   ASP  67           HB2      ASP  67 -21.503  -6.257 -15.551
  542   2HB   ASP  67           HB1      ASP  67 -20.018  -7.027 -14.991
  543    H    TYR  68           HN       TYR  68 -19.422  -6.309 -12.316
  544    HA   TYR  68           HA       TYR  68 -18.424  -8.935 -11.705
  545   1HB   TYR  68           HB2      TYR  68 -17.156  -6.667 -11.790
  546   2HB   TYR  68           HB1      TYR  68 -17.710  -6.468 -10.127
  547    HD1  TYR  68           HD1      TYR  68 -15.675  -8.561 -12.405
  548    HD2  TYR  68           HD2      TYR  68 -16.825  -7.819  -8.334
  549    HE1  TYR  68           HE1      TYR  68 -13.855 -10.050 -11.619
  550    HE2  TYR  68           HE2      TYR  68 -15.005  -9.310  -7.547
  551    HH   TYR  68           HH       TYR  68 -12.606 -10.602  -9.760
  552    H    GLN  69           HN       GLN  69 -18.596 -10.148  -9.813
  553    HA   GLN  69           HA       GLN  69 -20.280  -9.047  -7.614
  554   1HB   GLN  69           HB2      GLN  69 -20.694 -11.665  -9.079
  555   2HB   GLN  69           HB1      GLN  69 -21.411 -11.320  -7.504
  556   1HG   GLN  69           HG2      GLN  69 -21.760  -9.373  -9.769
  557   2HG   GLN  69           HG1      GLN  69 -22.793 -10.799  -9.664
  558   1HE2  GLN  69          HE22      GLN  69 -24.031  -7.760  -7.594
  559   2HE2  GLN  69          HE21      GLN  69 -23.271  -7.764  -9.113
  560    H    ALA  70           HN       ALA  70 -19.673  -9.782  -5.570
  561    HA   ALA  70           HA       ALA  70 -17.548 -11.868  -5.431
  562   1HB   ALA  70           HB3      ALA  70 -16.619  -9.472  -5.378
  563   2HB   ALA  70           HB2      ALA  70 -17.411  -9.321  -3.809
  564   3HB   ALA  70           HB1      ALA  70 -16.149 -10.529  -4.047
  565    H    GLN  71           HN       GLN  71 -18.313 -13.415  -4.089
  566    HA   GLN  71           HA       GLN  71 -20.434 -12.801  -2.149
  567   1HB   GLN  71           HB2      GLN  71 -18.993 -15.363  -2.885
  568   2HB   GLN  71           HB1      GLN  71 -20.262 -15.276  -1.664
  569   1HG   GLN  71           HG2      GLN  71 -20.674 -14.253  -4.478
  570   2HG   GLN  71           HG1      GLN  71 -21.002 -15.928  -4.034
  571   1HE2  GLN  71          HE22      GLN  71 -23.948 -15.154  -2.202
  572   2HE2  GLN  71          HE21      GLN  71 -22.788 -16.346  -2.546
  573    H    GLY  72           HN       GLY  72 -19.990 -12.176  -0.102
  574   1HA   GLY  72           HA2      GLY  72 -18.944 -12.186   2.022
  575   2HA   GLY  72           HA1      GLY  72 -17.804 -13.389   1.416
  576    H    ALA  73           HN       ALA  73 -18.534 -10.181   0.066
  577    HA   ALA  73           HA       ALA  73 -15.990  -9.072   1.017
  578   1HB   ALA  73           HB3      ALA  73 -16.444  -9.797  -1.884
  579   2HB   ALA  73           HB2      ALA  73 -15.269  -8.577  -1.390
  580   3HB   ALA  73           HB1      ALA  73 -15.084 -10.248  -0.855
  581    H    VAL  74           HN       VAL  74 -15.978  -6.804   0.867
  582    HA   VAL  74           HA       VAL  74 -18.591  -5.571   0.355
  583    HB   VAL  74           HB       VAL  74 -15.972  -4.251   1.130
  584   1HG1  VAL  74          HG12      VAL  74 -18.866  -3.380   1.414
  585   2HG1  VAL  74          HG11      VAL  74 -17.462  -2.478   1.989
  586   3HG1  VAL  74          HG13      VAL  74 -17.705  -2.723   0.260
  587   1HG2  VAL  74          HG22      VAL  74 -18.210  -5.394   2.831
  588   2HG2  VAL  74          HG21      VAL  74 -16.538  -5.953   2.779
  589   3HG2  VAL  74          HG23      VAL  74 -16.917  -4.367   3.450
  590    H    VAL  75           HN       VAL  75 -18.936  -5.574  -1.876
  591    HA   VAL  75           HA       VAL  75 -16.867  -4.758  -3.759
  592    HB   VAL  75           HB       VAL  75 -19.857  -4.992  -4.209
  593   1HG1  VAL  75          HG12      VAL  75 -18.368  -3.789  -5.915
  594   2HG1  VAL  75          HG11      VAL  75 -17.594  -5.351  -6.183
  595   3HG1  VAL  75          HG13      VAL  75 -19.312  -5.148  -6.526
  596   1HG2  VAL  75          HG22      VAL  75 -17.636  -7.050  -4.381
  597   2HG2  VAL  75          HG21      VAL  75 -19.049  -7.098  -3.327
  598   3HG2  VAL  75          HG23      VAL  75 -19.243  -7.283  -5.070
  599    H    VAL  76           HN       VAL  76 -16.212  -2.646  -3.413
  600    HA   VAL  76           HA       VAL  76 -18.245  -0.530  -3.044
  601    HB   VAL  76           HB       VAL  76 -16.237   0.955  -2.803
  602   1HG1  VAL  76          HG12      VAL  76 -16.480  -1.550  -1.127
  603   2HG1  VAL  76          HG11      VAL  76 -15.377  -0.242  -0.703
  604   3HG1  VAL  76          HG13      VAL  76 -17.113   0.059  -0.776
  605   1HG2  VAL  76          HG23      VAL  76 -14.793  -1.680  -3.229
  606   2HG2  VAL  76          HG22      VAL  76 -14.673  -0.235  -4.233
  607   3HG2  VAL  76          HG21      VAL  76 -14.025  -0.226  -2.592
  608    H    HIS  77           HN       HIS  77 -18.367   1.296  -4.497
  609    HA   HIS  77           HA       HIS  77 -17.136   0.873  -7.182
  610   1HB   HIS  77           HB2      HIS  77 -20.042   1.566  -6.649
  611   2HB   HIS  77           HB1      HIS  77 -19.284   1.499  -8.240
  612    HD1  HIS  77           HD1      HIS  77 -18.692  -0.838  -9.195
  613    HD2  HIS  77           HD2      HIS  77 -20.515  -0.980  -5.449
  614    HE1  HIS  77           HE1      HIS  77 -19.330  -3.256  -8.801
  615    H    ASP  78           HN       ASP  78 -16.530   2.702  -4.926
  616    HA   ASP  78           HA       ASP  78 -16.299   5.154  -6.459
  617   1HB   ASP  78           HB2      ASP  78 -18.714   5.134  -5.528
  618   2HB   ASP  78           HB1      ASP  78 -17.963   5.392  -3.951
  619    H    VAL  79           HN       VAL  79 -14.793   6.584  -5.486
  620    HA   VAL  79           HA       VAL  79 -12.952   5.381  -3.622
  621    HB   VAL  79           HB       VAL  79 -13.164   8.300  -4.414
  622   1HG1  VAL  79          HG12      VAL  79 -11.690   7.711  -2.464
  623   2HG1  VAL  79          HG11      VAL  79 -10.776   6.652  -3.537
  624   3HG1  VAL  79          HG13      VAL  79 -10.811   8.389  -3.835
  625   1HG2  VAL  79          HG21      VAL  79 -11.829   5.935  -5.756
  626   2HG2  VAL  79          HG23      VAL  79 -13.034   7.022  -6.445
  627   3HG2  VAL  79          HG22      VAL  79 -11.402   7.607  -6.118
  628    H    ALA  80           HN       ALA  80 -15.611   7.674  -3.307
  629    HA   ALA  80           HA       ALA  80 -15.023   8.485  -0.602
  630   1HB   ALA  80           HB1      ALA  80 -16.555   9.711  -2.179
  631   2HB   ALA  80           HB3      ALA  80 -17.729   8.412  -1.968
  632   3HB   ALA  80           HB2      ALA  80 -17.263   9.412  -0.592
  633    H    ALA  81           HN       ALA  81 -16.810   5.802  -2.028
  634    HA   ALA  81           HA       ALA  81 -18.102   4.925   0.389
  635   1HB   ALA  81           HB1      ALA  81 -17.326   3.421  -2.126
  636   2HB   ALA  81           HB3      ALA  81 -18.328   2.746  -0.841
  637   3HB   ALA  81           HB2      ALA  81 -18.897   4.136  -1.766
  638    H    VAL  82           HN       VAL  82 -14.955   4.252  -1.079
  639    HA   VAL  82           HA       VAL  82 -14.227   2.133   0.745
  640    HB   VAL  82           HB       VAL  82 -12.393   4.000  -0.791
  641   1HG1  VAL  82          HG13      VAL  82 -11.327   2.604   0.972
  642   2HG1  VAL  82          HG12      VAL  82 -12.005   1.163   0.216
  643   3HG1  VAL  82          HG11      VAL  82 -10.812   2.133  -0.647
  644   1HG2  VAL  82          HG21      VAL  82 -14.024   1.613  -1.603
  645   2HG2  VAL  82          HG23      VAL  82 -13.700   3.098  -2.498
  646   3HG2  VAL  82          HG22      VAL  82 -12.447   1.865  -2.351
  647    H    PHE  83           HN       PHE  83 -13.721   5.648   0.718
  648    HA   PHE  83           HA       PHE  83 -12.126   5.630   3.159
  649   1HB   PHE  83           HB2      PHE  83 -13.427   7.787   1.497
  650   2HB   PHE  83           HB1      PHE  83 -12.677   8.159   3.048
  651    HD1  PHE  83           HD2      PHE  83 -10.285   6.844   3.333
  652    HD2  PHE  83           HD1      PHE  83 -12.071   8.113  -0.362
  653    HE1  PHE  83           HE2      PHE  83  -8.051   6.847   2.255
  654    HE2  PHE  83           HE1      PHE  83  -9.838   8.114  -1.440
  655    HZ   PHE  83           HZ       PHE  83  -7.828   7.482  -0.132
  656    H    ALA  84           HN       ALA  84 -15.529   5.993   2.340
  657    HA   ALA  84           HA       ALA  84 -16.405   7.011   4.884
  658   1HB   ALA  84           HB1      ALA  84 -17.902   5.382   2.808
  659   2HB   ALA  84           HB3      ALA  84 -18.651   6.240   4.155
  660   3HB   ALA  84           HB2      ALA  84 -17.824   7.142   2.885
  661    H    TYR  85           HN       TYR  85 -15.867   3.756   3.619
  662    HA   TYR  85           HA       TYR  85 -17.059   2.391   5.884
  663   1HB   TYR  85           HB2      TYR  85 -16.610   1.441   3.533
  664   2HB   TYR  85           HB1      TYR  85 -14.940   1.244   4.063
  665    HD1  TYR  85           HD1      TYR  85 -18.444   0.215   4.669
  666    HD2  TYR  85           HD2      TYR  85 -14.322  -0.429   5.689
  667    HE1  TYR  85           HE1      TYR  85 -19.062  -1.881   5.842
  668    HE2  TYR  85           HE2      TYR  85 -14.939  -2.525   6.862
  669    HH   TYR  85           HH       TYR  85 -18.268  -3.395   7.437
  670    H    ALA  86           HN       ALA  86 -13.829   3.552   5.076
  671    HA   ALA  86           HA       ALA  86 -12.457   2.201   7.226
  672   1HB   ALA  86           HB3      ALA  86 -11.739   4.739   5.724
  673   2HB   ALA  86           HB2      ALA  86 -10.647   3.841   6.779
  674   3HB   ALA  86           HB1      ALA  86 -11.241   3.104   5.291
  675    H    LYS  87           HN       LYS  87 -14.249   5.211   6.972
  676    HA   LYS  87           HA       LYS  87 -13.319   6.401   9.420
  677   1HB   LYS  87           HB2      LYS  87 -15.778   6.768   7.710
  678   2HB   LYS  87           HB1      LYS  87 -15.597   7.630   9.239
  679   1HG   LYS  87           HG2      LYS  87 -13.433   8.547   8.457
  680   2HG   LYS  87           HG1      LYS  87 -13.648   7.713   6.917
  681   1HD   LYS  87           HD2      LYS  87 -15.556   9.030   6.355
  682   2HD   LYS  87           HD1      LYS  87 -15.693   9.661   7.996
  683   1HE   LYS  87           HE2      LYS  87 -13.299  10.163   6.210
  684   2HE   LYS  87           HE1      LYS  87 -14.662  11.274   6.347
  685   1HZ   LYS  87           HZ3      LYS  87 -13.203  10.322   8.733
  686   2HZ   LYS  87           HZ2      LYS  87 -12.663  11.667   7.846
  687   3HZ   LYS  87           HZ1      LYS  87 -14.198  11.687   8.574
  688    H    GLN  88           HN       GLN  88 -16.087   4.300   8.644
  689    HA   GLN  88           HA       GLN  88 -17.214   4.304  11.288
  690   1HB   GLN  88           HB2      GLN  88 -17.415   2.379   8.964
  691   2HB   GLN  88           HB1      GLN  88 -18.278   2.118  10.480
  692   1HG   GLN  88           HG2      GLN  88 -19.273   4.417  10.224
  693   2HG   GLN  88           HG1      GLN  88 -18.541   4.496   8.620
  694   1HE2  GLN  88          HE22      GLN  88 -20.637   1.606   7.539
  695   2HE2  GLN  88          HE21      GLN  88 -18.971   1.921   7.631
  696    H    HIS  89           HN       HIS  89 -14.595   2.527   9.793
  697    HA   HIS  89           HA       HIS  89 -14.243   1.000  12.345
  698   1HB   HIS  89           HB2      HIS  89 -13.662   0.235   9.479
  699   2HB   HIS  89           HB1      HIS  89 -12.918  -0.609  10.836
  700    HD1  HIS  89           HD1      HIS  89 -14.189  -2.693  11.312
  701    HD2  HIS  89           HD2      HIS  89 -16.732   0.425  10.219
  702    HE1  HIS  89           HE1      HIS  89 -16.547  -3.606  11.463
  703    HA   PRO  90           HA       PRO  90 -10.558   3.746  12.046
  704   1HB   PRO  90           HB2      PRO  90 -10.542   4.197  14.811
  705   2HB   PRO  90           HB1      PRO  90 -11.237   5.269  13.588
  706   1HG   PRO  90           HG2      PRO  90 -12.607   3.736  15.579
  707   2HG   PRO  90           HG1      PRO  90 -13.296   4.825  14.367
  708   1HD   PRO  90           HD2      PRO  90 -13.215   1.903  14.380
  709   2HD   PRO  90           HD1      PRO  90 -14.172   2.993  13.363
  710    H    ASP  91           HN       ASP  91 -11.351   0.962  13.981
  711    HA   ASP  91           HA       ASP  91  -8.754   0.530  15.158
  712   1HB   ASP  91           HB2      ASP  91 -10.979  -0.562  15.824
  713   2HB   ASP  91           HB1      ASP  91 -10.740  -1.638  14.446
  714    H    GLN  92           HN       GLN  92 -10.133  -0.132  12.017
  715    HA   GLN  92           HA       GLN  92  -7.799  -1.812  11.268
  716   1HB   GLN  92           HB2      GLN  92 -10.325  -1.118   9.735
  717   2HB   GLN  92           HB1      GLN  92  -9.063  -2.216   9.172
  718   1HG   GLN  92           HG2      GLN  92  -9.438  -3.598  11.239
  719   2HG   GLN  92           HG1      GLN  92 -10.815  -2.563  11.622
  720   1HE2  GLN  92          HE22      GLN  92 -11.142  -4.798   8.175
  721   2HE2  GLN  92          HE21      GLN  92  -9.643  -4.104   8.566
  722    H    GLU  93           HN       GLU  93  -7.159  -1.267   8.801
  723    HA   GLU  93           HA       GLU  93  -6.942   1.683   8.463
  724   1HB   GLU  93           HB2      GLU  93  -4.671  -0.298   8.650
  725   2HB   GLU  93           HB1      GLU  93  -4.488   1.230   7.787
  726   1HG   GLU  93           HG2      GLU  93  -5.495   1.075  10.635
  727   2HG   GLU  93           HG1      GLU  93  -3.787   1.268  10.236
  728    H    LEU  94           HN       LEU  94  -6.111   2.213   6.222
  729    HA   LEU  94           HA       LEU  94  -7.315   0.319   4.277
  730   1HB   LEU  94           HB2      LEU  94  -7.858   2.851   4.391
  731   2HB   LEU  94           HB1      LEU  94  -6.277   3.079   3.641
  732    HG   LEU  94           HG       LEU  94  -7.056   1.357   1.890
  733   1HD1  LEU  94          HD12      LEU  94  -9.668   2.051   3.257
  734   2HD1  LEU  94          HD11      LEU  94  -9.581   1.371   1.632
  735   3HD1  LEU  94          HD13      LEU  94  -8.981   0.446   3.006
  736   1HD2  LEU  94          HD22      LEU  94  -8.129   4.154   2.213
  737   2HD2  LEU  94          HD21      LEU  94  -6.870   3.572   1.124
  738   3HD2  LEU  94          HD23      LEU  94  -8.561   3.195   0.797
  739    H    VAL  95           HN       VAL  95  -6.043  -0.888   2.954
  740    HA   VAL  95           HA       VAL  95  -3.209  -0.034   2.544
  741    HB   VAL  95           HB       VAL  95  -4.119  -2.888   3.017
  742   1HG1  VAL  95          HG11      VAL  95  -1.421  -1.566   2.643
  743   2HG1  VAL  95          HG13      VAL  95  -1.611  -3.198   3.283
  744   3HG1  VAL  95          HG12      VAL  95  -2.148  -2.825   1.645
  745   1HG2  VAL  95          HG23      VAL  95  -2.844  -0.839   4.845
  746   2HG2  VAL  95          HG22      VAL  95  -4.329  -1.751   5.114
  747   3HG2  VAL  95          HG21      VAL  95  -2.769  -2.572   5.167
  748    H    ILE  96           HN       ILE  96  -2.572  -0.137   0.429
  749    HA   ILE  96           HA       ILE  96  -4.509  -1.306  -1.518
  750    HB   ILE  96           HB       ILE  96  -2.218   0.608  -2.049
  751   1HG1  ILE  96          HG12      ILE  96  -3.880   1.636  -0.535
  752   2HG1  ILE  96          HG11      ILE  96  -3.948   2.372  -2.134
  753   1HG2  ILE  96          HG23      ILE  96  -3.085  -0.785  -3.958
  754   2HG2  ILE  96          HG22      ILE  96  -4.666  -0.047  -3.711
  755   3HG2  ILE  96          HG21      ILE  96  -3.292   0.950  -4.189
  756   1HD1  ILE  96          HD13      ILE  96  -5.844   0.796  -2.688
  757   2HD1  ILE  96          HD12      ILE  96  -5.842   0.293  -0.998
  758   3HD1  ILE  96          HD11      ILE  96  -6.222   1.963  -1.421
  759    H    ALA  97           HN       ALA  97  -3.944  -3.184  -2.490
  760    HA   ALA  97           HA       ALA  97  -1.068  -3.998  -2.415
  761   1HB   ALA  97           HB1      ALA  97  -3.650  -5.507  -2.245
  762   2HB   ALA  97           HB3      ALA  97  -2.255  -6.311  -2.964
  763   3HB   ALA  97           HB2      ALA  97  -2.172  -5.713  -1.307
  764    H    GLY  98           HN       GLY  98  -3.844  -3.452  -4.473
  765   1HA   GLY  98           HA2      GLY  98  -2.504  -2.927  -6.832
  766   2HA   GLY  98           HA1      GLY  98  -2.674  -4.684  -6.842
  767    H    GLY  99           HN       GLY  99  -5.715  -3.513  -8.564
  768   1HA   GLY  99           HA2      GLY  99  -2.930  -4.384  -8.908
  769   2HA   GLY  99           HA1      GLY  99  -4.093  -4.082 -10.201
  770    H    ALA 100           HN       ALA 100  -2.466  -2.832 -11.330
  771    HA   ALA 100           HA       ALA 100  -1.169  -0.540 -10.185
  772   1HB   ALA 100           HB3      ALA 100  -1.727  -1.451 -13.001
  773   2HB   ALA 100           HB2      ALA 100  -1.009   0.131 -12.698
  774   3HB   ALA 100           HB1      ALA 100  -0.178  -1.332 -12.167
  775    H    GLN 101           HN       GLN 101  -4.290  -1.020 -11.740
  776    HA   GLN 101           HA       GLN 101  -4.901   1.788 -12.074
  777   1HB   GLN 101           HB2      GLN 101  -6.019  -0.291 -13.182
  778   2HB   GLN 101           HB1      GLN 101  -6.989  -0.353 -11.709
  779   1HG   GLN 101           HG2      GLN 101  -7.884   1.826 -12.088
  780   2HG   GLN 101           HG1      GLN 101  -6.696   2.174 -13.344
  781   1HE2  GLN 101          HE21      GLN 101  -9.567   0.166 -12.625
  782   2HE2  GLN 101          HE22      GLN 101  -9.966  -0.129 -14.250
  783    H    ILE 102           HN       ILE 102  -5.297  -0.543  -9.466
  784    HA   ILE 102           HA       ILE 102  -7.065   1.112  -7.870
  785    HB   ILE 102           HB       ILE 102  -5.221  -1.107  -6.942
  786   1HG1  ILE 102          HG12      ILE 102  -6.655  -1.871  -8.805
  787   2HG1  ILE 102          HG11      ILE 102  -7.157  -2.604  -7.283
  788   1HG2  ILE 102          HG21      ILE 102  -7.795   0.022  -5.801
  789   2HG2  ILE 102          HG23      ILE 102  -6.895  -1.342  -5.137
  790   3HG2  ILE 102          HG22      ILE 102  -6.179   0.269  -5.140
  791   1HD1  ILE 102          HD11      ILE 102  -8.896  -0.792  -7.068
  792   2HD1  ILE 102          HD13      ILE 102  -8.463  -0.257  -8.691
  793   3HD1  ILE 102          HD12      ILE 102  -9.149  -1.862  -8.445
  794    H    PHE 103           HN       PHE 103  -3.561   0.669  -8.088
  795    HA   PHE 103           HA       PHE 103  -2.846   2.151  -5.748
  796   1HB   PHE 103           HB2      PHE 103  -1.415   1.529  -8.331
  797   2HB   PHE 103           HB1      PHE 103  -0.668   2.539  -7.095
  798    HD1  PHE 103           HD2      PHE 103  -1.281   1.437  -4.575
  799    HD2  PHE 103           HD1      PHE 103  -0.626  -0.659  -8.266
  800    HE1  PHE 103           HE2      PHE 103  -0.630  -0.592  -3.307
  801    HE2  PHE 103           HE1      PHE 103   0.024  -2.689  -6.999
  802    HZ   PHE 103           HZ       PHE 103   0.022  -2.655  -4.519
  803    H    THR 104           HN       THR 104  -2.904   3.204  -9.175
  804    HA   THR 104           HA       THR 104  -2.440   5.968  -8.619
  805    HB   THR 104           HB       THR 104  -4.077   4.999 -10.960
  806    HG1  THR 104           HG1      THR 104  -2.303   4.185 -11.864
  807   1HG2  THR 104          HG22      THR 104  -1.988   7.159 -10.568
  808   2HG2  THR 104          HG21      THR 104  -2.759   6.776 -12.108
  809   3HG2  THR 104          HG23      THR 104  -3.724   7.404 -10.771
  810    H    ALA 105           HN       ALA 105  -5.273   3.998  -8.317
  811    HA   ALA 105           HA       ALA 105  -7.254   6.085  -8.514
  812   1HB   ALA 105           HB1      ALA 105  -7.680   3.580  -8.632
  813   2HB   ALA 105           HB3      ALA 105  -7.468   3.543  -6.882
  814   3HB   ALA 105           HB2      ALA 105  -8.783   4.480  -7.591
  815    H    PHE 106           HN       PHE 106  -5.331   4.765  -5.848
  816    HA   PHE 106           HA       PHE 106  -6.484   6.874  -4.067
  817   1HB   PHE 106           HB2      PHE 106  -5.295   4.160  -3.462
  818   2HB   PHE 106           HB1      PHE 106  -5.529   5.384  -2.214
  819    HD1  PHE 106           HD2      PHE 106  -7.818   6.210  -1.678
  820    HD2  PHE 106           HD1      PHE 106  -7.154   2.963  -4.411
  821    HE1  PHE 106           HE2      PHE 106 -10.205   5.565  -1.491
  822    HE2  PHE 106           HE1      PHE 106  -9.542   2.318  -4.223
  823    HZ   PHE 106           HZ       PHE 106 -11.067   3.618  -2.763
  824    H    LYS 107           HN       LYS 107  -4.102   6.837  -6.062
  825    HA   LYS 107           HA       LYS 107  -1.698   7.073  -4.499
  826   1HB   LYS 107           HB2      LYS 107  -0.791   8.231  -6.517
  827   2HB   LYS 107           HB1      LYS 107  -1.588   6.708  -6.911
  828   1HG   LYS 107           HG2      LYS 107  -2.655   8.000  -8.470
  829   2HG   LYS 107           HG1      LYS 107  -3.700   8.392  -7.105
  830   1HD   LYS 107           HD2      LYS 107  -2.787  10.493  -6.825
  831   2HD   LYS 107           HD1      LYS 107  -1.211  10.005  -7.453
  832   1HE   LYS 107           HE2      LYS 107  -2.010  10.035  -9.718
  833   2HE   LYS 107           HE1      LYS 107  -3.683  10.211  -9.189
  834   1HZ   LYS 107           HZ2      LYS 107  -3.050  12.359  -8.190
  835   2HZ   LYS 107           HZ1      LYS 107  -1.500  12.195  -8.865
  836   3HZ   LYS 107           HZ3      LYS 107  -2.854  12.331  -9.878
  837    H    ASP 108           HN       ASP 108  -4.352   9.229  -5.127
  838    HA   ASP 108           HA       ASP 108  -2.962  11.692  -4.494
  839   1HB   ASP 108           HB2      ASP 108  -5.219  11.376  -5.739
  840   2HB   ASP 108           HB1      ASP 108  -5.924  11.260  -4.125
  841    H    ASP 109           HN       ASP 109  -5.061   9.483  -2.636
  842    HA   ASP 109           HA       ASP 109  -4.435  10.987  -0.156
  843   1HB   ASP 109           HB2      ASP 109  -6.375   8.762  -0.817
  844   2HB   ASP 109           HB1      ASP 109  -6.063   9.274   0.843
  845    H    VAL 110           HN       VAL 110  -2.273   9.586  -1.406
  846    HA   VAL 110           HA       VAL 110  -1.904   7.101   0.144
  847    HB   VAL 110           HB       VAL 110  -1.146   7.190  -2.205
  848   1HG1  VAL 110          HG13      VAL 110  -0.557   9.697  -1.998
  849   2HG1  VAL 110          HG12      VAL 110   0.985   9.144  -1.342
  850   3HG1  VAL 110          HG11      VAL 110   0.509   8.689  -2.978
  851   1HG2  VAL 110          HG23      VAL 110   0.146   6.008  -0.188
  852   2HG2  VAL 110          HG22      VAL 110   0.787   5.978  -1.830
  853   3HG2  VAL 110          HG21      VAL 110   1.414   7.138  -0.659
  854    H    ASP 111           HN       ASP 111  -0.177   6.842   1.677
  855    HA   ASP 111           HA       ASP 111   1.032   9.382   2.680
  856   1HB   ASP 111           HB2      ASP 111  -0.306   7.213   4.325
  857   2HB   ASP 111           HB1      ASP 111   0.665   8.517   5.009
  858    H    THR 112           HN       THR 112   1.102   5.862   3.368
  859    HA   THR 112           HA       THR 112   4.049   6.022   3.642
  860    HB   THR 112           HB       THR 112   2.320   3.568   4.004
  861    HG1  THR 112           HG1      THR 112   2.524   4.301   6.295
  862   1HG2  THR 112          HG22      THR 112   5.026   4.452   5.034
  863   2HG2  THR 112          HG21      THR 112   4.175   3.024   5.623
  864   3HG2  THR 112          HG23      THR 112   4.688   3.113   3.937
  865    H    LEU 113           HN       LEU 113   5.393   4.416   2.487
  866    HA   LEU 113           HA       LEU 113   4.167   3.333   0.000
  867   1HB   LEU 113           HB2      LEU 113   6.503   5.238   0.186
  868   2HB   LEU 113           HB1      LEU 113   6.298   4.162  -1.198
  869    HG   LEU 113           HG       LEU 113   4.059   5.948  -0.245
  870   1HD1  LEU 113          HD13      LEU 113   6.212   6.584  -2.288
  871   2HD1  LEU 113          HD12      LEU 113   4.769   7.555  -1.994
  872   3HD1  LEU 113          HD11      LEU 113   5.992   7.389  -0.734
  873   1HD2  LEU 113          HD22      LEU 113   4.723   4.387  -2.742
  874   2HD2  LEU 113          HD21      LEU 113   3.274   4.291  -1.743
  875   3HD2  LEU 113          HD23      LEU 113   3.544   5.697  -2.771
  876    H    LEU 114           HN       LEU 114   4.459   1.206   0.723
  877    HA   LEU 114           HA       LEU 114   7.172   0.368   1.586
  878   1HB   LEU 114           HB2      LEU 114   4.534  -1.126   1.473
  879   2HB   LEU 114           HB1      LEU 114   6.049  -1.814   2.059
  880    HG   LEU 114           HG       LEU 114   4.970   0.757   3.207
  881   1HD1  LEU 114          HD13      LEU 114   3.191  -0.948   3.410
  882   2HD1  LEU 114          HD12      LEU 114   4.347  -2.063   4.140
  883   3HD1  LEU 114          HD11      LEU 114   3.901  -0.579   4.982
  884   1HD2  LEU 114          HD22      LEU 114   6.951  -1.374   4.006
  885   2HD2  LEU 114          HD21      LEU 114   7.195   0.369   3.891
  886   3HD2  LEU 114          HD23      LEU 114   6.243  -0.302   5.216
  887    H    VAL 115           HN       VAL 115   8.462   0.144  -0.214
  888    HA   VAL 115           HA       VAL 115   7.358  -1.400  -2.520
  889    HB   VAL 115           HB       VAL 115   8.164   0.869  -3.071
  890   1HG1  VAL 115          HG12      VAL 115   9.839   1.021  -1.233
  891   2HG1  VAL 115          HG11      VAL 115  10.860  -0.126  -2.102
  892   3HG1  VAL 115          HG13      VAL 115  10.518   1.457  -2.801
  893   1HG2  VAL 115          HG21      VAL 115   8.503  -1.191  -4.600
  894   2HG2  VAL 115          HG23      VAL 115   9.435   0.260  -4.972
  895   3HG2  VAL 115          HG22      VAL 115  10.202  -1.089  -4.134
  896    H    THR 116           HN       THR 116   8.312  -3.330  -3.070
  897    HA   THR 116           HA       THR 116  10.589  -4.236  -1.361
  898    HB   THR 116           HB       THR 116   8.716  -5.970  -2.991
  899    HG1  THR 116           HG1      THR 116   8.328  -6.056  -0.337
  900   1HG2  THR 116          HG23      THR 116  10.685  -6.476  -0.750
  901   2HG2  THR 116          HG22      THR 116   9.500  -7.668  -1.281
  902   3HG2  THR 116          HG21      THR 116  10.747  -7.108  -2.395
  903    H    ARG 117           HN       ARG 117  12.421  -3.720  -2.514
  904    HA   ARG 117           HA       ARG 117  12.502  -4.073  -5.435
  905   1HB   ARG 117           HB2      ARG 117  14.454  -3.061  -3.367
  906   2HB   ARG 117           HB1      ARG 117  14.964  -3.380  -5.026
  907   1HG   ARG 117           HG2      ARG 117  12.491  -1.752  -4.601
  908   2HG   ARG 117           HG1      ARG 117  14.053  -0.984  -4.314
  909   1HD   ARG 117           HD2      ARG 117  13.501  -2.536  -6.844
  910   2HD   ARG 117           HD1      ARG 117  13.091  -0.826  -6.702
  911    HE   ARG 117           HE       ARG 117  15.862  -1.503  -5.985
  912   1HH1  ARG 117          HH21      ARG 117  13.621  -0.454  -8.423
  913   2HH1  ARG 117          HH22      ARG 117  14.847   0.277  -9.404
  914   1HH2  ARG 117          HH11      ARG 117  17.444  -0.551  -7.266
  915   2HH2  ARG 117          HH12      ARG 117  17.001   0.222  -8.751
  916    H    LEU 118           HN       LEU 118  13.781  -5.625  -6.506
  917    HA   LEU 118           HA       LEU 118  14.925  -7.785  -4.782
  918   1HB   LEU 118           HB2      LEU 118  12.887  -7.923  -6.912
  919   2HB   LEU 118           HB1      LEU 118  14.195  -9.091  -7.096
  920    HG   LEU 118           HG       LEU 118  13.821  -9.623  -4.598
  921   1HD1  LEU 118          HD12      LEU 118  11.234  -8.188  -5.269
  922   2HD1  LEU 118          HD11      LEU 118  11.499  -9.165  -3.825
  923   3HD1  LEU 118          HD13      LEU 118  12.424  -7.684  -4.069
  924   1HD2  LEU 118          HD21      LEU 118  11.824 -10.285  -6.775
  925   2HD2  LEU 118          HD23      LEU 118  13.206 -11.246  -6.249
  926   3HD2  LEU 118          HD22      LEU 118  11.803 -11.071  -5.196
  927    H    ALA 119           HN       ALA 119  16.998  -8.332  -5.304
  928    HA   ALA 119           HA       ALA 119  18.444  -6.809  -7.286
  929   1HB   ALA 119           HB3      ALA 119  19.417  -7.785  -5.158
  930   2HB   ALA 119           HB2      ALA 119  19.347  -9.366  -5.936
  931   3HB   ALA 119           HB1      ALA 119  20.366  -8.095  -6.612
  932    H    GLY 120           HN       GLY 120  17.025 -10.041  -7.210
  933   1HA   GLY 120           HA2      GLY 120  18.247 -10.997  -9.636
  934   2HA   GLY 120           HA1      GLY 120  16.789 -11.660  -8.897
  935    H    SER 121           HN       SER 121  17.731 -10.539 -11.727
  936    HA   SER 121           HA       SER 121  15.667  -8.543 -12.285
  937   1HB   SER 121           HB2      SER 121  17.721  -8.420 -13.557
  938   2HB   SER 121           HB1      SER 121  17.562 -10.098 -14.069
  939    HG   SER 121           HG       SER 121  15.387  -8.485 -14.604
  940    H    PHE 122           HN       PHE 122  13.689  -8.912 -13.268
  941    HA   PHE 122           HA       PHE 122  13.050 -11.630 -14.260
  942   1HB   PHE 122           HB2      PHE 122  11.547 -10.241 -12.022
  943   2HB   PHE 122           HB1      PHE 122  10.945 -11.654 -12.888
  944    HD1  PHE 122           HD1      PHE 122  12.419 -13.763 -12.921
  945    HD2  PHE 122           HD2      PHE 122  13.044 -10.487 -10.213
  946    HE1  PHE 122           HE1      PHE 122  13.753 -15.240 -11.441
  947    HE2  PHE 122           HE2      PHE 122  14.378 -11.964  -8.735
  948    HZ   PHE 122           HZ       PHE 122  14.732 -14.341  -9.348
  949    H    GLU 123           HN       GLU 123  11.912 -11.418 -16.122
  950    HA   GLU 123           HA       GLU 123  10.677  -8.777 -16.724
  951   1HB   GLU 123           HB2      GLU 123  11.555 -11.099 -18.451
  952   2HB   GLU 123           HB1      GLU 123  10.566  -9.783 -19.082
  953   1HG   GLU 123           HG2      GLU 123  12.253  -8.168 -18.675
  954   2HG   GLU 123           HG1      GLU 123  13.144  -9.251 -17.605
  955    H    GLY 124           HN       GLY 124   8.492  -8.634 -17.359
  956   1HA   GLY 124           HA2      GLY 124   6.859 -11.113 -17.303
  957   2HA   GLY 124           HA1      GLY 124   6.448  -9.834 -16.158
  958    H    ASP 125           HN       ASP 125   4.754  -8.665 -16.885
  959    HA   ASP 125           HA       ASP 125   4.785  -7.687 -19.687
  960   1HB   ASP 125           HB2      ASP 125   2.361  -8.285 -19.931
  961   2HB   ASP 125           HB1      ASP 125   3.417  -9.695 -19.828
  962    H    THR 126           HN       THR 126   3.574  -7.506 -16.396
  963    HA   THR 126           HA       THR 126   2.376  -4.837 -16.954
  964    HB   THR 126           HB       THR 126   2.274  -6.306 -14.319
  965    HG1  THR 126           HG1      THR 126   0.070  -6.819 -15.429
  966   1HG2  THR 126          HG22      THR 126   1.553  -3.919 -14.467
  967   2HG2  THR 126          HG21      THR 126   0.355  -4.392 -15.673
  968   3HG2  THR 126          HG23      THR 126   0.238  -5.008 -14.024
  969    H    LYS 127           HN       LYS 127   3.184  -2.978 -15.968
  970    HA   LYS 127           HA       LYS 127   5.734  -3.318 -14.437
  971   1HB   LYS 127           HB2      LYS 127   4.900  -1.071 -16.299
  972   2HB   LYS 127           HB1      LYS 127   6.394  -1.106 -15.362
  973   1HG   LYS 127           HG2      LYS 127   6.989  -3.261 -16.505
  974   2HG   LYS 127           HG1      LYS 127   5.568  -3.056 -17.530
  975   1HD   LYS 127           HD2      LYS 127   6.441  -1.112 -18.554
  976   2HD   LYS 127           HD1      LYS 127   7.649  -0.886 -17.289
  977   1HE   LYS 127           HE2      LYS 127   8.966  -2.693 -18.063
  978   2HE   LYS 127           HE1      LYS 127   7.646  -3.348 -19.032
  979   1HZ   LYS 127           HZ1      LYS 127   7.773  -1.380 -20.445
  980   2HZ   LYS 127           HZ3      LYS 127   9.072  -0.790 -19.527
  981   3HZ   LYS 127           HZ2      LYS 127   9.249  -2.222 -20.424
  982    H    MET 128           HN       MET 128   6.159  -1.149 -13.142
  983    HA   MET 128           HA       MET 128   3.718  -0.689 -11.516
  984   1HB   MET 128           HB2      MET 128   6.230  -1.241 -10.714
  985   2HB   MET 128           HB1      MET 128   6.330   0.520 -10.752
  986   1HG   MET 128           HG2      MET 128   3.979  -0.813  -9.435
  987   2HG   MET 128           HG1      MET 128   5.505  -0.665  -8.563
  988   1HE   MET 128           HE1      MET 128   3.134   0.513  -7.267
  989   2HE   MET 128           HE3      MET 128   2.560   2.118  -7.740
  990   3HE   MET 128           HE2      MET 128   2.246   0.727  -8.774
  991    H    ILE 129           HN       ILE 129   2.900   1.407 -11.146
  992    HA   ILE 129           HA       ILE 129   3.230   3.303 -13.297
  993    HB   ILE 129           HB       ILE 129   1.782   4.770 -11.869
  994   1HG1  ILE 129          HG12      ILE 129   1.790   2.433  -9.940
  995   2HG1  ILE 129          HG11      ILE 129   2.793   3.864  -9.707
  996   1HG2  ILE 129          HG23      ILE 129   0.996   1.873 -12.269
  997   2HG2  ILE 129          HG22      ILE 129  -0.151   3.122 -11.783
  998   3HG2  ILE 129          HG21      ILE 129   0.668   3.234 -13.341
  999   1HD1  ILE 129          HD12      ILE 129   0.615   5.216  -9.974
 1000   2HD1  ILE 129          HD11      ILE 129  -0.220   3.679  -9.740
 1001   3HD1  ILE 129          HD13      ILE 129   0.822   4.320  -8.470
 1002    HA   PRO 130           HA       PRO 130   6.480   5.878 -11.687
 1003   1HB   PRO 130           HB2      PRO 130   5.570   8.352 -12.639
 1004   2HB   PRO 130           HB1      PRO 130   6.532   7.178 -13.547
 1005   1HG   PRO 130           HG2      PRO 130   3.811   7.948 -13.983
 1006   2HG   PRO 130           HG1      PRO 130   4.785   6.792 -14.902
 1007   1HD   PRO 130           HD2      PRO 130   2.707   6.274 -12.913
 1008   2HD   PRO 130           HD1      PRO 130   3.451   5.159 -14.070
 1009    H    LEU 131           HN       LEU 131   6.345   6.021  -9.447
 1010    HA   LEU 131           HA       LEU 131   4.246   7.661  -8.185
 1011   1HB   LEU 131           HB2      LEU 131   6.559   6.077  -7.029
 1012   2HB   LEU 131           HB1      LEU 131   5.360   6.935  -6.062
 1013    HG   LEU 131           HG       LEU 131   4.607   4.852  -8.122
 1014   1HD1  LEU 131          HD11      LEU 131   6.101   4.009  -6.206
 1015   2HD1  LEU 131          HD13      LEU 131   4.756   4.406  -5.136
 1016   3HD1  LEU 131          HD12      LEU 131   4.546   3.204  -6.409
 1017   1HD2  LEU 131          HD23      LEU 131   3.201   6.373  -5.932
 1018   2HD2  LEU 131          HD22      LEU 131   2.717   6.158  -7.614
 1019   3HD2  LEU 131          HD21      LEU 131   2.578   4.817  -6.479
 1020    H    ASN 132           HN       ASN 132   4.639   9.615  -7.101
 1021    HA   ASN 132           HA       ASN 132   6.974  11.125  -8.025
 1022   1HB   ASN 132           HB2      ASN 132   4.532  11.981  -7.663
 1023   2HB   ASN 132           HB1      ASN 132   5.007  12.114  -5.971
 1024   1HD2  ASN 132          HD21      ASN 132   6.687  13.682  -5.418
 1025   2HD2  ASN 132          HD22      ASN 132   7.155  14.895  -6.509
 1026    H    TRP 133           HN       TRP 133   8.675   9.935  -6.943
 1027    HA   TRP 133           HA       TRP 133   8.726   9.626  -4.064
 1028   1HB   TRP 133           HB2      TRP 133  10.973   9.557  -6.101
 1029   2HB   TRP 133           HB1      TRP 133  11.119   9.052  -4.417
 1030    HD1  TRP 133           HD1      TRP 133   9.862   7.922  -7.777
 1031    HE1  TRP 133           HE1      TRP 133   8.951   5.518  -7.596
 1032    HE3  TRP 133           HE3      TRP 133   9.876   7.354  -2.702
 1033    HZ2  TRP 133           HZ2      TRP 133   8.312   3.606  -5.566
 1034    HZ3  TRP 133           HZ3      TRP 133   9.112   5.234  -1.672
 1035    HH2  TRP 133           HH2      TRP 133   8.331   3.360  -3.096
 1036    H    ASP 134           HN       ASP 134   9.260  12.293  -6.135
 1037    HA   ASP 134           HA       ASP 134  11.216  13.692  -4.505
 1038   1HB   ASP 134           HB2      ASP 134   9.507  14.327  -6.860
 1039   2HB   ASP 134           HB1      ASP 134  10.054  15.690  -5.884
 1040    H    ASP 135           HN       ASP 135   8.304  12.735  -3.569
 1041    HA   ASP 135           HA       ASP 135   7.854  15.184  -1.924
 1042   1HB   ASP 135           HB2      ASP 135   5.874  13.668  -3.602
 1043   2HB   ASP 135           HB1      ASP 135   5.334  14.450  -2.116
 1044    H    PHE 136           HN       PHE 136   9.216  12.629  -1.363
 1045    HA   PHE 136           HA       PHE 136   7.584  11.837   0.993
 1046   1HB   PHE 136           HB2      PHE 136   8.710   9.979  -1.110
 1047   2HB   PHE 136           HB1      PHE 136   8.314   9.424   0.517
 1048    HD1  PHE 136           HD2      PHE 136   5.966   9.596   1.362
 1049    HD2  PHE 136           HD1      PHE 136   6.997  10.473  -2.714
 1050    HE1  PHE 136           HE2      PHE 136   3.577   9.415   0.718
 1051    HE2  PHE 136           HE1      PHE 136   4.609  10.292  -3.358
 1052    HZ   PHE 136           HZ       PHE 136   2.899   9.763  -1.641
 1053    H    THR 137           HN       THR 137   9.042  10.340   2.436
 1054    HA   THR 137           HA       THR 137  11.922  10.990   2.201
 1055    HB   THR 137           HB       THR 137  10.435  11.582   4.769
 1056    HG1  THR 137           HG1      THR 137   9.667  13.006   3.232
 1057   1HG2  THR 137          HG23      THR 137  12.884  11.153   4.866
 1058   2HG2  THR 137          HG22      THR 137  13.136  12.462   3.712
 1059   3HG2  THR 137          HG21      THR 137  12.477  12.811   5.310
 1060    H    LYS 138           HN       LYS 138  13.183   9.351   3.028
 1061    HA   LYS 138           HA       LYS 138  11.909   6.859   3.763
 1062   1HB   LYS 138           HB2      LYS 138  14.176   7.183   2.587
 1063   2HB   LYS 138           HB1      LYS 138  14.825   7.527   4.190
 1064   1HG   LYS 138           HG2      LYS 138  14.123   5.353   5.006
 1065   2HG   LYS 138           HG1      LYS 138  13.288   5.011   3.490
 1066   1HD   LYS 138           HD2      LYS 138  16.251   5.601   3.601
 1067   2HD   LYS 138           HD1      LYS 138  15.608   3.966   3.748
 1068   1HE   LYS 138           HE2      LYS 138  14.331   4.456   1.568
 1069   2HE   LYS 138           HE1      LYS 138  15.399   5.849   1.397
 1070   1HZ   LYS 138           HZ1      LYS 138  16.583   3.231   1.979
 1071   2HZ   LYS 138           HZ3      LYS 138  16.042   3.539   0.401
 1072   3HZ   LYS 138           HZ2      LYS 138  17.224   4.538   1.103
 1073    H    VAL 139           HN       VAL 139  12.186   5.745   5.826
 1074    HA   VAL 139           HA       VAL 139  12.931   7.443   8.143
 1075    HB   VAL 139           HB       VAL 139  10.818   6.773   9.318
 1076   1HG1  VAL 139          HG11      VAL 139  11.202   8.946   7.934
 1077   2HG1  VAL 139          HG13      VAL 139  10.112   8.205   6.762
 1078   3HG1  VAL 139          HG12      VAL 139   9.553   8.533   8.402
 1079   1HG2  VAL 139          HG22      VAL 139  10.078   5.810   6.535
 1080   2HG2  VAL 139          HG21      VAL 139  10.257   4.807   7.974
 1081   3HG2  VAL 139          HG23      VAL 139   8.942   5.978   7.874
 1082    H    SER 140           HN       SER 140  12.033   4.269   6.864
 1083    HA   SER 140           HA       SER 140  13.943   3.023   8.749
 1084   1HB   SER 140           HB2      SER 140  10.988   2.435   8.650
 1085   2HB   SER 140           HB1      SER 140  12.137   1.200   9.158
 1086    HG   SER 140           HG       SER 140  11.920   3.815  10.255
 1087    H    SER 141           HN       SER 141  14.366   0.719   8.110
 1088    HA   SER 141           HA       SER 141  13.459  -0.149   5.464
 1089   1HB   SER 141           HB2      SER 141  15.293   1.509   4.978
 1090   2HB   SER 141           HB1      SER 141  16.398   0.470   5.872
 1091    HG   SER 141           HG       SER 141  16.457  -0.835   4.226
 1092    H    ARG 142           HN       ARG 142  14.229  -2.337   4.980
 1093    HA   ARG 142           HA       ARG 142  15.602  -3.740   7.211
 1094   1HB   ARG 142           HB2      ARG 142  13.058  -3.849   7.483
 1095   2HB   ARG 142           HB1      ARG 142  13.045  -4.823   6.013
 1096   1HG   ARG 142           HG2      ARG 142  14.324  -6.552   7.012
 1097   2HG   ARG 142           HG1      ARG 142  14.818  -5.519   8.354
 1098   1HD   ARG 142           HD2      ARG 142  12.288  -5.374   8.901
 1099   2HD   ARG 142           HD1      ARG 142  12.126  -6.778   7.847
 1100    HE   ARG 142           HE       ARG 142  14.183  -7.065   9.915
 1101   1HH1  ARG 142          HH21      ARG 142  10.850  -7.491   9.035
 1102   2HH1  ARG 142          HH22      ARG 142  10.571  -8.724  10.218
 1103   1HH2  ARG 142          HH11      ARG 142  13.809  -8.667  11.447
 1104   2HH2  ARG 142          HH12      ARG 142  12.239  -9.387  11.576
 1105    H    THR 143           HN       THR 143  17.371  -4.326   5.977
 1106    HA   THR 143           HA       THR 143  17.010  -5.397   3.258
 1107    HB   THR 143           HB       THR 143  19.582  -5.398   4.840
 1108    HG1  THR 143           HG1      THR 143  18.087  -3.299   4.305
 1109   1HG2  THR 143          HG22      THR 143  19.487  -6.555   2.640
 1110   2HG2  THR 143          HG21      THR 143  18.973  -5.043   1.893
 1111   3HG2  THR 143          HG23      THR 143  20.575  -5.167   2.618
 1112    H    VAL 144           HN       VAL 144  17.299  -7.562   2.680
 1113    HA   VAL 144           HA       VAL 144  18.023  -9.517   4.781
 1114    HB   VAL 144           HB       VAL 144  15.573  -9.274   4.976
 1115   1HG1  VAL 144          HG12      VAL 144  15.247  -8.527   2.589
 1116   2HG1  VAL 144          HG11      VAL 144  15.456 -10.208   2.096
 1117   3HG1  VAL 144          HG13      VAL 144  14.097  -9.753   3.125
 1118   1HG2  VAL 144          HG22      VAL 144  16.812 -11.546   5.117
 1119   2HG2  VAL 144          HG21      VAL 144  15.058 -11.581   4.936
 1120   3HG2  VAL 144          HG23      VAL 144  16.094 -11.878   3.541
 1121    H    GLU 145           HN       GLU 145  19.305 -11.070   3.896
 1122    HA   GLU 145           HA       GLU 145  19.408 -11.255   0.918
 1123   1HB   GLU 145           HB2      GLU 145  21.489 -10.684   2.353
 1124   2HB   GLU 145           HB1      GLU 145  21.464 -12.387   2.815
 1125   1HG   GLU 145           HG2      GLU 145  21.570 -13.045   0.447
 1126   2HG   GLU 145           HG1      GLU 145  21.567 -11.348  -0.033
 1127    H    ASP 146           HN       ASP 146  18.465 -13.021   0.041
 1128    HA   ASP 146           HA       ASP 146  17.635 -15.266   1.725
 1129   1HB   ASP 146           HB2      ASP 146  16.425 -14.231  -0.361
 1130   2HB   ASP 146           HB1      ASP 146  17.502 -15.282  -1.280
 1131    H    THR 147           HN       THR 147  17.997 -17.459   0.065
 1132    HA   THR 147           HA       THR 147  20.743 -18.164   0.621
 1133    HB   THR 147           HB       THR 147  20.052 -20.188  -0.910
 1134    HG1  THR 147           HG1      THR 147  17.733 -20.349  -0.908
 1135   1HG2  THR 147          HG21      THR 147  18.639 -19.568   1.700
 1136   2HG2  THR 147          HG23      THR 147  18.826 -21.174   0.996
 1137   3HG2  THR 147          HG22      THR 147  20.245 -20.281   1.540
 1138    H    ASN 148           HN       ASN 148  18.970 -17.283  -2.330
 1139    HA   ASN 148           HA       ASN 148  21.540 -17.358  -3.836
 1140   1HB   ASN 148           HB2      ASN 148  19.385 -18.559  -4.647
 1141   2HB   ASN 148           HB1      ASN 148  18.819 -16.942  -5.065
 1142   1HD2  ASN 148          HD22      ASN 148  21.468 -18.783  -7.476
 1143   2HD2  ASN 148          HD21      ASN 148  20.723 -19.573  -6.171
 1144    HA   PRO 149           HA       PRO 149  22.018 -12.930  -3.647
 1145   1HB   PRO 149           HB2      PRO 149  22.820 -12.820  -6.436
 1146   2HB   PRO 149           HB1      PRO 149  23.808 -12.595  -4.987
 1147   1HG   PRO 149           HG2      PRO 149  23.687 -14.872  -6.726
 1148   2HG   PRO 149           HG1      PRO 149  24.730 -14.609  -5.322
 1149   1HD   PRO 149           HD2      PRO 149  22.618 -16.448  -5.496
 1150   2HD   PRO 149           HD1      PRO 149  23.457 -15.950  -4.020
 1151    H    ALA 150           HN       ALA 150  20.561 -14.269  -6.622
 1152    HA   ALA 150           HA       ALA 150  19.175 -11.901  -7.412
 1153   1HB   ALA 150           HB3      ALA 150  18.457 -14.811  -7.884
 1154   2HB   ALA 150           HB2      ALA 150  17.748 -13.442  -8.741
 1155   3HB   ALA 150           HB1      ALA 150  19.463 -13.808  -8.929
 1156    H    LEU 151           HN       LEU 151  18.417 -14.399  -5.061
 1157    HA   LEU 151           HA       LEU 151  15.643 -13.521  -4.720
 1158   1HB   LEU 151           HB2      LEU 151  17.435 -15.496  -3.313
 1159   2HB   LEU 151           HB1      LEU 151  15.869 -15.053  -2.633
 1160    HG   LEU 151           HG       LEU 151  16.219 -16.019  -5.481
 1161   1HD1  LEU 151          HD11      LEU 151  16.861 -17.663  -3.563
 1162   2HD1  LEU 151          HD13      LEU 151  15.131 -17.689  -3.220
 1163   3HD1  LEU 151          HD12      LEU 151  15.727 -18.214  -4.795
 1164   1HD2  LEU 151          HD23      LEU 151  13.861 -15.567  -3.633
 1165   2HD2  LEU 151          HD22      LEU 151  14.173 -14.802  -5.192
 1166   3HD2  LEU 151          HD21      LEU 151  13.737 -16.510  -5.119
 1167    H    THR 152           HN       THR 152  18.074 -11.690  -4.245
 1168    HA   THR 152           HA       THR 152  17.761 -11.056  -1.372
 1169    HB   THR 152           HB       THR 152  19.444  -9.664  -3.477
 1170    HG1  THR 152           HG1      THR 152  21.122 -10.919  -2.444
 1171   1HG2  THR 152          HG23      THR 152  19.237  -9.515  -0.476
 1172   2HG2  THR 152          HG22      THR 152  20.734  -9.082  -1.301
 1173   3HG2  THR 152          HG21      THR 152  19.248  -8.197  -1.648
 1174    H    HIS 153           HN       HIS 153  16.629  -9.285  -0.625
 1175    HA   HIS 153           HA       HIS 153  15.703  -7.215  -2.512
 1176   1HB   HIS 153           HB2      HIS 153  13.316  -7.523  -1.793
 1177   2HB   HIS 153           HB1      HIS 153  13.937  -8.866  -2.752
 1178    HD1  HIS 153           HD1      HIS 153  14.865 -10.967  -1.262
 1179    HD2  HIS 153           HD2      HIS 153  12.320  -8.294   0.676
 1180    HE1  HIS 153           HE1      HIS 153  14.023 -12.155   0.809
 1181    H    THR 154           HN       THR 154  14.429  -5.499  -1.250
 1182    HA   THR 154           HA       THR 154  15.120  -5.436   1.639
 1183    HB   THR 154           HB       THR 154  15.759  -3.135  -0.226
 1184    HG1  THR 154           HG1      THR 154  17.411  -4.331  -0.710
 1185   1HG2  THR 154          HG21      THR 154  16.027  -3.683   2.706
 1186   2HG2  THR 154          HG23      THR 154  17.229  -2.659   1.920
 1187   3HG2  THR 154          HG22      THR 154  15.524  -2.204   1.887
 1188    H    TYR 155           HN       TYR 155  13.468  -4.560   2.815
 1189    HA   TYR 155           HA       TYR 155  11.119  -3.535   1.348
 1190   1HB   TYR 155           HB2      TYR 155  11.557  -4.159   4.284
 1191   2HB   TYR 155           HB1      TYR 155  10.024  -3.629   3.591
 1192    HD1  TYR 155           HD1      TYR 155   8.825  -5.061   1.946
 1193    HD2  TYR 155           HD2      TYR 155  12.368  -6.404   3.968
 1194    HE1  TYR 155           HE1      TYR 155   8.309  -7.397   1.297
 1195    HE2  TYR 155           HE2      TYR 155  11.852  -8.742   3.320
 1196    HH   TYR 155           HH       TYR 155  10.537 -10.056   2.082
 1197    H    GLU 156           HN       GLU 156  11.502  -1.414   0.757
 1198    HA   GLU 156           HA       GLU 156  12.740   0.465   2.656
 1199   1HB   GLU 156           HB2      GLU 156  11.643   0.784  -0.151
 1200   2HB   GLU 156           HB1      GLU 156  12.321   2.119   0.784
 1201   1HG   GLU 156           HG2      GLU 156  14.414   0.700   1.068
 1202   2HG   GLU 156           HG1      GLU 156  13.734  -0.394  -0.138
 1203    H    VAL 157           HN       VAL 157  11.592   1.752   4.017
 1204    HA   VAL 157           HA       VAL 157   8.635   1.938   3.590
 1205    HB   VAL 157           HB       VAL 157  10.154   2.188   6.204
 1206   1HG1  VAL 157          HG11      VAL 157   7.212   2.003   5.496
 1207   2HG1  VAL 157          HG13      VAL 157   7.837   1.849   7.138
 1208   3HG1  VAL 157          HG12      VAL 157   8.038   3.363   6.256
 1209   1HG2  VAL 157          HG21      VAL 157   8.914  -0.146   4.778
 1210   2HG2  VAL 157          HG23      VAL 157  10.402  -0.079   5.724
 1211   3HG2  VAL 157          HG22      VAL 157   8.838  -0.082   6.540
 1212    H    TRP 158           HN       TRP 158   8.151   3.920   2.788
 1213    HA   TRP 158           HA       TRP 158   9.749   6.262   3.734
 1214   1HB   TRP 158           HB2      TRP 158   8.083   5.870   1.230
 1215   2HB   TRP 158           HB1      TRP 158   8.839   7.397   1.687
 1216    HD1  TRP 158           HD1      TRP 158  10.008   3.714   1.332
 1217    HE1  TRP 158           HE1      TRP 158  12.326   3.722   0.206
 1218    HE3  TRP 158           HE3      TRP 158  10.705   8.743   0.787
 1219    HZ2  TRP 158           HZ2      TRP 158  14.226   5.611  -0.795
 1220    HZ3  TRP 158           HZ3      TRP 158  12.776   9.619  -0.256
 1221    HH2  TRP 158           HH2      TRP 158  14.536   8.061  -1.046
 1222    H    GLN 159           HN       GLN 159   8.456   8.308   3.979
 1223    HA   GLN 159           HA       GLN 159   5.599   7.838   4.667
 1224   1HB   GLN 159           HB2      GLN 159   7.752   8.903   6.498
 1225   2HB   GLN 159           HB1      GLN 159   6.050   9.295   6.752
 1226   1HG   GLN 159           HG2      GLN 159   6.935   6.436   6.390
 1227   2HG   GLN 159           HG1      GLN 159   7.015   7.214   7.971
 1228   1HE2  GLN 159          HE22      GLN 159   3.576   5.623   7.114
 1229   2HE2  GLN 159          HE21      GLN 159   5.122   5.060   6.702
 1230    H    LYS 160           HN       LYS 160   4.309   9.559   4.105
 1231    HA   LYS 160           HA       LYS 160   5.455  11.700   2.520
 1232   1HB   LYS 160           HB2      LYS 160   3.116  10.624   2.292
 1233   2HB   LYS 160           HB1      LYS 160   2.647  11.672   3.630
 1234   1HG   LYS 160           HG2      LYS 160   3.225  13.652   2.383
 1235   2HG   LYS 160           HG1      LYS 160   3.959  12.691   1.098
 1236   1HD   LYS 160           HD2      LYS 160   1.840  11.807   0.421
 1237   2HD   LYS 160           HD1      LYS 160   1.043  12.436   1.863
 1238   1HE   LYS 160           HE2      LYS 160   1.415  14.728   1.121
 1239   2HE   LYS 160           HE1      LYS 160   2.333  14.159  -0.274
 1240   1HZ   LYS 160           HZ1      LYS 160  -0.242  12.929  -0.078
 1241   2HZ   LYS 160           HZ3      LYS 160  -0.352  14.617  -0.199
 1242   3HZ   LYS 160           HZ2      LYS 160   0.476  13.733  -1.390
 1243    H    LYS 161           HN       LYS 161   5.807  13.836   3.108
 1244    HA   LYS 161           HA       LYS 161   5.030  14.696   5.847
 1245   1HB   LYS 161           HB2      LYS 161   7.833  14.607   4.722
 1246   2HB   LYS 161           HB1      LYS 161   7.393  15.708   6.028
 1247   1HG   LYS 161           HG2      LYS 161   6.547  13.746   7.332
 1248   2HG   LYS 161           HG1      LYS 161   7.151  12.686   6.057
 1249   1HD   LYS 161           HD2      LYS 161   9.425  13.417   6.434
 1250   2HD   LYS 161           HD1      LYS 161   8.887  14.661   7.562
 1251   1HE   LYS 161           HE2      LYS 161   7.891  12.771   8.961
 1252   2HE   LYS 161           HE1      LYS 161   8.794  11.661   7.931
 1253   1HZ   LYS 161           HZ2      LYS 161   9.985  13.901   9.475
 1254   2HZ   LYS 161           HZ1      LYS 161  10.011  12.270   9.951
 1255   3HZ   LYS 161           HZ3      LYS 161  10.830  12.755   8.547
 1256    H    ALA 162           HN       ALA 162   4.180  16.717   5.757
 1257    HA   ALA 162           HA       ALA 162   5.207  18.685   3.816
 1258   1HB   ALA 162           HB1      ALA 162   2.306  17.793   3.815
 1259   2HB   ALA 162           HB3      ALA 162   2.957  19.147   2.890
 1260   3HB   ALA 162           HB2      ALA 162   3.474  17.500   2.525
 1261   1H9   TMQ 170           H91      TMQ 170   0.010 -10.139  -6.281
 1262   2H9   TMQ 170           H92      TMQ 170  -0.929 -10.773  -4.922
 1263    HN1  TMQ 170           H1N      TMQ 170   0.698 -12.274  -6.691
 1264   1H17  TMQ 170           HM1      TMQ 170  -1.181  -8.189  -3.023
 1265   2H17  TMQ 170           HM2      TMQ 170  -1.184  -8.818  -4.670
 1266   3H17  TMQ 170           HM3      TMQ 170  -0.472  -7.240  -4.337
 1267   1H21  TMQ 170          HW11      TMQ 170  -1.950 -12.156  -1.432
 1268   2H21  TMQ 170          HW12      TMQ 170  -3.133 -13.375  -0.929
 1269   3H21  TMQ 170          HW13      TMQ 170  -2.794 -13.127  -2.649
 1270   1H22  TMQ 170           HI1      TMQ 170   1.267 -17.226  -0.685
 1271   2H22  TMQ 170           HI2      TMQ 170   1.396 -15.471  -0.882
 1272   3H22  TMQ 170           HI3      TMQ 170   2.175 -16.554  -2.047
 1273   1H23  TMQ 170          HW21      TMQ 170   1.169 -16.632  -6.478
 1274   2H23  TMQ 170          HW22      TMQ 170   2.344 -17.878  -6.031
 1275   3H23  TMQ 170          HW23      TMQ 170   2.846 -16.183  -6.131
 1276   1HN2  TMQ 170          HN21      TMQ 170   5.587  -7.516  -0.112
 1277   2HN2  TMQ 170          HN22      TMQ 170   4.607  -6.160   0.336
 1278   1HN5  TMQ 170          HN41      TMQ 170   0.496  -5.479  -1.371
 1279   2HN5  TMQ 170          HN42      TMQ 170  -0.276  -6.494  -2.510
 1280    HN   TMQ 170           H1       TMQ 170   4.798  -9.041  -1.624
 1281    H7   TMQ 170           H7       TMQ 170   2.505 -11.674  -4.735
 1282    H8   TMQ 170           H8       TMQ 170   4.180 -10.767  -3.190
 1283    H12  TMQ 170           HP2      TMQ 170  -1.013 -12.154  -3.496
 1284    H16  TMQ 170           HP6      TMQ 170   1.653 -14.405  -6.045
   
  No H/Q in entry =        1284
  Start of MODEL    2
    1   1H    THR   1           HT3      THR   1  -2.592   6.458   4.657
    2   2H    THR   1           HT2      THR   1  -3.247   7.295   3.330
    3   3H    THR   1           HT1      THR   1  -4.274   6.578   4.478
    4    HA   THR   1           HA       THR   1  -4.078   4.526   3.612
    5    HB   THR   1           HB       THR   1  -2.988   6.049   1.234
    6    HG1  THR   1           HG1      THR   1  -5.636   5.884   1.244
    7   1HG2  THR   1          HG23      THR   1  -4.710   3.593   1.609
    8   2HG2  THR   1          HG22      THR   1  -4.583   4.437   0.066
    9   3HG2  THR   1          HG21      THR   1  -3.150   3.708   0.793
   10    H    ALA   2           HN       ALA   2  -2.666   2.847   2.578
   11    HA   ALA   2           HA       ALA   2   0.245   3.436   2.859
   12   1HB   ALA   2           HB1      ALA   2  -0.801   2.265   4.909
   13   2HB   ALA   2           HB3      ALA   2  -0.970   0.858   3.859
   14   3HB   ALA   2           HB2      ALA   2   0.630   1.518   4.199
   15    H    PHE   3           HN       PHE   3   1.233   2.880   0.991
   16    HA   PHE   3           HA       PHE   3  -0.122   1.026  -0.876
   17   1HB   PHE   3           HB2      PHE   3   2.148   2.988  -1.093
   18   2HB   PHE   3           HB1      PHE   3   1.964   1.722  -2.307
   19    HD1  PHE   3           HD1      PHE   3  -0.426   3.914  -0.405
   20    HD2  PHE   3           HD2      PHE   3   0.921   2.498  -4.230
   21    HE1  PHE   3           HE1      PHE   3  -2.206   5.232  -1.520
   22    HE2  PHE   3           HE2      PHE   3  -0.859   3.817  -5.345
   23    HZ   PHE   3           HZ       PHE   3  -2.422   5.183  -3.990
   24    H    LEU   4           HN       LEU   4   0.896  -0.883  -1.658
   25    HA   LEU   4           HA       LEU   4   3.496  -1.720  -0.606
   26   1HB   LEU   4           HB2      LEU   4   1.931  -2.194   1.293
   27   2HB   LEU   4           HB1      LEU   4   1.013  -3.253   0.223
   28    HG   LEU   4           HG       LEU   4   3.343  -4.384  -0.208
   29   1HD1  LEU   4          HD11      LEU   4   3.766  -2.723   2.260
   30   2HD1  LEU   4          HD13      LEU   4   4.572  -4.285   2.113
   31   3HD1  LEU   4          HD12      LEU   4   4.871  -3.023   0.918
   32   1HD2  LEU   4          HD21      LEU   4   1.333  -5.364   0.965
   33   2HD2  LEU   4          HD23      LEU   4   2.879  -5.960   1.570
   34   3HD2  LEU   4          HD22      LEU   4   1.987  -4.741   2.481
   35    H    TRP   5           HN       TRP   5   4.308  -2.476  -2.511
   36    HA   TRP   5           HA       TRP   5   2.794  -4.610  -3.905
   37   1HB   TRP   5           HB2      TRP   5   3.160  -3.573  -6.102
   38   2HB   TRP   5           HB1      TRP   5   2.224  -2.498  -5.069
   39    HD1  TRP   5           HD1      TRP   5   5.221  -2.581  -7.195
   40    HE1  TRP   5           HE1      TRP   5   6.652  -0.466  -6.859
   41    HE3  TRP   5           HE3      TRP   5   3.052  -0.703  -2.964
   42    HZ2  TRP   5           HZ2      TRP   5   6.854   1.730  -5.041
   43    HZ3  TRP   5           HZ3      TRP   5   3.890   1.398  -1.954
   44    HH2  TRP   5           HH2      TRP   5   5.784   2.616  -2.986
   45    H    ALA   6           HN       ALA   6   4.147  -6.083  -5.025
   46    HA   ALA   6           HA       ALA   6   7.000  -5.947  -4.220
   47   1HB   ALA   6           HB1      ALA   6   5.525  -8.021  -3.873
   48   2HB   ALA   6           HB3      ALA   6   5.617  -8.244  -5.619
   49   3HB   ALA   6           HB2      ALA   6   7.087  -8.291  -4.647
   50    H    GLN   7           HN       GLN   7   8.290  -4.921  -5.673
   51    HA   GLN   7           HA       GLN   7   7.929  -5.586  -8.564
   52   1HB   GLN   7           HB2      GLN   7   8.580  -3.218  -9.084
   53   2HB   GLN   7           HB1      GLN   7   7.028  -3.349  -8.256
   54   1HG   GLN   7           HG2      GLN   7   7.904  -2.581  -6.218
   55   2HG   GLN   7           HG1      GLN   7   9.562  -2.971  -6.676
   56   1HE2  GLN   7          HE22      GLN   7  10.130   0.284  -7.863
   57   2HE2  GLN   7          HE21      GLN   7  10.755  -1.133  -7.169
   58    H    ASP   8           HN       ASP   8   9.886  -5.653  -9.768
   59    HA   ASP   8           HA       ASP   8  12.319  -5.932  -8.075
   60   1HB   ASP   8           HB2      ASP   8  13.252  -7.085 -10.123
   61   2HB   ASP   8           HB1      ASP   8  11.858  -7.892  -9.408
   62    H    ARG   9           HN       ARG   9  14.405  -5.243  -9.268
   63    HA   ARG   9           HA       ARG   9  14.319  -2.438  -9.771
   64   1HB   ARG   9           HB2      ARG   9  16.666  -2.757 -10.599
   65   2HB   ARG   9           HB1      ARG   9  16.374  -3.502  -9.026
   66   1HG   ARG   9           HG2      ARG   9  16.120  -5.686 -10.037
   67   2HG   ARG   9           HG1      ARG   9  16.193  -4.993 -11.658
   68   1HD   ARG   9           HD2      ARG   9  18.453  -4.660  -9.683
   69   2HD   ARG   9           HD1      ARG   9  18.357  -6.051 -10.763
   70    HE   ARG   9           HE       ARG   9  18.053  -3.643 -12.288
   71   1HH1  ARG   9          HH11      ARG   9  20.407  -5.491 -10.525
   72   2HH1  ARG   9          HH12      ARG   9  21.739  -4.927 -11.477
   73   1HH2  ARG   9          HH21      ARG   9  19.789  -2.917 -13.516
   74   2HH2  ARG   9          HH22      ARG   9  21.390  -3.477 -13.163
   75    H    ASP  10           HN       ASP  10  13.632  -5.109 -11.829
   76    HA   ASP  10           HA       ASP  10  14.271  -3.782 -14.344
   77   1HB   ASP  10           HB2      ASP  10  12.796  -6.287 -13.564
   78   2HB   ASP  10           HB1      ASP  10  12.694  -5.680 -15.218
   79    H    GLY  11           HN       GLY  11  12.228  -2.708 -12.191
   80   1HA   GLY  11           HA2      GLY  11  10.298  -1.379 -12.278
   81   2HA   GLY  11           HA1      GLY  11  10.561  -1.280 -14.020
   82    H    LEU  12           HN       LEU  12  10.044  -4.257 -12.173
   83    HA   LEU  12           HA       LEU  12   7.535  -4.675 -13.750
   84   1HB   LEU  12           HB2      LEU  12   9.674  -6.254 -13.884
   85   2HB   LEU  12           HB1      LEU  12   8.968  -6.941 -12.421
   86    HG   LEU  12           HG       LEU  12   6.752  -6.983 -13.783
   87   1HD1  LEU  12          HD11      LEU  12   7.764  -5.596 -15.644
   88   2HD1  LEU  12          HD13      LEU  12   8.754  -6.995 -16.057
   89   3HD1  LEU  12          HD12      LEU  12   6.998  -7.091 -16.180
   90   1HD2  LEU  12          HD21      LEU  12   8.453  -8.899 -13.134
   91   2HD2  LEU  12          HD23      LEU  12   7.167  -9.219 -14.298
   92   3HD2  LEU  12          HD22      LEU  12   8.805  -8.890 -14.863
   93    H    ILE  13           HN       ILE  13   5.900  -6.077 -12.568
   94    HA   ILE  13           HA       ILE  13   6.017  -5.758  -9.611
   95    HB   ILE  13           HB       ILE  13   3.635  -4.970  -9.642
   96   1HG1  ILE  13          HG12      ILE  13   4.149  -4.555 -12.603
   97   2HG1  ILE  13          HG11      ILE  13   3.172  -5.873 -11.953
   98   1HG2  ILE  13          HG21      ILE  13   5.751  -3.323 -11.049
   99   2HG2  ILE  13          HG23      ILE  13   4.205  -2.654 -10.525
  100   3HG2  ILE  13          HG22      ILE  13   5.335  -3.301  -9.335
  101   1HD1  ILE  13          HD11      ILE  13   2.583  -3.026 -11.175
  102   2HD1  ILE  13          HD13      ILE  13   1.973  -3.676 -12.697
  103   3HD1  ILE  13          HD12      ILE  13   1.505  -4.421 -11.168
  104    H    GLY  14           HN       GLY  14   4.695  -7.339 -12.453
  105   1HA   GLY  14           HA2      GLY  14   4.408  -9.852 -11.070
  106   2HA   GLY  14           HA1      GLY  14   2.831  -9.103 -11.319
  107    H    LYS  15           HN       LYS  15   2.600 -11.153 -12.678
  108    HA   LYS  15           HA       LYS  15   2.819 -10.463 -15.474
  109   1HB   LYS  15           HB2      LYS  15   5.191 -11.260 -14.774
  110   2HB   LYS  15           HB1      LYS  15   4.468 -12.867 -14.703
  111   1HG   LYS  15           HG2      LYS  15   4.063 -11.140 -17.133
  112   2HG   LYS  15           HG1      LYS  15   5.548 -12.073 -16.947
  113   1HD   LYS  15           HD2      LYS  15   3.948 -14.067 -16.428
  114   2HD   LYS  15           HD1      LYS  15   2.717 -13.067 -17.201
  115   1HE   LYS  15           HE2      LYS  15   3.832 -13.075 -19.272
  116   2HE   LYS  15           HE1      LYS  15   5.371 -13.540 -18.546
  117   1HZ   LYS  15           HZ3      LYS  15   4.415 -15.700 -18.009
  118   2HZ   LYS  15           HZ2      LYS  15   2.950 -15.250 -18.743
  119   3HZ   LYS  15           HZ1      LYS  15   4.360 -15.405 -19.678
  120    H    ASP  16           HN       ASP  16   0.954 -11.304 -16.244
  121    HA   ASP  16           HA       ASP  16  -0.853 -12.761 -16.571
  122   1HB   ASP  16           HB2      ASP  16   1.458 -14.539 -15.984
  123   2HB   ASP  16           HB1      ASP  16  -0.143 -15.264 -15.848
  124    H    GLY  17           HN       GLY  17  -0.438 -11.422 -13.953
  125   1HA   GLY  17           HA2      GLY  17  -1.951 -11.391 -12.089
  126   2HA   GLY  17           HA1      GLY  17  -2.333 -13.084 -12.402
  127    H    HIS  18           HN       HIS  18  -0.187 -14.513 -12.218
  128    HA   HIS  18           HA       HIS  18   0.677 -14.272  -9.456
  129   1HB   HIS  18           HB2      HIS  18   2.097 -16.264 -10.017
  130   2HB   HIS  18           HB1      HIS  18   0.394 -16.485 -10.421
  131    HD1  HIS  18           HD1      HIS  18   3.754 -15.844 -12.015
  132    HD2  HIS  18           HD2      HIS  18  -0.147 -16.733 -13.182
  133    HE1  HIS  18           HE1      HIS  18   3.851 -16.381 -14.488
  134    H    LEU  19           HN       LEU  19   3.115 -14.415  -8.957
  135    HA   LEU  19           HA       LEU  19   4.428 -12.145 -10.284
  136   1HB   LEU  19           HB2      LEU  19   5.095 -13.868  -7.894
  137   2HB   LEU  19           HB1      LEU  19   6.252 -12.705  -8.545
  138    HG   LEU  19           HG       LEU  19   3.421 -11.922  -7.835
  139   1HD1  LEU  19          HD11      LEU  19   5.873 -12.151  -6.103
  140   2HD1  LEU  19          HD13      LEU  19   4.659 -10.918  -5.767
  141   3HD1  LEU  19          HD12      LEU  19   4.214 -12.624  -5.739
  142   1HD2  LEU  19          HD22      LEU  19   5.953 -10.556  -8.644
  143   2HD2  LEU  19          HD21      LEU  19   4.288 -10.181  -9.086
  144   3HD2  LEU  19          HD23      LEU  19   4.903  -9.720  -7.500
  145    HA   PRO  20           HA       PRO  20   7.083 -14.599 -12.882
  146   1HB   PRO  20           HB2      PRO  20   9.209 -12.795 -13.057
  147   2HB   PRO  20           HB1      PRO  20   7.754 -12.779 -14.063
  148   1HG   PRO  20           HG2      PRO  20   8.554 -10.889 -12.054
  149   2HG   PRO  20           HG1      PRO  20   7.144 -10.835 -13.120
  150   1HD   PRO  20           HD2      PRO  20   7.275 -11.554 -10.301
  151   2HD   PRO  20           HD1      PRO  20   5.854 -11.239 -11.308
  152    H    TRP  21           HN       TRP  21   8.342 -13.296  -9.874
  153    HA   TRP  21           HA       TRP  21  10.539 -15.318  -9.917
  154   1HB   TRP  21           HB2      TRP  21  11.481 -13.973  -8.020
  155   2HB   TRP  21           HB1      TRP  21  11.337 -13.055  -9.518
  156    HD1  TRP  21           HD1      TRP  21   9.657 -13.494  -6.101
  157    HE1  TRP  21           HE1      TRP  21   8.238 -11.398  -5.608
  158    HE3  TRP  21           HE3      TRP  21  10.112 -11.049 -10.562
  159    HZ2  TRP  21           HZ2      TRP  21   7.406  -9.002  -6.930
  160    HZ3  TRP  21           HZ3      TRP  21   8.998  -8.864 -10.918
  161    HH2  TRP  21           HH2      TRP  21   7.647  -7.839  -9.110
  162    H    HIS  22           HN       HIS  22  10.983 -16.310  -7.700
  163    HA   HIS  22           HA       HIS  22   8.390 -16.883  -6.318
  164   1HB   HIS  22           HB2      HIS  22   9.516 -18.763  -7.683
  165   2HB   HIS  22           HB1      HIS  22  10.741 -18.777  -6.413
  166    HD1  HIS  22           HD1      HIS  22   6.915 -18.644  -6.398
  167    HD2  HIS  22           HD2      HIS  22  10.050 -20.677  -4.550
  168    HE1  HIS  22           HE1      HIS  22   5.855 -20.251  -4.752
  169    H    LEU  23           HN       LEU  23   8.679 -15.340  -4.663
  170    HA   LEU  23           HA       LEU  23  11.064 -15.762  -2.906
  171   1HB   LEU  23           HB2      LEU  23  10.712 -13.471  -4.021
  172   2HB   LEU  23           HB1      LEU  23   9.330 -13.286  -2.942
  173    HG   LEU  23           HG       LEU  23  10.846 -13.719  -1.000
  174   1HD1  LEU  23          HD12      LEU  23  12.875 -13.804  -3.234
  175   2HD1  LEU  23          HD11      LEU  23  13.343 -13.380  -1.587
  176   3HD1  LEU  23          HD13      LEU  23  12.636 -14.960  -1.924
  177   1HD2  LEU  23          HD23      LEU  23  10.405 -11.393  -2.315
  178   2HD2  LEU  23          HD22      LEU  23  11.395 -11.494  -0.859
  179   3HD2  LEU  23          HD21      LEU  23  12.161 -11.477  -2.447
  180    HA   PRO  24           HA       PRO  24   7.405 -17.712  -0.721
  181   1HB   PRO  24           HB2      PRO  24   9.505 -18.761   1.009
  182   2HB   PRO  24           HB1      PRO  24   8.342 -19.638   0.007
  183   1HG   PRO  24           HG2      PRO  24  11.118 -19.171  -0.500
  184   2HG   PRO  24           HG1      PRO  24   9.959 -20.072  -1.485
  185   1HD   PRO  24           HD2      PRO  24  11.144 -17.617  -2.153
  186   2HD   PRO  24           HD1      PRO  24   9.760 -18.368  -2.962
  187    H    ASP  25           HN       ASP  25  10.277 -16.068   0.581
  188    HA   ASP  25           HA       ASP  25   9.230 -15.514   3.183
  189   1HB   ASP  25           HB2      ASP  25  11.646 -15.185   2.141
  190   2HB   ASP  25           HB1      ASP  25  11.044 -13.559   1.817
  191    H    ASP  26           HN       ASP  26   9.136 -13.634   0.157
  192    HA   ASP  26           HA       ASP  26   7.767 -11.364   1.242
  193   1HB   ASP  26           HB2      ASP  26   8.929 -11.401  -0.974
  194   2HB   ASP  26           HB1      ASP  26   7.642 -12.435  -1.594
  195    H    LEU  27           HN       LEU  27   6.598 -14.372  -0.257
  196    HA   LEU  27           HA       LEU  27   3.822 -13.688  -0.284
  197   1HB   LEU  27           HB2      LEU  27   5.148 -16.404  -0.026
  198   2HB   LEU  27           HB1      LEU  27   3.449 -16.141  -0.414
  199    HG   LEU  27           HG       LEU  27   5.760 -15.056  -2.049
  200   1HD1  LEU  27          HD12      LEU  27   4.122 -17.574  -2.246
  201   2HD1  LEU  27          HD11      LEU  27   4.768 -16.820  -3.705
  202   3HD1  LEU  27          HD13      LEU  27   5.863 -17.367  -2.435
  203   1HD2  LEU  27          HD22      LEU  27   2.792 -14.831  -2.137
  204   2HD2  LEU  27          HD21      LEU  27   4.021 -13.683  -2.665
  205   3HD2  LEU  27          HD23      LEU  27   3.608 -15.063  -3.683
  206    H    HIS  28           HN       HIS  28   5.961 -14.666   2.276
  207    HA   HIS  28           HA       HIS  28   3.779 -15.413   4.101
  208   1HB   HIS  28           HB2      HIS  28   6.777 -15.231   4.317
  209   2HB   HIS  28           HB1      HIS  28   5.790 -15.361   5.773
  210    HD1  HIS  28           HD1      HIS  28   3.627 -17.303   4.878
  211    HD2  HIS  28           HD2      HIS  28   7.655 -17.836   3.946
  212    HE1  HIS  28           HE1      HIS  28   3.929 -19.771   4.393
  213    H    TYR  29           HN       TYR  29   5.768 -12.617   3.376
  214    HA   TYR  29           HA       TYR  29   5.138 -11.131   5.777
  215   1HB   TYR  29           HB2      TYR  29   7.069 -10.672   4.186
  216   2HB   TYR  29           HB1      TYR  29   5.886  -9.981   3.076
  217    HD1  TYR  29           HD1      TYR  29   6.624  -9.816   6.760
  218    HD2  TYR  29           HD2      TYR  29   5.681  -7.671   3.160
  219    HE1  TYR  29           HE1      TYR  29   6.687  -7.680   8.017
  220    HE2  TYR  29           HE2      TYR  29   5.744  -5.534   4.417
  221    HH   TYR  29           HH       TYR  29   6.637  -5.454   7.861
  222    H    PHE  30           HN       PHE  30   3.510 -11.687   2.742
  223    HA   PHE  30           HA       PHE  30   1.743  -9.431   2.770
  224   1HB   PHE  30           HB2      PHE  30   2.125 -11.033   0.837
  225   2HB   PHE  30           HB1      PHE  30   1.103 -12.189   1.692
  226    HD1  PHE  30           HD2      PHE  30   1.034  -8.526   0.842
  227    HD2  PHE  30           HD1      PHE  30  -1.130 -12.231   1.056
  228    HE1  PHE  30           HE2      PHE  30  -0.989  -7.396  -0.041
  229    HE2  PHE  30           HE1      PHE  30  -3.153 -11.100   0.173
  230    HZ   PHE  30           HZ       PHE  30  -3.083  -8.683  -0.376
  231    H    ARG  31           HN       ARG  31   1.240 -12.792   3.903
  232    HA   ARG  31           HA       ARG  31  -1.331 -12.241   5.083
  233   1HB   ARG  31           HB2      ARG  31  -0.278 -14.523   4.442
  234   2HB   ARG  31           HB1      ARG  31   0.516 -14.434   6.014
  235   1HG   ARG  31           HG2      ARG  31  -1.669 -14.187   7.118
  236   2HG   ARG  31           HG1      ARG  31  -2.475 -14.247   5.551
  237   1HD   ARG  31           HD2      ARG  31  -0.617 -16.477   6.292
  238   2HD   ARG  31           HD1      ARG  31  -2.226 -16.441   7.015
  239    HE   ARG  31           HE       ARG  31  -2.100 -16.161   4.074
  240   1HH1  ARG  31          HH11      ARG  31  -2.654 -18.155   6.865
  241   2HH1  ARG  31          HH12      ARG  31  -3.532 -19.356   5.980
  242   1HH2  ARG  31          HH21      ARG  31  -3.242 -17.727   2.936
  243   2HH2  ARG  31          HH22      ARG  31  -3.864 -19.114   3.767
  244    H    ALA  32           HN       ALA  32   1.586 -11.004   5.951
  245    HA   ALA  32           HA       ALA  32   1.098 -11.174   8.883
  246   1HB   ALA  32           HB3      ALA  32   3.398 -11.623   8.033
  247   2HB   ALA  32           HB2      ALA  32   3.450  -9.987   7.377
  248   3HB   ALA  32           HB1      ALA  32   3.345 -10.235   9.121
  249    H    GLN  33           HN       GLN  33   1.072  -8.945   6.176
  250    HA   GLN  33           HA       GLN  33   0.277  -6.750   8.048
  251   1HB   GLN  33           HB2      GLN  33   1.775  -6.752   5.440
  252   2HB   GLN  33           HB1      GLN  33   0.868  -5.321   5.928
  253   1HG   GLN  33           HG2      GLN  33   3.098  -5.031   6.764
  254   2HG   GLN  33           HG1      GLN  33   2.090  -5.441   8.152
  255   1HE2  GLN  33          HE22      GLN  33   4.321  -8.052   8.928
  256   2HE2  GLN  33          HE21      GLN  33   3.469  -6.685   9.465
  257    H    THR  34           HN       THR  34  -1.517  -8.808   7.042
  258    HA   THR  34           HA       THR  34  -3.372  -7.055   5.490
  259    HB   THR  34           HB       THR  34  -4.156  -9.172   4.329
  260    HG1  THR  34           HG1      THR  34  -1.776 -10.411   4.665
  261   1HG2  THR  34          HG22      THR  34  -1.320  -8.192   3.928
  262   2HG2  THR  34          HG21      THR  34  -2.166  -9.231   2.781
  263   3HG2  THR  34          HG23      THR  34  -2.773  -7.610   3.116
  264    H    VAL  35           HN       VAL  35  -2.873  -9.533   7.906
  265    HA   VAL  35           HA       VAL  35  -5.699 -10.015   8.411
  266    HB   VAL  35           HB       VAL  35  -4.845 -11.137  10.486
  267   1HG1  VAL  35          HG12      VAL  35  -3.567 -11.767   7.817
  268   2HG1  VAL  35          HG11      VAL  35  -3.420 -12.830   9.215
  269   3HG1  VAL  35          HG13      VAL  35  -5.008 -12.497   8.524
  270   1HG2  VAL  35          HG23      VAL  35  -2.220 -10.053   9.428
  271   2HG2  VAL  35          HG22      VAL  35  -2.939  -9.757  11.011
  272   3HG2  VAL  35          HG21      VAL  35  -2.319 -11.359  10.610
  273    H    GLY  36           HN       GLY  36  -7.039  -8.740   9.589
  274   1HA   GLY  36           HA2      GLY  36  -7.706  -7.279  11.341
  275   2HA   GLY  36           HA1      GLY  36  -6.013  -7.111  11.809
  276    H    LYS  37           HN       LYS  37  -6.873  -6.680   8.471
  277    HA   LYS  37           HA       LYS  37  -6.966  -3.728   8.759
  278   1HB   LYS  37           HB2      LYS  37  -4.798  -5.302   7.396
  279   2HB   LYS  37           HB1      LYS  37  -5.258  -3.723   6.756
  280   1HG   LYS  37           HG2      LYS  37  -3.705  -2.987   8.273
  281   2HG   LYS  37           HG1      LYS  37  -5.074  -3.103   9.381
  282   1HD   LYS  37           HD2      LYS  37  -4.227  -5.643   9.531
  283   2HD   LYS  37           HD1      LYS  37  -2.692  -4.877   9.118
  284   1HE   LYS  37           HE2      LYS  37  -4.464  -3.843  11.339
  285   2HE   LYS  37           HE1      LYS  37  -3.218  -5.061  11.616
  286   1HZ   LYS  37           HZ2      LYS  37  -1.646  -3.462  10.514
  287   2HZ   LYS  37           HZ1      LYS  37  -2.867  -2.288  10.641
  288   3HZ   LYS  37           HZ3      LYS  37  -2.220  -2.993  12.042
  289    H    ILE  38           HN       ILE  38  -7.531  -2.700   6.617
  290    HA   ILE  38           HA       ILE  38  -9.524  -4.390   5.230
  291    HB   ILE  38           HB       ILE  38  -8.928  -1.439   4.868
  292   1HG1  ILE  38          HG12      ILE  38 -11.094  -2.739   6.546
  293   2HG1  ILE  38          HG11      ILE  38  -9.591  -2.100   7.214
  294   1HG2  ILE  38          HG22      ILE  38 -11.319  -3.162   4.146
  295   2HG2  ILE  38          HG21      ILE  38 -11.231  -1.412   3.941
  296   3HG2  ILE  38          HG23      ILE  38 -10.165  -2.464   3.010
  297   1HD1  ILE  38          HD11      ILE  38 -10.183   0.104   6.057
  298   2HD1  ILE  38          HD13      ILE  38 -11.789  -0.580   5.802
  299   3HD1  ILE  38          HD12      ILE  38 -11.183  -0.339   7.441
  300    H    MET  39           HN       MET  39  -8.534  -5.644   3.686
  301    HA   MET  39           HA       MET  39  -6.313  -4.601   2.077
  302   1HB   MET  39           HB2      MET  39  -6.554  -7.023   2.839
  303   2HB   MET  39           HB1      MET  39  -7.843  -7.176   1.645
  304   1HG   MET  39           HG2      MET  39  -6.196  -6.324  -0.087
  305   2HG   MET  39           HG1      MET  39  -4.938  -6.496   1.137
  306   1HE   MET  39           HE3      MET  39  -7.760  -7.906  -0.701
  307   2HE   MET  39           HE2      MET  39  -7.427  -9.609  -1.003
  308   3HE   MET  39           HE1      MET  39  -8.114  -9.113   0.542
  309    H    VAL  40           HN       VAL  40  -6.865  -3.124   0.538
  310    HA   VAL  40           HA       VAL  40  -9.421  -3.451  -0.941
  311    HB   VAL  40           HB       VAL  40  -7.401  -1.193  -1.086
  312   1HG1  VAL  40          HG13      VAL  40 -10.269  -1.506  -2.017
  313   2HG1  VAL  40          HG12      VAL  40  -9.417   0.037  -1.971
  314   3HG1  VAL  40          HG11      VAL  40  -8.845  -1.255  -3.026
  315   1HG2  VAL  40          HG23      VAL  40  -9.844  -1.622   0.649
  316   2HG2  VAL  40          HG22      VAL  40  -8.204  -1.224   1.165
  317   3HG2  VAL  40          HG21      VAL  40  -9.184  -0.017   0.333
  318    H    VAL  41           HN       VAL  41  -9.345  -4.580  -2.810
  319    HA   VAL  41           HA       VAL  41  -6.898  -4.346  -4.509
  320    HB   VAL  41           HB       VAL  41  -7.224  -6.755  -5.123
  321   1HG1  VAL  41          HG13      VAL  41  -6.520  -5.800  -2.383
  322   2HG1  VAL  41          HG12      VAL  41  -6.651  -7.541  -2.630
  323   3HG1  VAL  41          HG11      VAL  41  -5.509  -6.598  -3.587
  324   1HG2  VAL  41          HG23      VAL  41  -9.245  -6.599  -2.866
  325   2HG2  VAL  41          HG22      VAL  41  -9.572  -7.010  -4.549
  326   3HG2  VAL  41          HG21      VAL  41  -8.633  -8.110  -3.539
  327    H    GLY  42           HN       GLY  42  -7.396  -5.027  -6.820
  328   1HA   GLY  42           HA2      GLY  42  -9.985  -3.832  -7.612
  329   2HA   GLY  42           HA1      GLY  42  -8.634  -4.179  -8.693
  330    H    ARG  43           HN       ARG  43 -10.298  -5.197 -10.085
  331    HA   ARG  43           HA       ARG  43 -11.545  -7.676  -9.111
  332   1HB   ARG  43           HB2      ARG  43 -11.584  -6.138 -11.698
  333   2HB   ARG  43           HB1      ARG  43 -12.180  -7.796 -11.646
  334   1HG   ARG  43           HG2      ARG  43 -13.661  -7.120  -9.720
  335   2HG   ARG  43           HG1      ARG  43 -13.170  -5.450 -10.006
  336   1HD   ARG  43           HD2      ARG  43 -15.300  -5.949 -11.148
  337   2HD   ARG  43           HD1      ARG  43 -14.027  -5.591 -12.316
  338    HE   ARG  43           HE       ARG  43 -14.342  -8.445 -11.715
  339   1HH1  ARG  43          HH11      ARG  43 -15.268  -5.758 -13.713
  340   2HH1  ARG  43          HH12      ARG  43 -15.768  -6.760 -15.034
  341   1HH2  ARG  43          HH21      ARG  43 -14.996  -9.734 -13.435
  342   2HH2  ARG  43          HH22      ARG  43 -15.616  -9.000 -14.877
  343    H    ARG  44           HN       ARG  44  -8.858  -6.710 -11.196
  344    HA   ARG  44           HA       ARG  44  -8.279  -9.358 -12.190
  345   1HB   ARG  44           HB2      ARG  44  -6.647  -6.820 -11.983
  346   2HB   ARG  44           HB1      ARG  44  -5.993  -8.308 -12.669
  347   1HG   ARG  44           HG2      ARG  44  -8.625  -7.225 -13.645
  348   2HG   ARG  44           HG1      ARG  44  -7.111  -6.572 -14.271
  349   1HD   ARG  44           HD2      ARG  44  -6.400  -8.892 -14.862
  350   2HD   ARG  44           HD1      ARG  44  -7.981  -9.476 -14.340
  351    HE   ARG  44           HE       ARG  44  -8.289  -7.368 -16.278
  352   1HH1  ARG  44          HH11      ARG  44  -7.405 -10.709 -15.927
  353   2HH1  ARG  44          HH12      ARG  44  -7.899 -11.132 -17.533
  354   1HH2  ARG  44          HH21      ARG  44  -8.926  -7.929 -18.360
  355   2HH2  ARG  44          HH22      ARG  44  -8.756  -9.564 -18.903
  356    H    THR  45           HN       THR  45  -7.176  -7.480  -9.393
  357    HA   THR  45           HA       THR  45  -5.229  -9.489  -8.566
  358    HB   THR  45           HB       THR  45  -6.439  -7.275  -6.889
  359    HG1  THR  45           HG1      THR  45  -5.601  -6.352  -8.727
  360   1HG2  THR  45          HG23      THR  45  -5.122  -8.987  -5.684
  361   2HG2  THR  45          HG22      THR  45  -3.768  -8.704  -6.779
  362   3HG2  THR  45          HG21      THR  45  -4.301  -7.426  -5.686
  363    H    TYR  46           HN       TYR  46  -8.618  -8.854  -7.993
  364    HA   TYR  46           HA       TYR  46  -8.932 -10.412  -5.603
  365   1HB   TYR  46           HB2      TYR  46 -10.620  -8.787  -6.573
  366   2HB   TYR  46           HB1      TYR  46 -11.004 -10.015  -7.778
  367    HD1  TYR  46           HD2      TYR  46 -10.411  -9.933  -4.066
  368    HD2  TYR  46           HD1      TYR  46 -12.894 -11.276  -7.303
  369    HE1  TYR  46           HE2      TYR  46 -11.915 -11.058  -2.445
  370    HE2  TYR  46           HE1      TYR  46 -14.398 -12.400  -5.683
  371    HH   TYR  46           HH       TYR  46 -14.984 -12.116  -3.219
  372    H    GLU  47           HN       GLU  47  -8.919 -11.236  -9.037
  373    HA   GLU  47           HA       GLU  47  -9.625 -14.047  -8.460
  374   1HB   GLU  47           HB2      GLU  47  -9.011 -12.544 -11.017
  375   2HB   GLU  47           HB1      GLU  47  -9.312 -14.281 -10.972
  376   1HG   GLU  47           HG2      GLU  47 -11.543 -14.007 -10.285
  377   2HG   GLU  47           HG1      GLU  47 -11.260 -12.365  -9.707
  378    H    SER  48           HN       SER  48  -6.810 -12.076  -9.009
  379    HA   SER  48           HA       SER  48  -4.979 -14.097  -9.866
  380   1HB   SER  48           HB2      SER  48  -4.533 -11.624  -9.893
  381   2HB   SER  48           HB1      SER  48  -4.363 -11.680  -8.140
  382    HG   SER  48           HG       SER  48  -2.363 -11.886  -9.320
  383    H    PHE  49           HN       PHE  49  -6.422 -13.436  -6.781
  384    HA   PHE  49           HA       PHE  49  -4.462 -14.614  -5.066
  385   1HB   PHE  49           HB2      PHE  49  -7.479 -14.457  -4.787
  386   2HB   PHE  49           HB1      PHE  49  -6.382 -14.942  -3.493
  387    HD1  PHE  49           HD2      PHE  49  -4.178 -13.206  -3.493
  388    HD2  PHE  49           HD1      PHE  49  -8.239 -12.273  -4.540
  389    HE1  PHE  49           HE2      PHE  49  -3.772 -10.822  -2.942
  390    HE2  PHE  49           HE1      PHE  49  -7.833  -9.889  -3.990
  391    HZ   PHE  49           HZ       PHE  49  -5.599  -9.164  -3.190
  392    HA   PRO  50           HA       PRO  50  -4.981 -18.965  -5.846
  393   1HB   PRO  50           HB2      PRO  50  -4.349 -19.902  -3.289
  394   2HB   PRO  50           HB1      PRO  50  -3.187 -19.499  -4.560
  395   1HG   PRO  50           HG2      PRO  50  -3.647 -18.140  -2.078
  396   2HG   PRO  50           HG1      PRO  50  -2.453 -17.770  -3.331
  397   1HD   PRO  50           HD2      PRO  50  -4.989 -16.439  -2.762
  398   2HD   PRO  50           HD1      PRO  50  -3.648 -15.903  -3.788
  399    H    LYS  51           HN       LYS  51  -5.982 -18.675  -2.428
  400    HA   LYS  51           HA       LYS  51  -8.523 -20.064  -3.163
  401   1HB   LYS  51           HB2      LYS  51  -8.611 -20.644  -0.712
  402   2HB   LYS  51           HB1      LYS  51  -7.227 -21.334  -1.559
  403   1HG   LYS  51           HG2      LYS  51  -5.719 -20.035  -0.435
  404   2HG   LYS  51           HG1      LYS  51  -6.797 -18.640  -0.395
  405   1HD   LYS  51           HD2      LYS  51  -8.065 -19.580   1.429
  406   2HD   LYS  51           HD1      LYS  51  -7.208 -21.116   1.300
  407   1HE   LYS  51           HE2      LYS  51  -5.944 -18.458   2.032
  408   2HE   LYS  51           HE1      LYS  51  -6.323 -19.755   3.164
  409   1HZ   LYS  51           HZ1      LYS  51  -4.538 -20.080   0.817
  410   2HZ   LYS  51           HZ3      LYS  51  -3.983 -19.734   2.381
  411   3HZ   LYS  51           HZ2      LYS  51  -4.797 -21.194   2.074
  412    H    ARG  52           HN       ARG  52  -9.253 -17.833  -3.848
  413    HA   ARG  52           HA       ARG  52  -9.695 -15.840  -1.758
  414   1HB   ARG  52           HB2      ARG  52 -11.009 -14.674  -3.544
  415   2HB   ARG  52           HB1      ARG  52  -9.373 -15.092  -4.055
  416   1HG   ARG  52           HG2      ARG  52 -10.424 -17.268  -4.976
  417   2HG   ARG  52           HG1      ARG  52 -11.968 -16.433  -4.805
  418   1HD   ARG  52           HD2      ARG  52  -9.730 -15.003  -6.183
  419   2HD   ARG  52           HD1      ARG  52 -10.584 -16.270  -7.064
  420    HE   ARG  52           HE       ARG  52 -11.712 -13.681  -6.223
  421   1HH1  ARG  52          HH11      ARG  52 -12.258 -16.908  -7.389
  422   2HH1  ARG  52          HH12      ARG  52 -13.828 -16.541  -8.023
  423   1HH2  ARG  52          HH21      ARG  52 -13.750 -13.217  -7.050
  424   2HH2  ARG  52          HH22      ARG  52 -14.668 -14.461  -7.831
  425    HA   PRO  53           HA       PRO  53 -11.263 -14.134  -1.604
  426   1HB   PRO  53           HB2      PRO  53 -12.834 -13.462   0.617
  427   2HB   PRO  53           HB1      PRO  53 -13.232 -13.134  -1.075
  428   1HG   PRO  53           HG2      PRO  53 -14.520 -14.951   0.723
  429   2HG   PRO  53           HG1      PRO  53 -14.924 -14.607  -0.965
  430   1HD   PRO  53           HD2      PRO  53 -13.513 -16.910   0.158
  431   2HD   PRO  53           HD1      PRO  53 -14.224 -16.708  -1.452
  432    H    LEU  54           HN       LEU  54 -10.301 -12.912   0.354
  433    HA   LEU  54           HA       LEU  54  -8.800 -14.868   1.993
  434   1HB   LEU  54           HB2      LEU  54  -8.426 -11.876   1.677
  435   2HB   LEU  54           HB1      LEU  54  -7.326 -12.973   2.513
  436    HG   LEU  54           HG       LEU  54  -8.087 -13.262  -0.405
  437   1HD1  LEU  54          HD11      LEU  54  -6.728 -11.152   0.366
  438   2HD1  LEU  54          HD13      LEU  54  -5.410 -12.305   0.569
  439   3HD1  LEU  54          HD12      LEU  54  -6.157 -12.092  -1.014
  440   1HD2  LEU  54          HD23      LEU  54  -6.084 -14.586   1.434
  441   2HD2  LEU  54          HD22      LEU  54  -7.343 -15.352   0.466
  442   3HD2  LEU  54          HD21      LEU  54  -5.927 -14.655  -0.322
  443    HA   PRO  55           HA       PRO  55 -11.631 -13.712   5.361
  444   1HB   PRO  55           HB2      PRO  55 -10.723 -15.788   7.015
  445   2HB   PRO  55           HB1      PRO  55 -12.110 -15.857   5.922
  446   1HG   PRO  55           HG2      PRO  55  -9.626 -17.253   5.706
  447   2HG   PRO  55           HG1      PRO  55 -11.019 -17.321   4.617
  448   1HD   PRO  55           HD2      PRO  55  -8.485 -15.906   4.275
  449   2HD   PRO  55           HD1      PRO  55  -9.739 -16.263   3.077
  450    H    GLU  56           HN       GLU  56 -11.115 -13.682   7.930
  451    HA   GLU  56           HA       GLU  56  -9.900 -12.624   9.631
  452   1HB   GLU  56           HB2      GLU  56  -7.474 -13.413   7.989
  453   2HB   GLU  56           HB1      GLU  56  -7.506 -13.022   9.709
  454   1HG   GLU  56           HG2      GLU  56  -9.095 -14.952  10.039
  455   2HG   GLU  56           HG1      GLU  56  -8.814 -15.395   8.355
  456    H    ARG  57           HN       ARG  57 -10.729 -11.156   7.164
  457    HA   ARG  57           HA       ARG  57  -9.533  -8.627   7.756
  458   1HB   ARG  57           HB2      ARG  57  -8.274  -8.298   5.625
  459   2HB   ARG  57           HB1      ARG  57  -7.550  -9.533   6.653
  460   1HG   ARG  57           HG2      ARG  57  -9.115 -11.157   5.271
  461   2HG   ARG  57           HG1      ARG  57  -9.058  -9.855   4.082
  462   1HD   ARG  57           HD2      ARG  57  -7.229 -11.241   3.506
  463   2HD   ARG  57           HD1      ARG  57  -6.498  -9.918   4.413
  464    HE   ARG  57           HE       ARG  57  -7.140 -11.964   6.268
  465   1HH1  ARG  57          HH11      ARG  57  -5.062 -11.412   3.540
  466   2HH1  ARG  57          HH12      ARG  57  -3.843 -12.509   4.096
  467   1HH2  ARG  57          HH21      ARG  57  -5.551 -13.384   6.980
  468   2HH2  ARG  57          HH22      ARG  57  -4.119 -13.620   6.034
  469    H    THR  58           HN       THR  58 -10.032  -7.069   5.730
  470    HA   THR  58           HA       THR  58 -12.779  -7.808   4.804
  471    HB   THR  58           HB       THR  58 -11.685  -4.998   5.012
  472    HG1  THR  58           HG1      THR  58 -11.960  -6.575   7.011
  473   1HG2  THR  58          HG22      THR  58 -14.421  -6.258   4.795
  474   2HG2  THR  58          HG21      THR  58 -14.196  -4.583   5.299
  475   3HG2  THR  58          HG23      THR  58 -13.666  -5.101   3.699
  476    H    ASN  59           HN       ASN  59 -12.671  -8.447   2.705
  477    HA   ASN  59           HA       ASN  59 -10.593  -7.383   0.911
  478   1HB   ASN  59           HB2      ASN  59 -12.795  -9.432   0.566
  479   2HB   ASN  59           HB1      ASN  59 -11.747  -8.926  -0.759
  480   1HD2  ASN  59          HD22      ASN  59  -9.801 -10.717   2.396
  481   2HD2  ASN  59          HD21      ASN  59 -11.000  -9.558   2.714
  482    H    VAL  60           HN       VAL  60 -10.998  -5.348   0.159
  483    HA   VAL  60           HA       VAL  60 -13.790  -4.635  -0.601
  484    HB   VAL  60           HB       VAL  60 -11.363  -2.832  -0.357
  485   1HG1  VAL  60          HG11      VAL  60 -14.333  -2.350  -0.687
  486   2HG1  VAL  60          HG13      VAL  60 -13.217  -1.094  -0.152
  487   3HG1  VAL  60          HG12      VAL  60 -13.029  -1.819  -1.749
  488   1HG2  VAL  60          HG22      VAL  60 -12.018  -3.950   1.796
  489   2HG2  VAL  60          HG21      VAL  60 -12.238  -2.200   1.825
  490   3HG2  VAL  60          HG23      VAL  60 -13.631  -3.262   1.614
  491    H    VAL  61           HN       VAL  61 -14.225  -5.064  -2.707
  492    HA   VAL  61           HA       VAL  61 -12.033  -4.938  -4.704
  493    HB   VAL  61           HB       VAL  61 -14.908  -5.836  -5.069
  494   1HG1  VAL  61          HG12      VAL  61 -12.386  -6.180  -6.720
  495   2HG1  VAL  61          HG11      VAL  61 -13.906  -7.013  -7.045
  496   3HG1  VAL  61          HG13      VAL  61 -13.822  -5.256  -7.166
  497   1HG2  VAL  61          HG22      VAL  61 -12.398  -7.437  -4.472
  498   2HG2  VAL  61          HG21      VAL  61 -13.777  -7.230  -3.393
  499   3HG2  VAL  61          HG23      VAL  61 -13.962  -8.131  -4.897
  500    H    LEU  62           HN       LEU  62 -11.804  -3.163  -5.966
  501    HA   LEU  62           HA       LEU  62 -14.049  -1.199  -6.053
  502   1HB   LEU  62           HB2      LEU  62 -11.757  -0.486  -5.218
  503   2HB   LEU  62           HB1      LEU  62 -11.167  -0.740  -6.861
  504    HG   LEU  62           HG       LEU  62 -13.105   0.802  -7.592
  505   1HD1  LEU  62          HD13      LEU  62 -12.937   1.459  -4.635
  506   2HD1  LEU  62          HD12      LEU  62 -13.805   2.417  -5.835
  507   3HD1  LEU  62          HD11      LEU  62 -14.332   0.775  -5.469
  508   1HD2  LEU  62          HD22      LEU  62 -10.762   1.836  -5.966
  509   2HD2  LEU  62          HD21      LEU  62 -10.782   1.519  -7.700
  510   3HD2  LEU  62          HD23      LEU  62 -11.744   2.838  -7.034
  511    H    THR  63           HN       THR  63 -15.264  -1.369  -7.867
  512    HA   THR  63           HA       THR  63 -13.877  -1.678 -10.480
  513    HB   THR  63           HB       THR  63 -14.599  -3.936  -9.927
  514    HG1  THR  63           HG1      THR  63 -16.256  -4.139 -11.610
  515   1HG2  THR  63          HG21      THR  63 -17.286  -2.634  -9.418
  516   2HG2  THR  63          HG23      THR  63 -17.030  -4.376  -9.509
  517   3HG2  THR  63          HG22      THR  63 -16.260  -3.437  -8.230
  518    H    HIS  64           HN       HIS  64 -14.858  -0.501 -12.121
  519    HA   HIS  64           HA       HIS  64 -16.994   1.358 -11.284
  520   1HB   HIS  64           HB2      HIS  64 -15.332   1.167 -13.814
  521   2HB   HIS  64           HB1      HIS  64 -16.546   2.412 -13.518
  522    HD1  HIS  64           HD1      HIS  64 -13.155   1.249 -12.385
  523    HD2  HIS  64           HD2      HIS  64 -15.790   4.387 -11.619
  524    HE1  HIS  64           HE1      HIS  64 -11.865   2.951 -11.024
  525    H    GLN  65           HN       GLN  65 -17.589  -1.512 -11.704
  526    HA   GLN  65           HA       GLN  65 -19.738  -1.155 -13.738
  527   1HB   GLN  65           HB2      GLN  65 -17.732  -3.407 -13.567
  528   2HB   GLN  65           HB1      GLN  65 -19.297  -3.621 -14.353
  529   1HG   GLN  65           HG2      GLN  65 -18.743  -1.549 -15.733
  530   2HG   GLN  65           HG1      GLN  65 -17.100  -1.681 -15.103
  531   1HE2  GLN  65          HE21      GLN  65 -19.571  -3.864 -16.596
  532   2HE2  GLN  65          HE22      GLN  65 -18.453  -4.695 -17.567
  533    H    GLU  66           HN       GLU  66 -21.669  -1.656 -12.839
  534    HA   GLU  66           HA       GLU  66 -21.759  -2.976 -10.215
  535   1HB   GLU  66           HB2      GLU  66 -23.809  -1.682 -12.013
  536   2HB   GLU  66           HB1      GLU  66 -24.299  -2.621 -10.602
  537   1HG   GLU  66           HG2      GLU  66 -24.133  -0.419  -9.769
  538   2HG   GLU  66           HG1      GLU  66 -22.603  -1.158  -9.297
  539    H    ASP  67           HN       ASP  67 -20.902  -4.527 -12.600
  540    HA   ASP  67           HA       ASP  67 -23.136  -6.495 -12.811
  541   1HB   ASP  67           HB2      ASP  67 -21.984  -5.508 -14.896
  542   2HB   ASP  67           HB1      ASP  67 -20.598  -6.505 -14.450
  543    H    TYR  68           HN       TYR  68 -19.713  -6.159 -11.959
  544    HA   TYR  68           HA       TYR  68 -19.295  -8.965 -11.397
  545   1HB   TYR  68           HB2      TYR  68 -17.495  -7.208 -11.840
  546   2HB   TYR  68           HB1      TYR  68 -17.766  -6.650 -10.189
  547    HD1  TYR  68           HD2      TYR  68 -17.272  -9.890 -12.028
  548    HD2  TYR  68           HD1      TYR  68 -16.415  -7.554  -8.526
  549    HE1  TYR  68           HE2      TYR  68 -15.816 -11.707 -11.173
  550    HE2  TYR  68           HE1      TYR  68 -14.959  -9.371  -7.671
  551    HH   TYR  68           HH       TYR  68 -14.327 -12.284  -9.609
  552    H    GLN  69           HN       GLN  69 -19.423 -10.043  -9.412
  553    HA   GLN  69           HA       GLN  69 -20.299  -8.521  -7.023
  554   1HB   GLN  69           HB2      GLN  69 -21.864 -10.784  -8.295
  555   2HB   GLN  69           HB1      GLN  69 -22.138 -10.217  -6.647
  556   1HG   GLN  69           HG2      GLN  69 -22.376  -7.867  -7.708
  557   2HG   GLN  69           HG1      GLN  69 -22.562  -8.729  -9.236
  558   1HE2  GLN  69          HE22      GLN  69 -25.629  -8.665  -6.583
  559   2HE2  GLN  69          HE21      GLN  69 -24.167  -7.862  -6.263
  560    H    ALA  70           HN       ALA  70 -18.515  -9.103  -5.813
  561    HA   ALA  70           HA       ALA  70 -17.588 -11.905  -5.799
  562   1HB   ALA  70           HB3      ALA  70 -16.008  -9.927  -5.747
  563   2HB   ALA  70           HB2      ALA  70 -16.591  -9.592  -4.116
  564   3HB   ALA  70           HB1      ALA  70 -15.751 -11.104  -4.460
  565    H    GLN  71           HN       GLN  71 -18.535 -13.341  -4.450
  566    HA   GLN  71           HA       GLN  71 -20.296 -12.507  -2.296
  567   1HB   GLN  71           HB2      GLN  71 -19.260 -15.161  -3.283
  568   2HB   GLN  71           HB1      GLN  71 -20.176 -15.055  -1.779
  569   1HG   GLN  71           HG2      GLN  71 -22.094 -14.176  -2.892
  570   2HG   GLN  71           HG1      GLN  71 -21.182 -13.863  -4.369
  571   1HE2  GLN  71          HE22      GLN  71 -22.857 -17.488  -3.814
  572   2HE2  GLN  71          HE21      GLN  71 -23.139 -16.187  -2.760
  573    H    GLY  72           HN       GLY  72 -19.833 -12.350  -0.128
  574   1HA   GLY  72           HA2      GLY  72 -18.596 -12.439   1.873
  575   2HA   GLY  72           HA1      GLY  72 -17.518 -13.599   1.094
  576    H    ALA  73           HN       ALA  73 -18.277 -10.346  -0.081
  577    HA   ALA  73           HA       ALA  73 -15.717  -9.255   0.845
  578   1HB   ALA  73           HB1      ALA  73 -16.225  -9.795  -2.096
  579   2HB   ALA  73           HB3      ALA  73 -14.937  -8.753  -1.489
  580   3HB   ALA  73           HB2      ALA  73 -14.932 -10.474  -1.105
  581    H    VAL  74           HN       VAL  74 -15.701  -6.982   0.724
  582    HA   VAL  74           HA       VAL  74 -18.310  -5.723   0.403
  583    HB   VAL  74           HB       VAL  74 -15.606  -4.411   0.815
  584   1HG1  VAL  74          HG11      VAL  74 -17.544  -2.968   0.085
  585   2HG1  VAL  74          HG13      VAL  74 -18.390  -3.464   1.551
  586   3HG1  VAL  74          HG12      VAL  74 -16.888  -2.545   1.666
  587   1HG2  VAL  74          HG23      VAL  74 -17.639  -5.445   2.819
  588   2HG2  VAL  74          HG22      VAL  74 -16.007  -6.067   2.571
  589   3HG2  VAL  74          HG21      VAL  74 -16.244  -4.448   3.231
  590    H    VAL  75           HN       VAL  75 -18.945  -5.737  -1.751
  591    HA   VAL  75           HA       VAL  75 -17.090  -5.001  -3.891
  592    HB   VAL  75           HB       VAL  75 -20.105  -5.301  -4.003
  593   1HG1  VAL  75          HG11      VAL  75 -18.720  -4.154  -5.891
  594   2HG1  VAL  75          HG13      VAL  75 -18.136  -5.783  -6.230
  595   3HG1  VAL  75          HG12      VAL  75 -19.860  -5.424  -6.336
  596   1HG2  VAL  75          HG23      VAL  75 -19.018  -7.338  -3.111
  597   2HG2  VAL  75          HG22      VAL  75 -19.643  -7.612  -4.737
  598   3HG2  VAL  75          HG21      VAL  75 -17.917  -7.349  -4.488
  599    H    VAL  76           HN       VAL  76 -16.442  -2.866  -3.659
  600    HA   VAL  76           HA       VAL  76 -18.546  -0.791  -3.301
  601    HB   VAL  76           HB       VAL  76 -16.591   0.744  -2.964
  602   1HG1  VAL  76          HG13      VAL  76 -17.740  -0.549  -1.101
  603   2HG1  VAL  76          HG12      VAL  76 -16.422  -1.716  -1.207
  604   3HG1  VAL  76          HG11      VAL  76 -16.085  -0.046  -0.754
  605   1HG2  VAL  76          HG21      VAL  76 -15.121  -0.973  -4.353
  606   2HG2  VAL  76          HG23      VAL  76 -14.391  -0.006  -3.071
  607   3HG2  VAL  76          HG22      VAL  76 -14.839  -1.684  -2.763
  608    H    HIS  77           HN       HIS  77 -18.494   1.100  -4.743
  609    HA   HIS  77           HA       HIS  77 -17.165   0.630  -7.367
  610   1HB   HIS  77           HB2      HIS  77 -20.092   1.360  -7.021
  611   2HB   HIS  77           HB1      HIS  77 -19.240   1.203  -8.558
  612    HD1  HIS  77           HD1      HIS  77 -18.725  -1.172  -9.408
  613    HD2  HIS  77           HD2      HIS  77 -20.600  -1.132  -5.685
  614    HE1  HIS  77           HE1      HIS  77 -19.412  -3.561  -8.927
  615    H    ASP  78           HN       ASP  78 -16.694   2.483  -5.093
  616    HA   ASP  78           HA       ASP  78 -16.359   4.917  -6.629
  617   1HB   ASP  78           HB2      ASP  78 -18.843   4.888  -5.867
  618   2HB   ASP  78           HB1      ASP  78 -18.197   5.209  -4.257
  619    H    VAL  79           HN       VAL  79 -14.946   6.372  -5.554
  620    HA   VAL  79           HA       VAL  79 -13.235   5.198  -3.555
  621    HB   VAL  79           HB       VAL  79 -13.430   8.115  -4.365
  622   1HG1  VAL  79          HG13      VAL  79 -11.203   6.442  -3.162
  623   2HG1  VAL  79          HG12      VAL  79 -11.021   8.107  -3.715
  624   3HG1  VAL  79          HG11      VAL  79 -12.086   7.740  -2.359
  625   1HG2  VAL  79          HG22      VAL  79 -12.102   5.725  -5.641
  626   2HG2  VAL  79          HG21      VAL  79 -13.085   6.977  -6.403
  627   3HG2  VAL  79          HG23      VAL  79 -11.446   7.347  -5.866
  628    H    ALA  80           HN       ALA  80 -15.971   7.407  -3.436
  629    HA   ALA  80           HA       ALA  80 -15.602   8.300  -0.727
  630   1HB   ALA  80           HB3      ALA  80 -17.152   9.312  -2.482
  631   2HB   ALA  80           HB2      ALA  80 -18.257   7.980  -2.145
  632   3HB   ALA  80           HB1      ALA  80 -17.846   9.128  -0.871
  633    H    ALA  81           HN       ALA  81 -17.138   5.465  -2.160
  634    HA   ALA  81           HA       ALA  81 -18.449   4.565   0.250
  635   1HB   ALA  81           HB2      ALA  81 -19.056   3.772  -2.035
  636   2HB   ALA  81           HB1      ALA  81 -17.509   2.929  -2.126
  637   3HB   ALA  81           HB3      ALA  81 -18.711   2.440  -0.931
  638    H    VAL  82           HN       VAL  82 -15.245   4.050  -1.152
  639    HA   VAL  82           HA       VAL  82 -14.427   1.968   0.663
  640    HB   VAL  82           HB       VAL  82 -12.676   3.995  -0.760
  641   1HG1  VAL  82          HG12      VAL  82 -11.549   2.659   0.988
  642   2HG1  VAL  82          HG11      VAL  82 -12.143   1.178   0.235
  643   3HG1  VAL  82          HG13      VAL  82 -10.989   2.202  -0.620
  644   1HG2  VAL  82          HG21      VAL  82 -14.306   2.772  -2.253
  645   2HG2  VAL  82          HG23      VAL  82 -12.612   2.446  -2.616
  646   3HG2  VAL  82          HG22      VAL  82 -13.566   1.261  -1.723
  647    H    PHE  83           HN       PHE  83 -14.032   5.511   0.696
  648    HA   PHE  83           HA       PHE  83 -12.583   5.533   3.209
  649   1HB   PHE  83           HB2      PHE  83 -13.959   7.651   1.553
  650   2HB   PHE  83           HB1      PHE  83 -13.267   8.025   3.131
  651    HD1  PHE  83           HD2      PHE  83 -10.810   6.867   3.454
  652    HD2  PHE  83           HD1      PHE  83 -12.580   8.067  -0.271
  653    HE1  PHE  83           HE2      PHE  83  -8.556   7.022   2.432
  654    HE2  PHE  83           HE1      PHE  83 -10.326   8.221  -1.293
  655    HZ   PHE  83           HZ       PHE  83  -8.313   7.698   0.059
  656    H    ALA  84           HN       ALA  84 -15.965   5.662   2.272
  657    HA   ALA  84           HA       ALA  84 -17.014   6.603   4.778
  658   1HB   ALA  84           HB2      ALA  84 -18.254   6.474   2.557
  659   2HB   ALA  84           HB1      ALA  84 -18.412   4.741   2.842
  660   3HB   ALA  84           HB3      ALA  84 -19.154   5.889   3.956
  661    H    TYR  85           HN       TYR  85 -16.212   3.387   3.535
  662    HA   TYR  85           HA       TYR  85 -17.351   1.942   5.770
  663   1HB   TYR  85           HB2      TYR  85 -16.772   1.002   3.460
  664   2HB   TYR  85           HB1      TYR  85 -15.093   0.988   3.997
  665    HD1  TYR  85           HD2      TYR  85 -18.466  -0.416   4.577
  666    HD2  TYR  85           HD1      TYR  85 -14.314  -0.579   5.668
  667    HE1  TYR  85           HE2      TYR  85 -18.863  -2.554   5.769
  668    HE2  TYR  85           HE1      TYR  85 -14.711  -2.716   6.860
  669    HH   TYR  85           HH       TYR  85 -17.568  -4.524   6.488
  670    H    ALA  86           HN       ALA  86 -14.191   3.347   5.065
  671    HA   ALA  86           HA       ALA  86 -12.796   2.119   7.272
  672   1HB   ALA  86           HB2      ALA  86 -12.219   4.712   5.805
  673   2HB   ALA  86           HB1      ALA  86 -11.097   3.872   6.874
  674   3HB   ALA  86           HB3      ALA  86 -11.602   3.120   5.360
  675    H    LYS  87           HN       LYS  87 -14.798   4.986   6.932
  676    HA   LYS  87           HA       LYS  87 -14.058   6.244   9.412
  677   1HB   LYS  87           HB2      LYS  87 -16.466   6.431   7.603
  678   2HB   LYS  87           HB1      LYS  87 -16.406   7.308   9.133
  679   1HG   LYS  87           HG2      LYS  87 -14.338   8.425   8.445
  680   2HG   LYS  87           HG1      LYS  87 -14.324   7.509   6.938
  681   1HD   LYS  87           HD2      LYS  87 -15.279   9.606   6.362
  682   2HD   LYS  87           HD1      LYS  87 -16.653   8.507   6.501
  683   1HE   LYS  87           HE2      LYS  87 -17.240   9.349   8.652
  684   2HE   LYS  87           HE1      LYS  87 -15.698  10.188   8.825
  685   1HZ   LYS  87           HZ2      LYS  87 -16.325  11.610   6.957
  686   2HZ   LYS  87           HZ1      LYS  87 -17.829  10.828   6.858
  687   3HZ   LYS  87           HZ3      LYS  87 -17.437  11.734   8.237
  688    H    GLN  88           HN       GLN  88 -16.425   3.769   8.547
  689    HA   GLN  88           HA       GLN  88 -17.797   3.755  11.087
  690   1HB   GLN  88           HB2      GLN  88 -17.587   1.815   8.789
  691   2HB   GLN  88           HB1      GLN  88 -18.421   1.363  10.276
  692   1HG   GLN  88           HG2      GLN  88 -19.715   3.581  10.008
  693   2HG   GLN  88           HG1      GLN  88 -19.102   3.587   8.354
  694   1HE2  GLN  88          HE22      GLN  88 -20.868   0.399   7.654
  695   2HE2  GLN  88          HE21      GLN  88 -19.270   0.965   7.549
  696    H    HIS  89           HN       HIS  89 -14.991   2.031   9.790
  697    HA   HIS  89           HA       HIS  89 -14.532   0.903  12.526
  698   1HB   HIS  89           HB2      HIS  89 -14.022  -0.273   9.792
  699   2HB   HIS  89           HB1      HIS  89 -13.166  -0.858  11.219
  700    HD1  HIS  89           HD1      HIS  89 -14.295  -2.934  12.007
  701    HD2  HIS  89           HD2      HIS  89 -17.058  -0.078  10.743
  702    HE1  HIS  89           HE1      HIS  89 -16.589  -3.911  12.450
  703    HA   PRO  90           HA       PRO  90 -10.964   3.700  11.660
  704   1HB   PRO  90           HB2      PRO  90 -10.970   4.709  14.270
  705   2HB   PRO  90           HB1      PRO  90 -11.712   5.477  12.861
  706   1HG   PRO  90           HG2      PRO  90 -13.011   4.326  15.138
  707   2HG   PRO  90           HG1      PRO  90 -13.747   5.121  13.741
  708   1HD   PRO  90           HD2      PRO  90 -13.546   2.266  14.336
  709   2HD   PRO  90           HD1      PRO  90 -14.552   3.092  13.134
  710    H    ASP  91           HN       ASP  91 -11.211   0.835  12.836
  711    HA   ASP  91           HA       ASP  91  -8.877   0.889  14.686
  712   1HB   ASP  91           HB2      ASP  91 -11.059  -0.410  15.183
  713   2HB   ASP  91           HB1      ASP  91 -10.500  -1.550  13.959
  714    H    GLN  92           HN       GLN  92  -9.916  -0.207  11.516
  715    HA   GLN  92           HA       GLN  92  -7.346  -1.620  11.076
  716   1HB   GLN  92           HB2      GLN  92  -9.866  -1.346   9.419
  717   2HB   GLN  92           HB1      GLN  92  -8.409  -2.148   8.829
  718   1HG   GLN  92           HG2      GLN  92  -8.565  -3.876  10.415
  719   2HG   GLN  92           HG1      GLN  92  -9.621  -2.937  11.470
  720   1HE2  GLN  92          HE22      GLN  92 -12.472  -3.440   9.170
  721   2HE2  GLN  92          HE21      GLN  92 -11.695  -2.128   9.914
  722    H    GLU  93           HN       GLU  93  -6.495  -1.156   8.678
  723    HA   GLU  93           HA       GLU  93  -6.452   1.807   8.275
  724   1HB   GLU  93           HB2      GLU  93  -4.150  -0.154   8.311
  725   2HB   GLU  93           HB1      GLU  93  -4.022   1.429   7.545
  726   1HG   GLU  93           HG2      GLU  93  -3.228   1.781   9.749
  727   2HG   GLU  93           HG1      GLU  93  -4.888   2.379   9.782
  728    H    LEU  94           HN       LEU  94  -6.170   2.475   6.073
  729    HA   LEU  94           HA       LEU  94  -7.238   0.553   4.127
  730   1HB   LEU  94           HB2      LEU  94  -7.837   3.057   4.294
  731   2HB   LEU  94           HB1      LEU  94  -6.279   3.353   3.521
  732    HG   LEU  94           HG       LEU  94  -7.032   1.669   1.732
  733   1HD1  LEU  94          HD11      LEU  94  -9.594   2.135   3.261
  734   2HD1  LEU  94          HD13      LEU  94  -9.610   1.687   1.555
  735   3HD1  LEU  94          HD12      LEU  94  -8.889   0.604   2.745
  736   1HD2  LEU  94          HD23      LEU  94  -8.220   4.403   2.171
  737   2HD2  LEU  94          HD22      LEU  94  -6.956   3.916   1.041
  738   3HD2  LEU  94          HD21      LEU  94  -8.636   3.474   0.731
  739    H    VAL  95           HN       VAL  95  -5.780  -0.896   3.331
  740    HA   VAL  95           HA       VAL  95  -3.079   0.129   2.549
  741    HB   VAL  95           HB       VAL  95  -3.886  -2.736   3.129
  742   1HG1  VAL  95          HG12      VAL  95  -1.279  -1.336   2.521
  743   2HG1  VAL  95          HG11      VAL  95  -1.322  -2.895   3.344
  744   3HG1  VAL  95          HG13      VAL  95  -1.980  -2.740   1.716
  745   1HG2  VAL  95          HG23      VAL  95  -2.747  -0.547   4.855
  746   2HG2  VAL  95          HG22      VAL  95  -4.017  -1.710   5.237
  747   3HG2  VAL  95          HG21      VAL  95  -2.332  -2.231   5.177
  748    H    ILE  96           HN       ILE  96  -2.573   0.049   0.406
  749    HA   ILE  96           HA       ILE  96  -4.557  -1.184  -1.435
  750    HB   ILE  96           HB       ILE  96  -2.222   0.628  -2.103
  751   1HG1  ILE  96          HG12      ILE  96  -3.790   1.765  -0.568
  752   2HG1  ILE  96          HG11      ILE  96  -3.889   2.451  -2.187
  753   1HG2  ILE  96          HG22      ILE  96  -3.193  -0.785  -3.937
  754   2HG2  ILE  96          HG21      ILE  96  -4.747  -0.002  -3.655
  755   3HG2  ILE  96          HG23      ILE  96  -3.370   0.947  -4.213
  756   1HD1  ILE  96          HD13      ILE  96  -5.868   0.971  -2.633
  757   2HD1  ILE  96          HD12      ILE  96  -5.806   0.452  -0.948
  758   3HD1  ILE  96          HD11      ILE  96  -6.147   2.138  -1.340
  759    H    ALA  97           HN       ALA  97  -4.083  -3.092  -2.401
  760    HA   ALA  97           HA       ALA  97  -1.248  -4.035  -2.325
  761   1HB   ALA  97           HB1      ALA  97  -3.900  -5.414  -2.161
  762   2HB   ALA  97           HB3      ALA  97  -2.549  -6.287  -2.884
  763   3HB   ALA  97           HB2      ALA  97  -2.431  -5.696  -1.226
  764    H    GLY  98           HN       GLY  98  -3.977  -3.351  -4.406
  765   1HA   GLY  98           HA2      GLY  98  -2.626  -2.882  -6.756
  766   2HA   GLY  98           HA1      GLY  98  -2.822  -4.636  -6.762
  767    H    GLY  99           HN       GLY  99  -5.830  -3.419  -8.514
  768   1HA   GLY  99           HA2      GLY  99  -3.042  -4.308  -8.823
  769   2HA   GLY  99           HA1      GLY  99  -4.196  -4.029 -10.129
  770    H    ALA 100           HN       ALA 100  -2.639  -2.766 -11.298
  771    HA   ALA 100           HA       ALA 100  -1.309  -0.474 -10.179
  772   1HB   ALA 100           HB2      ALA 100  -1.949  -1.323 -13.009
  773   2HB   ALA 100           HB1      ALA 100  -1.101   0.182 -12.657
  774   3HB   ALA 100           HB3      ALA 100  -0.389  -1.361 -12.187
  775    H    GLN 101           HN       GLN 101  -4.452  -0.959 -11.691
  776    HA   GLN 101           HA       GLN 101  -5.064   1.847 -12.037
  777   1HB   GLN 101           HB2      GLN 101  -6.208  -0.173 -13.156
  778   2HB   GLN 101           HB1      GLN 101  -7.102  -0.350 -11.645
  779   1HG   GLN 101           HG2      GLN 101  -8.042   1.858 -11.854
  780   2HG   GLN 101           HG1      GLN 101  -6.992   2.234 -13.220
  781   1HE2  GLN 101          HE22      GLN 101  -8.856   0.043 -15.466
  782   2HE2  GLN 101          HE21      GLN 101  -7.250   0.447 -15.092
  783    H    ILE 102           HN       ILE 102  -5.381  -0.446  -9.394
  784    HA   ILE 102           HA       ILE 102  -7.126   1.244  -7.788
  785    HB   ILE 102           HB       ILE 102  -5.328  -1.021  -6.881
  786   1HG1  ILE 102          HG12      ILE 102  -6.804  -1.748  -8.726
  787   2HG1  ILE 102          HG11      ILE 102  -7.306  -2.469  -7.199
  788   1HG2  ILE 102          HG23      ILE 102  -6.233   0.388  -5.073
  789   2HG2  ILE 102          HG22      ILE 102  -7.863   0.163  -5.709
  790   3HG2  ILE 102          HG21      ILE 102  -6.974  -1.212  -5.052
  791   1HD1  ILE 102          HD11      ILE 102  -9.001  -0.626  -6.959
  792   2HD1  ILE 102          HD13      ILE 102  -8.566  -0.079  -8.579
  793   3HD1  ILE 102          HD12      ILE 102  -9.288  -1.672  -8.350
  794    H    PHE 103           HN       PHE 103  -3.640   0.737  -8.073
  795    HA   PHE 103           HA       PHE 103  -2.863   2.195  -5.732
  796   1HB   PHE 103           HB2      PHE 103  -1.469   1.539  -8.329
  797   2HB   PHE 103           HB1      PHE 103  -0.686   2.519  -7.091
  798    HD1  PHE 103           HD1      PHE 103  -1.347   1.407  -4.574
  799    HD2  PHE 103           HD2      PHE 103  -0.711  -0.662  -8.283
  800    HE1  PHE 103           HE1      PHE 103  -0.745  -0.649  -3.323
  801    HE2  PHE 103           HE2      PHE 103  -0.110  -2.717  -7.034
  802    HZ   PHE 103           HZ       PHE 103  -0.127  -2.711  -4.554
  803    H    THR 104           HN       THR 104  -2.889   3.243  -9.161
  804    HA   THR 104           HA       THR 104  -2.372   5.997  -8.602
  805    HB   THR 104           HB       THR 104  -4.022   5.102 -10.957
  806    HG1  THR 104           HG1      THR 104  -2.499   3.659 -11.215
  807   1HG2  THR 104          HG22      THR 104  -1.772   7.100 -10.595
  808   2HG2  THR 104          HG21      THR 104  -2.648   6.807 -12.096
  809   3HG2  THR 104          HG23      THR 104  -3.488   7.491 -10.705
  810    H    ALA 105           HN       ALA 105  -5.247   4.088  -8.311
  811    HA   ALA 105           HA       ALA 105  -7.172   6.234  -8.520
  812   1HB   ALA 105           HB2      ALA 105  -7.325   3.540  -7.134
  813   2HB   ALA 105           HB1      ALA 105  -8.698   4.621  -7.366
  814   3HB   ALA 105           HB3      ALA 105  -7.886   3.915  -8.763
  815    H    PHE 106           HN       PHE 106  -5.277   4.859  -5.874
  816    HA   PHE 106           HA       PHE 106  -6.441   6.926  -4.050
  817   1HB   PHE 106           HB2      PHE 106  -5.228   4.209  -3.505
  818   2HB   PHE 106           HB1      PHE 106  -5.468   5.405  -2.230
  819    HD1  PHE 106           HD1      PHE 106  -7.750   6.176  -1.637
  820    HD2  PHE 106           HD2      PHE 106  -7.092   3.046  -4.506
  821    HE1  PHE 106           HE1      PHE 106 -10.132   5.509  -1.456
  822    HE2  PHE 106           HE2      PHE 106  -9.473   2.379  -4.325
  823    HZ   PHE 106           HZ       PHE 106 -10.993   3.610  -2.800
  824    H    LYS 107           HN       LYS 107  -4.034   6.904  -6.045
  825    HA   LYS 107           HA       LYS 107  -1.652   7.160  -4.453
  826   1HB   LYS 107           HB2      LYS 107  -0.727   8.320  -6.463
  827   2HB   LYS 107           HB1      LYS 107  -1.506   6.789  -6.861
  828   1HG   LYS 107           HG2      LYS 107  -2.564   8.067  -8.440
  829   2HG   LYS 107           HG1      LYS 107  -3.630   8.457  -7.090
  830   1HD   LYS 107           HD2      LYS 107  -2.714  10.561  -6.789
  831   2HD   LYS 107           HD1      LYS 107  -1.144  10.084  -7.439
  832   1HE   LYS 107           HE2      LYS 107  -2.077  11.462  -9.125
  833   2HE   LYS 107           HE1      LYS 107  -2.365   9.819  -9.697
  834   1HZ   LYS 107           HZ1      LYS 107  -4.503  10.485  -8.065
  835   2HZ   LYS 107           HZ3      LYS 107  -4.245  11.827  -9.069
  836   3HZ   LYS 107           HZ2      LYS 107  -4.510  10.295  -9.754
  837    H    ASP 108           HN       ASP 108  -4.317   9.292  -5.098
  838    HA   ASP 108           HA       ASP 108  -3.005  11.792  -4.556
  839   1HB   ASP 108           HB2      ASP 108  -5.334  11.386  -5.594
  840   2HB   ASP 108           HB1      ASP 108  -5.902  11.213  -3.932
  841    H    ASP 109           HN       ASP 109  -4.826   9.533  -2.478
  842    HA   ASP 109           HA       ASP 109  -3.953  11.088  -0.095
  843   1HB   ASP 109           HB2      ASP 109  -5.933   8.798  -0.318
  844   2HB   ASP 109           HB1      ASP 109  -5.615   9.750   1.132
  845    H    VAL 110           HN       VAL 110  -1.904   9.706  -1.381
  846    HA   VAL 110           HA       VAL 110  -1.533   7.167   0.104
  847    HB   VAL 110           HB       VAL 110  -0.967   7.217  -2.300
  848   1HG1  VAL 110          HG13      VAL 110  -0.254   9.710  -2.126
  849   2HG1  VAL 110          HG12      VAL 110   1.319   9.069  -1.652
  850   3HG1  VAL 110          HG11      VAL 110   0.641   8.662  -3.227
  851   1HG2  VAL 110          HG22      VAL 110   0.417   5.958  -0.423
  852   2HG2  VAL 110          HG21      VAL 110   0.986   5.969  -2.092
  853   3HG2  VAL 110          HG23      VAL 110   1.690   7.076  -0.912
  854    H    ASP 111           HN       ASP 111   0.195   6.870   1.581
  855    HA   ASP 111           HA       ASP 111   1.727   9.307   2.359
  856   1HB   ASP 111           HB2      ASP 111  -0.406   8.711   3.809
  857   2HB   ASP 111           HB1      ASP 111   0.668   7.495   4.500
  858    H    THR 112           HN       THR 112   1.375   5.964   3.588
  859    HA   THR 112           HA       THR 112   4.302   5.705   3.733
  860    HB   THR 112           HB       THR 112   2.280   3.517   4.244
  861    HG1  THR 112           HG1      THR 112   2.492   5.876   5.474
  862   1HG2  THR 112          HG21      THR 112   5.061   4.154   5.257
  863   2HG2  THR 112          HG23      THR 112   4.043   2.882   5.934
  864   3HG2  THR 112          HG22      THR 112   4.578   2.785   4.256
  865    H    LEU 113           HN       LEU 113   5.458   5.028   2.004
  866    HA   LEU 113           HA       LEU 113   4.065   3.419  -0.092
  867   1HB   LEU 113           HB2      LEU 113   6.435   5.288  -0.172
  868   2HB   LEU 113           HB1      LEU 113   6.128   4.136  -1.473
  869    HG   LEU 113           HG       LEU 113   3.918   5.933  -0.507
  870   1HD1  LEU 113          HD11      LEU 113   6.162   6.629  -2.416
  871   2HD1  LEU 113          HD13      LEU 113   4.619   7.482  -2.401
  872   3HD1  LEU 113          HD12      LEU 113   5.659   7.515  -0.977
  873   1HD2  LEU 113          HD22      LEU 113   3.667   3.937  -2.128
  874   2HD2  LEU 113          HD21      LEU 113   2.983   5.481  -2.643
  875   3HD2  LEU 113          HD23      LEU 113   4.531   4.940  -3.295
  876    H    LEU 114           HN       LEU 114   4.369   1.336   0.756
  877    HA   LEU 114           HA       LEU 114   7.099   0.485   1.519
  878   1HB   LEU 114           HB2      LEU 114   4.447  -0.988   1.512
  879   2HB   LEU 114           HB1      LEU 114   5.969  -1.670   2.086
  880    HG   LEU 114           HG       LEU 114   4.912   0.936   3.177
  881   1HD1  LEU 114          HD12      LEU 114   4.341  -1.867   4.189
  882   2HD1  LEU 114          HD11      LEU 114   3.943  -0.377   5.043
  883   3HD1  LEU 114          HD13      LEU 114   3.155  -0.752   3.511
  884   1HD2  LEU 114          HD23      LEU 114   7.281   0.308   3.583
  885   2HD2  LEU 114          HD22      LEU 114   6.346   0.326   5.078
  886   3HD2  LEU 114          HD21      LEU 114   6.742  -1.209   4.304
  887    H    VAL 115           HN       VAL 115   8.427  -0.154  -0.102
  888    HA   VAL 115           HA       VAL 115   7.222  -1.664  -2.385
  889    HB   VAL 115           HB       VAL 115   7.926   0.601  -3.081
  890   1HG1  VAL 115          HG11      VAL 115   9.759   0.674  -1.260
  891   2HG1  VAL 115          HG13      VAL 115  10.763  -0.189  -2.425
  892   3HG1  VAL 115          HG12      VAL 115  10.131   1.410  -2.819
  893   1HG2  VAL 115          HG23      VAL 115   8.295  -1.578  -4.487
  894   2HG2  VAL 115          HG22      VAL 115   9.045  -0.076  -5.027
  895   3HG2  VAL 115          HG21      VAL 115  10.005  -1.283  -4.173
  896    H    THR 116           HN       THR 116   8.261  -3.556  -2.950
  897    HA   THR 116           HA       THR 116  10.625  -4.315  -1.286
  898    HB   THR 116           HB       THR 116   8.682  -6.149  -2.720
  899    HG1  THR 116           HG1      THR 116   7.946  -6.495  -0.525
  900   1HG2  THR 116          HG22      THR 116  10.811  -6.630  -0.617
  901   2HG2  THR 116          HG21      THR 116   9.684  -7.850  -1.209
  902   3HG2  THR 116          HG23      THR 116  10.875  -7.145  -2.302
  903    H    ARG 117           HN       ARG 117  12.363  -3.747  -2.568
  904    HA   ARG 117           HA       ARG 117  12.316  -4.309  -5.463
  905   1HB   ARG 117           HB2      ARG 117  14.515  -3.178  -3.703
  906   2HB   ARG 117           HB1      ARG 117  14.534  -3.233  -5.466
  907   1HG   ARG 117           HG2      ARG 117  12.715  -1.702  -5.636
  908   2HG   ARG 117           HG1      ARG 117  12.327  -1.861  -3.923
  909   1HD   ARG 117           HD2      ARG 117  14.478  -0.809  -3.332
  910   2HD   ARG 117           HD1      ARG 117  14.873  -0.652  -5.044
  911    HE   ARG 117           HE       ARG 117  13.010   1.032  -3.547
  912   1HH1  ARG 117          HH21      ARG 117  13.939  -0.206  -6.656
  913   2HH1  ARG 117          HH22      ARG 117  13.221   1.108  -7.527
  914   1HH2  ARG 117          HH11      ARG 117  12.082   2.733  -4.687
  915   2HH2  ARG 117          HH12      ARG 117  12.176   2.764  -6.417
  916    H    LEU 118           HN       LEU 118  13.467  -5.951  -6.454
  917    HA   LEU 118           HA       LEU 118  14.835  -7.889  -4.631
  918   1HB   LEU 118           HB2      LEU 118  12.965  -8.209  -6.899
  919   2HB   LEU 118           HB1      LEU 118  14.350  -9.300  -6.932
  920    HG   LEU 118           HG       LEU 118  13.836  -9.885  -4.529
  921   1HD1  LEU 118          HD11      LEU 118  12.503  -7.845  -4.042
  922   2HD1  LEU 118          HD13      LEU 118  11.255  -8.415  -5.152
  923   3HD1  LEU 118          HD12      LEU 118  11.604  -9.318  -3.679
  924   1HD2  LEU 118          HD21      LEU 118  13.111 -11.258  -6.513
  925   2HD2  LEU 118          HD23      LEU 118  12.056 -11.427  -5.110
  926   3HD2  LEU 118          HD22      LEU 118  11.563 -10.414  -6.467
  927    H    ALA 119           HN       ALA 119  16.919  -8.531  -5.153
  928    HA   ALA 119           HA       ALA 119  18.453  -6.835  -6.925
  929   1HB   ALA 119           HB1      ALA 119  19.311  -7.999  -4.829
  930   2HB   ALA 119           HB3      ALA 119  19.324  -9.494  -5.766
  931   3HB   ALA 119           HB2      ALA 119  20.348  -8.142  -6.249
  932    H    GLY 120           HN       GLY 120  17.022 -10.048  -7.188
  933   1HA   GLY 120           HA2      GLY 120  18.367 -10.732  -9.670
  934   2HA   GLY 120           HA1      GLY 120  16.971 -11.568  -8.989
  935    H    SER 121           HN       SER 121  17.661 -10.384 -11.763
  936    HA   SER 121           HA       SER 121  15.512  -8.399 -12.121
  937   1HB   SER 121           HB2      SER 121  17.512  -9.668 -14.001
  938   2HB   SER 121           HB1      SER 121  16.241  -8.588 -14.562
  939    HG   SER 121           HG       SER 121  17.487  -7.022 -13.953
  940    H    PHE 122           HN       PHE 122  13.570  -8.802 -13.202
  941    HA   PHE 122           HA       PHE 122  13.071 -11.499 -14.311
  942   1HB   PHE 122           HB2      PHE 122  11.451 -10.312 -12.037
  943   2HB   PHE 122           HB1      PHE 122  11.007 -11.759 -12.943
  944    HD1  PHE 122           HD2      PHE 122  12.603 -13.742 -12.944
  945    HD2  PHE 122           HD1      PHE 122  13.015 -10.415 -10.257
  946    HE1  PHE 122           HE2      PHE 122  14.054 -15.111 -11.470
  947    HE2  PHE 122           HE1      PHE 122  14.466 -11.785  -8.784
  948    HZ   PHE 122           HZ       PHE 122  14.986 -14.132  -9.391
  949    H    GLU 123           HN       GLU 123  12.395 -10.885 -16.316
  950    HA   GLU 123           HA       GLU 123  10.878  -8.418 -16.740
  951   1HB   GLU 123           HB2      GLU 123  12.579  -9.508 -18.356
  952   2HB   GLU 123           HB1      GLU 123  11.270 -10.613 -18.776
  953   1HG   GLU 123           HG2      GLU 123   9.848  -8.486 -19.140
  954   2HG   GLU 123           HG1      GLU 123  11.384  -7.619 -19.142
  955    H    GLY 124           HN       GLY 124   8.686  -8.298 -17.377
  956   1HA   GLY 124           HA2      GLY 124   7.103 -10.809 -17.385
  957   2HA   GLY 124           HA1      GLY 124   6.671  -9.573 -16.203
  958    H    ASP 125           HN       ASP 125   4.901  -8.499 -16.906
  959    HA   ASP 125           HA       ASP 125   4.919  -7.415 -19.675
  960   1HB   ASP 125           HB2      ASP 125   2.739  -9.105 -18.433
  961   2HB   ASP 125           HB1      ASP 125   2.428  -8.020 -19.789
  962    H    THR 126           HN       THR 126   3.358  -7.448 -16.477
  963    HA   THR 126           HA       THR 126   2.272  -4.736 -16.929
  964    HB   THR 126           HB       THR 126   2.150  -6.324 -14.359
  965    HG1  THR 126           HG1      THR 126   1.039  -6.856 -16.781
  966   1HG2  THR 126          HG23      THR 126   1.443  -3.823 -14.664
  967   2HG2  THR 126          HG22      THR 126   0.045  -4.505 -15.496
  968   3HG2  THR 126          HG21      THR 126   0.360  -4.923 -13.812
  969    H    LYS 127           HN       LYS 127   3.353  -2.935 -16.301
  970    HA   LYS 127           HA       LYS 127   5.750  -3.276 -14.558
  971   1HB   LYS 127           HB2      LYS 127   4.960  -1.083 -16.497
  972   2HB   LYS 127           HB1      LYS 127   6.381  -1.008 -15.454
  973   1HG   LYS 127           HG2      LYS 127   7.218  -3.112 -16.470
  974   2HG   LYS 127           HG1      LYS 127   5.820  -3.131 -17.546
  975   1HD   LYS 127           HD2      LYS 127   6.528  -1.196 -18.698
  976   2HD   LYS 127           HD1      LYS 127   7.648  -0.736 -17.414
  977   1HE   LYS 127           HE2      LYS 127   8.985  -1.638 -19.190
  978   2HE   LYS 127           HE1      LYS 127   8.932  -2.869 -17.928
  979   1HZ   LYS 127           HZ2      LYS 127   6.805  -2.985 -19.898
  980   2HZ   LYS 127           HZ1      LYS 127   8.359  -3.351 -20.479
  981   3HZ   LYS 127           HZ3      LYS 127   7.705  -4.241 -19.192
  982    H    MET 128           HN       MET 128   6.166  -1.218 -13.167
  983    HA   MET 128           HA       MET 128   3.691  -0.706 -11.626
  984   1HB   MET 128           HB2      MET 128   6.178  -1.280 -10.769
  985   2HB   MET 128           HB1      MET 128   6.297   0.479 -10.803
  986   1HG   MET 128           HG2      MET 128   3.906  -0.832  -9.538
  987   2HG   MET 128           HG1      MET 128   5.413  -0.694  -8.633
  988   1HE   MET 128           HE3      MET 128   2.210   0.609  -8.885
  989   2HE   MET 128           HE2      MET 128   3.035   0.604  -7.328
  990   3HE   MET 128           HE1      MET 128   2.415   2.117  -7.983
  991    H    ILE 129           HN       ILE 129   2.851   1.377 -11.298
  992    HA   ILE 129           HA       ILE 129   3.224   3.281 -13.421
  993    HB   ILE 129           HB       ILE 129   1.787   4.761 -11.995
  994   1HG1  ILE 129          HG12      ILE 129   1.722   2.432 -10.066
  995   2HG1  ILE 129          HG11      ILE 129   2.806   3.805  -9.838
  996   1HG2  ILE 129          HG22      ILE 129   1.029   1.884 -12.502
  997   2HG2  ILE 129          HG21      ILE 129  -0.135   3.033 -11.843
  998   3HG2  ILE 129          HG23      ILE 129   0.582   3.316 -13.429
  999   1HD1  ILE 129          HD13      ILE 129   0.683   5.264 -10.121
 1000   2HD1  ILE 129          HD12      ILE 129  -0.209   3.772  -9.822
 1001   3HD1  ILE 129          HD11      ILE 129   0.891   4.402  -8.595
 1002    HA   PRO 130           HA       PRO 130   6.475   5.848 -11.796
 1003   1HB   PRO 130           HB2      PRO 130   5.567   8.333 -12.706
 1004   2HB   PRO 130           HB1      PRO 130   6.506   7.165 -13.646
 1005   1HG   PRO 130           HG2      PRO 130   3.781   7.960 -14.024
 1006   2HG   PRO 130           HG1      PRO 130   4.734   6.815 -14.979
 1007   1HD   PRO 130           HD2      PRO 130   2.688   6.272 -12.962
 1008   2HD   PRO 130           HD1      PRO 130   3.406   5.175 -14.153
 1009    H    LEU 131           HN       LEU 131   6.510   6.124  -9.592
 1010    HA   LEU 131           HA       LEU 131   4.394   7.773  -8.308
 1011   1HB   LEU 131           HB2      LEU 131   6.555   6.006  -7.119
 1012   2HB   LEU 131           HB1      LEU 131   5.354   6.896  -6.183
 1013    HG   LEU 131           HG       LEU 131   4.595   4.925  -8.348
 1014   1HD1  LEU 131          HD12      LEU 131   4.932   4.481  -5.366
 1015   2HD1  LEU 131          HD11      LEU 131   4.128   3.352  -6.458
 1016   3HD1  LEU 131          HD13      LEU 131   5.846   3.697  -6.656
 1017   1HD2  LEU 131          HD21      LEU 131   3.149   6.339  -6.096
 1018   2HD2  LEU 131          HD23      LEU 131   2.801   6.415  -7.824
 1019   3HD2  LEU 131          HD22      LEU 131   2.465   4.939  -6.920
 1020    H    ASN 132           HN       ASN 132   4.914   9.654  -7.144
 1021    HA   ASN 132           HA       ASN 132   7.436  10.953  -7.932
 1022   1HB   ASN 132           HB2      ASN 132   5.106  12.069  -7.847
 1023   2HB   ASN 132           HB1      ASN 132   5.339  12.117  -6.099
 1024   1HD2  ASN 132          HD22      ASN 132   7.090  15.149  -6.485
 1025   2HD2  ASN 132          HD21      ASN 132   5.840  14.304  -5.707
 1026    H    TRP 133           HN       TRP 133   8.940   9.674  -6.697
 1027    HA   TRP 133           HA       TRP 133   8.709   9.339  -3.839
 1028   1HB   TRP 133           HB2      TRP 133  11.132   9.196  -5.659
 1029   2HB   TRP 133           HB1      TRP 133  11.103   8.669  -3.976
 1030    HD1  TRP 133           HD1      TRP 133  10.070   7.645  -7.451
 1031    HE1  TRP 133           HE1      TRP 133   9.056   5.274  -7.385
 1032    HE3  TRP 133           HE3      TRP 133   9.692   6.988  -2.401
 1033    HZ2  TRP 133           HZ2      TRP 133   8.199   3.354  -5.446
 1034    HZ3  TRP 133           HZ3      TRP 133   8.774   4.881  -1.472
 1035    HH2  TRP 133           HH2      TRP 133   8.028   3.065  -2.987
 1036    H    ASP 134           HN       ASP 134   9.654  11.981  -5.828
 1037    HA   ASP 134           HA       ASP 134  11.524  13.294  -4.110
 1038   1HB   ASP 134           HB2      ASP 134   9.756  14.087  -6.369
 1039   2HB   ASP 134           HB1      ASP 134  10.316  15.385  -5.314
 1040    H    ASP 135           HN       ASP 135   8.041  13.006  -4.019
 1041    HA   ASP 135           HA       ASP 135   7.818  15.093  -1.928
 1042   1HB   ASP 135           HB2      ASP 135   6.119  14.672  -3.861
 1043   2HB   ASP 135           HB1      ASP 135   5.563  13.328  -2.863
 1044    H    PHE 136           HN       PHE 136   9.308  12.582  -1.444
 1045    HA   PHE 136           HA       PHE 136   7.905  11.800   1.036
 1046   1HB   PHE 136           HB2      PHE 136   8.712   9.815  -1.112
 1047   2HB   PHE 136           HB1      PHE 136   8.231   9.370   0.527
 1048    HD1  PHE 136           HD2      PHE 136   5.934  10.346   1.352
 1049    HD2  PHE 136           HD1      PHE 136   7.078  10.004  -2.774
 1050    HE1  PHE 136           HE2      PHE 136   3.548  10.456   0.681
 1051    HE2  PHE 136           HE1      PHE 136   4.693  10.115  -3.445
 1052    HZ   PHE 136           HZ       PHE 136   2.928  10.340  -1.717
 1053    H    THR 137           HN       THR 137   9.383  10.474   2.444
 1054    HA   THR 137           HA       THR 137  12.264  10.778   1.753
 1055    HB   THR 137           HB       THR 137  11.213  11.513   4.488
 1056    HG1  THR 137           HG1      THR 137  10.291  12.953   3.049
 1057   1HG2  THR 137          HG21      THR 137  13.681  10.919   3.926
 1058   2HG2  THR 137          HG23      THR 137  13.710  12.487   3.119
 1059   3HG2  THR 137          HG22      THR 137  13.363  12.390   4.846
 1060    H    LYS 138           HN       LYS 138  13.476   9.038   2.417
 1061    HA   LYS 138           HA       LYS 138  12.128   6.677   3.394
 1062   1HB   LYS 138           HB2      LYS 138  14.239   6.811   1.918
 1063   2HB   LYS 138           HB1      LYS 138  15.119   7.101   3.420
 1064   1HG   LYS 138           HG2      LYS 138  14.551   4.987   4.300
 1065   2HG   LYS 138           HG1      LYS 138  13.231   4.764   3.151
 1066   1HD   LYS 138           HD2      LYS 138  15.026   3.372   2.386
 1067   2HD   LYS 138           HD1      LYS 138  14.991   4.771   1.311
 1068   1HE   LYS 138           HE2      LYS 138  17.286   4.466   1.895
 1069   2HE   LYS 138           HE1      LYS 138  16.725   5.832   2.860
 1070   1HZ   LYS 138           HZ1      LYS 138  16.237   4.148   4.646
 1071   2HZ   LYS 138           HZ3      LYS 138  17.126   3.030   3.731
 1072   3HZ   LYS 138           HZ2      LYS 138  17.881   4.432   4.326
 1073    H    VAL 139           HN       VAL 139  12.356   5.671   5.449
 1074    HA   VAL 139           HA       VAL 139  13.670   7.262   7.591
 1075    HB   VAL 139           HB       VAL 139  11.656   6.910   9.043
 1076   1HG1  VAL 139          HG13      VAL 139  12.076   9.039   7.788
 1077   2HG1  VAL 139          HG12      VAL 139  11.069   8.419   6.479
 1078   3HG1  VAL 139          HG11      VAL 139  10.362   8.724   8.066
 1079   1HG2  VAL 139          HG21      VAL 139  10.463   5.987   6.410
 1080   2HG2  VAL 139          HG23      VAL 139  10.649   5.025   7.876
 1081   3HG2  VAL 139          HG22      VAL 139   9.515   6.376   7.845
 1082    H    SER 140           HN       SER 140  12.323   4.224   6.443
 1083    HA   SER 140           HA       SER 140  14.151   2.783   8.289
 1084   1HB   SER 140           HB2      SER 140  11.313   1.828   7.946
 1085   2HB   SER 140           HB1      SER 140  12.484   1.373   9.180
 1086    HG   SER 140           HG       SER 140  12.103   3.204  10.236
 1087    H    SER 141           HN       SER 141  14.688   0.650   7.516
 1088    HA   SER 141           HA       SER 141  13.600  -0.246   4.936
 1089   1HB   SER 141           HB2      SER 141  15.823  -0.264   3.831
 1090   2HB   SER 141           HB1      SER 141  15.299   1.373   4.214
 1091    HG   SER 141           HG       SER 141  17.426   1.093   4.880
 1092    H    ARG 142           HN       ARG 142  13.264  -2.361   5.403
 1093    HA   ARG 142           HA       ARG 142  15.084  -3.772   7.258
 1094   1HB   ARG 142           HB2      ARG 142  12.509  -3.943   7.292
 1095   2HB   ARG 142           HB1      ARG 142  12.685  -4.960   5.860
 1096   1HG   ARG 142           HG2      ARG 142  12.694  -6.506   7.646
 1097   2HG   ARG 142           HG1      ARG 142  14.404  -6.293   7.268
 1098   1HD   ARG 142           HD2      ARG 142  14.716  -4.793   9.112
 1099   2HD   ARG 142           HD1      ARG 142  12.978  -4.663   9.382
 1100    HE   ARG 142           HE       ARG 142  13.045  -6.726  10.539
 1101   1HH1  ARG 142          HH21      ARG 142  15.978  -6.178   8.758
 1102   2HH1  ARG 142          HH22      ARG 142  16.801  -7.527   9.468
 1103   1HH2  ARG 142          HH11      ARG 142  14.125  -8.472  11.454
 1104   2HH2  ARG 142          HH12      ARG 142  15.756  -8.818  10.987
 1105    H    THR 143           HN       THR 143  16.949  -4.358   6.197
 1106    HA   THR 143           HA       THR 143  16.853  -5.351   3.428
 1107    HB   THR 143           HB       THR 143  19.252  -5.374   5.266
 1108    HG1  THR 143           HG1      THR 143  19.579  -3.257   4.138
 1109   1HG2  THR 143          HG23      THR 143  18.864  -5.168   2.269
 1110   2HG2  THR 143          HG22      THR 143  20.421  -5.003   3.080
 1111   3HG2  THR 143          HG21      THR 143  19.545  -6.532   3.155
 1112    H    VAL 144           HN       VAL 144  17.139  -7.497   2.822
 1113    HA   VAL 144           HA       VAL 144  17.706  -9.517   4.910
 1114    HB   VAL 144           HB       VAL 144  15.249  -9.264   4.934
 1115   1HG1  VAL 144          HG12      VAL 144  15.079  -8.442   2.567
 1116   2HG1  VAL 144          HG11      VAL 144  15.355 -10.097   2.022
 1117   3HG1  VAL 144          HG13      VAL 144  13.914  -9.707   2.960
 1118   1HG2  VAL 144          HG22      VAL 144  16.398 -11.531   5.174
 1119   2HG2  VAL 144          HG21      VAL 144  14.700 -11.583   4.697
 1120   3HG2  VAL 144          HG23      VAL 144  15.963 -11.827   3.490
 1121    H    GLU 145           HN       GLU 145  19.031 -11.062   4.078
 1122    HA   GLU 145           HA       GLU 145  19.316 -11.186   1.105
 1123   1HB   GLU 145           HB2      GLU 145  21.250 -11.915   3.325
 1124   2HB   GLU 145           HB1      GLU 145  21.561 -12.188   1.610
 1125   1HG   GLU 145           HG2      GLU 145  21.360  -9.788   1.163
 1126   2HG   GLU 145           HG1      GLU 145  20.968  -9.486   2.856
 1127    H    ASP 146           HN       ASP 146  18.454 -12.968   0.178
 1128    HA   ASP 146           HA       ASP 146  17.618 -15.251   1.807
 1129   1HB   ASP 146           HB2      ASP 146  16.463 -14.228  -0.316
 1130   2HB   ASP 146           HB1      ASP 146  17.604 -15.242  -1.201
 1131    H    THR 147           HN       THR 147  18.107 -17.414   0.137
 1132    HA   THR 147           HA       THR 147  20.854 -18.040   0.791
 1133    HB   THR 147           HB       THR 147  20.359 -20.137  -0.564
 1134    HG1  THR 147           HG1      THR 147  18.286 -18.549  -1.269
 1135   1HG2  THR 147          HG21      THR 147  18.420 -19.315   1.617
 1136   2HG2  THR 147          HG23      THR 147  18.692 -20.974   1.081
 1137   3HG2  THR 147          HG22      THR 147  19.997 -20.071   1.851
 1138    H    ASN 148           HN       ASN 148  19.144 -17.311  -2.250
 1139    HA   ASN 148           HA       ASN 148  21.771 -17.258  -3.652
 1140   1HB   ASN 148           HB2      ASN 148  19.697 -18.559  -4.525
 1141   2HB   ASN 148           HB1      ASN 148  19.082 -16.972  -4.985
 1142   1HD2  ASN 148          HD22      ASN 148  21.899 -18.729  -7.267
 1143   2HD2  ASN 148          HD21      ASN 148  21.139 -19.532  -5.979
 1144    HA   PRO 149           HA       PRO 149  22.052 -12.813  -3.490
 1145   1HB   PRO 149           HB2      PRO 149  22.950 -12.695  -6.249
 1146   2HB   PRO 149           HB1      PRO 149  23.872 -12.410  -4.769
 1147   1HG   PRO 149           HG2      PRO 149  23.919 -14.707  -6.483
 1148   2HG   PRO 149           HG1      PRO 149  24.892 -14.386  -5.042
 1149   1HD   PRO 149           HD2      PRO 149  22.868 -16.316  -5.282
 1150   2HD   PRO 149           HD1      PRO 149  23.629 -15.773  -3.780
 1151    H    ALA 150           HN       ALA 150  20.707 -14.279  -6.453
 1152    HA   ALA 150           HA       ALA 150  19.287 -11.975  -7.362
 1153   1HB   ALA 150           HB1      ALA 150  19.673 -13.981  -8.764
 1154   2HB   ALA 150           HB3      ALA 150  18.579 -14.902  -7.732
 1155   3HB   ALA 150           HB2      ALA 150  17.961 -13.562  -8.698
 1156    H    LEU 151           HN       LEU 151  18.496 -14.453  -4.986
 1157    HA   LEU 151           HA       LEU 151  15.719 -13.566  -4.705
 1158   1HB   LEU 151           HB2      LEU 151  17.475 -15.515  -3.208
 1159   2HB   LEU 151           HB1      LEU 151  15.860 -15.096  -2.633
 1160    HG   LEU 151           HG       LEU 151  16.416 -16.090  -5.438
 1161   1HD1  LEU 151          HD12      LEU 151  17.015 -17.817  -3.770
 1162   2HD1  LEU 151          HD11      LEU 151  15.431 -17.631  -3.016
 1163   3HD1  LEU 151          HD13      LEU 151  15.557 -18.264  -4.657
 1164   1HD2  LEU 151          HD22      LEU 151  13.926 -15.635  -3.773
 1165   2HD2  LEU 151          HD21      LEU 151  14.346 -14.886  -5.314
 1166   3HD2  LEU 151          HD23      LEU 151  13.920 -16.596  -5.252
 1167    H    THR 152           HN       THR 152  18.150 -11.743  -4.188
 1168    HA   THR 152           HA       THR 152  17.784 -11.091  -1.326
 1169    HB   THR 152           HB       THR 152  19.500  -9.701  -3.407
 1170    HG1  THR 152           HG1      THR 152  19.888 -12.023  -2.886
 1171   1HG2  THR 152          HG21      THR 152  18.845  -8.548  -1.188
 1172   2HG2  THR 152          HG23      THR 152  19.876  -9.753  -0.416
 1173   3HG2  THR 152          HG22      THR 152  20.561  -8.628  -1.591
 1174    H    HIS 153           HN       HIS 153  16.742  -9.227  -0.604
 1175    HA   HIS 153           HA       HIS 153  15.843  -7.178  -2.496
 1176   1HB   HIS 153           HB2      HIS 153  13.423  -7.498  -1.905
 1177   2HB   HIS 153           HB1      HIS 153  14.090  -8.821  -2.860
 1178    HD1  HIS 153           HD1      HIS 153  15.068 -10.889  -1.270
 1179    HD2  HIS 153           HD2      HIS 153  12.179  -8.385   0.393
 1180    HE1  HIS 153           HE1      HIS 153  14.087 -12.137   0.704
 1181    H    THR 154           HN       THR 154  14.557  -5.463  -1.284
 1182    HA   THR 154           HA       THR 154  15.126  -5.456   1.639
 1183    HB   THR 154           HB       THR 154  15.739  -3.109  -0.179
 1184    HG1  THR 154           HG1      THR 154  17.092  -5.134  -0.282
 1185   1HG2  THR 154          HG21      THR 154  15.914  -3.672   2.755
 1186   2HG2  THR 154          HG23      THR 154  17.127  -2.619   2.026
 1187   3HG2  THR 154          HG22      THR 154  15.417  -2.197   1.926
 1188    H    TYR 155           HN       TYR 155  13.547  -4.397   2.837
 1189    HA   TYR 155           HA       TYR 155  11.139  -3.542   1.325
 1190   1HB   TYR 155           HB2      TYR 155  11.594  -4.179   4.254
 1191   2HB   TYR 155           HB1      TYR 155  10.057  -3.610   3.601
 1192    HD1  TYR 155           HD1      TYR 155   8.749  -5.002   2.047
 1193    HD2  TYR 155           HD2      TYR 155  12.415  -6.416   3.784
 1194    HE1  TYR 155           HE1      TYR 155   8.182  -7.318   1.361
 1195    HE2  TYR 155           HE2      TYR 155  11.847  -8.731   3.099
 1196    HH   TYR 155           HH       TYR 155   9.329  -9.431   0.905
 1197    H    GLU 156           HN       GLU 156  11.578  -1.424   0.694
 1198    HA   GLU 156           HA       GLU 156  12.719   0.509   2.576
 1199   1HB   GLU 156           HB2      GLU 156  11.595   0.747  -0.225
 1200   2HB   GLU 156           HB1      GLU 156  12.187   2.135   0.689
 1201   1HG   GLU 156           HG2      GLU 156  14.328   0.667   1.033
 1202   2HG   GLU 156           HG1      GLU 156  13.724  -0.225  -0.364
 1203    H    VAL 157           HN       VAL 157  11.583   2.061   3.722
 1204    HA   VAL 157           HA       VAL 157   8.605   2.046   3.423
 1205    HB   VAL 157           HB       VAL 157  10.150   2.388   6.011
 1206   1HG1  VAL 157          HG12      VAL 157   7.214   2.183   5.305
 1207   2HG1  VAL 157          HG11      VAL 157   7.816   1.944   6.945
 1208   3HG1  VAL 157          HG13      VAL 157   8.034   3.500   6.143
 1209   1HG2  VAL 157          HG21      VAL 157   8.936  -0.006   4.659
 1210   2HG2  VAL 157          HG23      VAL 157  10.451   0.118   5.554
 1211   3HG2  VAL 157          HG22      VAL 157   8.915   0.093   6.420
 1212    H    TRP 158           HN       TRP 158   8.191   3.985   2.453
 1213    HA   TRP 158           HA       TRP 158   9.692   6.390   3.381
 1214   1HB   TRP 158           HB2      TRP 158   7.984   5.933   0.916
 1215   2HB   TRP 158           HB1      TRP 158   8.772   7.457   1.320
 1216    HD1  TRP 158           HD1      TRP 158   9.867   3.749   1.006
 1217    HE1  TRP 158           HE1      TRP 158  12.165   3.695  -0.163
 1218    HE3  TRP 158           HE3      TRP 158  10.654   8.755   0.377
 1219    HZ2  TRP 158           HZ2      TRP 158  14.083   5.533  -1.224
 1220    HZ3  TRP 158           HZ3      TRP 158  12.723   9.576  -0.715
 1221    HH2  TRP 158           HH2      TRP 158  14.436   7.973  -1.515
 1222    H    GLN 159           HN       GLN 159   8.344   8.419   3.562
 1223    HA   GLN 159           HA       GLN 159   5.488   7.973   4.193
 1224   1HB   GLN 159           HB2      GLN 159   7.581   8.803   6.207
 1225   2HB   GLN 159           HB1      GLN 159   5.882   9.228   6.413
 1226   1HG   GLN 159           HG2      GLN 159   5.333   6.771   6.130
 1227   2HG   GLN 159           HG1      GLN 159   7.066   6.448   6.209
 1228   1HE2  GLN 159          HE22      GLN 159   5.053   7.524   9.609
 1229   2HE2  GLN 159          HE21      GLN 159   4.305   7.688   8.095
 1230    H    LYS 160           HN       LYS 160   4.269   9.870   3.976
 1231    HA   LYS 160           HA       LYS 160   5.429  11.999   2.412
 1232   1HB   LYS 160           HB2      LYS 160   2.970  11.186   2.474
 1233   2HB   LYS 160           HB1      LYS 160   2.814  12.206   3.903
 1234   1HG   LYS 160           HG2      LYS 160   3.781  14.103   2.502
 1235   2HG   LYS 160           HG1      LYS 160   3.562  13.057   1.099
 1236   1HD   LYS 160           HD2      LYS 160   1.594  14.426   1.248
 1237   2HD   LYS 160           HD1      LYS 160   1.132  12.815   1.798
 1238   1HE   LYS 160           HE2      LYS 160   1.117  13.461   4.067
 1239   2HE   LYS 160           HE1      LYS 160   2.073  14.909   3.752
 1240   1HZ   LYS 160           HZ3      LYS 160  -0.140  15.189   2.174
 1241   2HZ   LYS 160           HZ2      LYS 160  -0.755  14.538   3.618
 1242   3HZ   LYS 160           HZ1      LYS 160   0.145  15.979   3.648
 1243    H    LYS 161           HN       LYS 161   6.784  13.488   3.278
 1244    HA   LYS 161           HA       LYS 161   5.983  14.858   5.779
 1245   1HB   LYS 161           HB2      LYS 161   7.571  12.915   6.309
 1246   2HB   LYS 161           HB1      LYS 161   8.806  13.829   5.442
 1247   1HG   LYS 161           HG2      LYS 161   8.578  15.700   6.964
 1248   2HG   LYS 161           HG1      LYS 161   7.199  14.940   7.759
 1249   1HD   LYS 161           HD2      LYS 161   8.717  13.020   8.375
 1250   2HD   LYS 161           HD1      LYS 161  10.069  13.973   7.763
 1251   1HE   LYS 161           HE2      LYS 161   8.186  15.154   9.790
 1252   2HE   LYS 161           HE1      LYS 161   9.497  14.097  10.309
 1253   1HZ   LYS 161           HZ1      LYS 161  10.017  16.350   8.479
 1254   2HZ   LYS 161           HZ3      LYS 161   9.929  16.605  10.154
 1255   3HZ   LYS 161           HZ2      LYS 161  11.095  15.546   9.518
 1256    H    ALA 162           HN       ALA 162   6.559  17.018   5.752
 1257    HA   ALA 162           HA       ALA 162   8.649  18.012   3.953
 1258   1HB   ALA 162           HB2      ALA 162   5.716  18.407   3.384
 1259   2HB   ALA 162           HB1      ALA 162   6.896  19.619   2.887
 1260   3HB   ALA 162           HB3      ALA 162   7.010  17.973   2.265
 1261   1H9   TMQ 170           H91      TMQ 170  -0.360  -9.780  -6.708
 1262   2H9   TMQ 170           H92      TMQ 170  -1.302 -10.544  -5.418
 1263    HN1  TMQ 170           H1N      TMQ 170   0.286 -11.871  -7.348
 1264   1H17  TMQ 170           HM1      TMQ 170  -1.528  -8.618  -4.966
 1265   2H17  TMQ 170           HM2      TMQ 170  -0.792  -7.094  -4.476
 1266   3H17  TMQ 170           HM3      TMQ 170  -1.512  -8.162  -3.263
 1267   1H21  TMQ 170          HW11      TMQ 170  -0.963 -12.357  -1.789
 1268   2H21  TMQ 170          HW12      TMQ 170  -2.315 -13.025  -0.859
 1269   3H21  TMQ 170          HW13      TMQ 170  -2.592 -12.373  -2.482
 1270   1H22  TMQ 170           HI1      TMQ 170   1.840 -16.471  -3.113
 1271   2H22  TMQ 170           HI2      TMQ 170   0.966 -17.398  -1.884
 1272   3H22  TMQ 170           HI3      TMQ 170   0.989 -15.630  -1.809
 1273   1H23  TMQ 170          HW21      TMQ 170   2.042 -15.918  -7.455
 1274   2H23  TMQ 170          HW22      TMQ 170   3.021 -15.387  -6.079
 1275   3H23  TMQ 170          HW23      TMQ 170   3.037 -17.087  -6.573
 1276   1HN2  TMQ 170          HN21      TMQ 170   5.270  -7.889  -0.322
 1277   2HN2  TMQ 170          HN22      TMQ 170   4.311  -6.573   0.268
 1278   1HN5  TMQ 170          HN41      TMQ 170  -0.583  -6.541  -2.581
 1279   2HN5  TMQ 170          HN42      TMQ 170   0.207  -5.661  -1.346
 1280    HN   TMQ 170           H1       TMQ 170   4.456  -9.238  -1.980
 1281    H7   TMQ 170           H7       TMQ 170   2.120 -11.504  -5.339
 1282    H8   TMQ 170           H8       TMQ 170   3.810 -10.784  -3.714
 1283    H12  TMQ 170           HP2      TMQ 170  -1.368 -12.066  -4.129
 1284    H16  TMQ 170           HP6      TMQ 170   1.250 -14.056  -6.932
   
  No H/Q in entry =        1284
  Start of MODEL    3
    1   1H    THR   1           HT1      THR   1  -3.362   5.922   4.833
    2   2H    THR   1           HT3      THR   1  -4.012   7.069   3.767
    3   3H    THR   1           HT2      THR   1  -5.035   5.954   4.539
    4    HA   THR   1           HA       THR   1  -4.619   4.330   3.079
    5    HB   THR   1           HB       THR   1  -3.334   6.540   1.459
    6    HG1  THR   1           HG1      THR   1  -6.061   6.110   1.332
    7   1HG2  THR   1          HG21      THR   1  -3.357   4.279   0.467
    8   2HG2  THR   1          HG23      THR   1  -5.101   4.192   0.716
    9   3HG2  THR   1          HG22      THR   1  -4.428   5.372  -0.409
   10    H    ALA   2           HN       ALA   2  -3.113   2.775   2.484
   11    HA   ALA   2           HA       ALA   2  -0.225   3.491   2.732
   12   1HB   ALA   2           HB3      ALA   2  -1.120   2.355   4.818
   13   2HB   ALA   2           HB2      ALA   2  -1.434   0.935   3.821
   14   3HB   ALA   2           HB1      ALA   2   0.218   1.515   4.034
   15    H    PHE   3           HN       PHE   3   0.922   2.778   0.998
   16    HA   PHE   3           HA       PHE   3  -0.422   0.948  -0.915
   17   1HB   PHE   3           HB2      PHE   3   1.866   2.891  -1.092
   18   2HB   PHE   3           HB1      PHE   3   1.712   1.608  -2.292
   19    HD1  PHE   3           HD2      PHE   3  -0.717   3.847  -0.498
   20    HD2  PHE   3           HD1      PHE   3   0.727   2.352  -4.256
   21    HE1  PHE   3           HE2      PHE   3  -2.455   5.157  -1.688
   22    HE2  PHE   3           HE1      PHE   3  -1.010   3.661  -5.446
   23    HZ   PHE   3           HZ       PHE   3  -2.600   5.063  -4.162
   24    H    LEU   4           HN       LEU   4   0.865  -0.831  -1.864
   25    HA   LEU   4           HA       LEU   4   3.327  -1.725  -0.650
   26   1HB   LEU   4           HB2      LEU   4   1.718  -2.172   1.220
   27   2HB   LEU   4           HB1      LEU   4   0.822  -3.243   0.143
   28    HG   LEU   4           HG       LEU   4   3.144  -4.396  -0.221
   29   1HD1  LEU   4          HD11      LEU   4   3.551  -2.711   2.242
   30   2HD1  LEU   4          HD13      LEU   4   4.391  -4.251   2.064
   31   3HD1  LEU   4          HD12      LEU   4   4.646  -2.967   0.884
   32   1HD2  LEU   4          HD21      LEU   4   1.417  -4.591   2.252
   33   2HD2  LEU   4          HD23      LEU   4   1.387  -5.619   0.820
   34   3HD2  LEU   4          HD22      LEU   4   2.739  -5.719   1.949
   35    H    TRP   5           HN       TRP   5   4.159  -2.466  -2.558
   36    HA   TRP   5           HA       TRP   5   2.688  -4.639  -3.939
   37   1HB   TRP   5           HB2      TRP   5   3.063  -3.623  -6.145
   38   2HB   TRP   5           HB1      TRP   5   2.099  -2.550  -5.133
   39    HD1  TRP   5           HD1      TRP   5   5.118  -2.608  -7.228
   40    HE1  TRP   5           HE1      TRP   5   6.510  -0.465  -6.901
   41    HE3  TRP   5           HE3      TRP   5   2.876  -0.721  -3.040
   42    HZ2  TRP   5           HZ2      TRP   5   6.657   1.753  -5.106
   43    HZ3  TRP   5           HZ3      TRP   5   3.668   1.405  -2.044
   44    HH2  TRP   5           HH2      TRP   5   5.553   2.644  -3.072
   45    H    ALA   6           HN       ALA   6   4.079  -6.055  -5.130
   46    HA   ALA   6           HA       ALA   6   6.921  -5.898  -4.269
   47   1HB   ALA   6           HB2      ALA   6   5.189  -8.138  -5.329
   48   2HB   ALA   6           HB1      ALA   6   6.940  -8.297  -5.185
   49   3HB   ALA   6           HB3      ALA   6   5.958  -8.015  -3.747
   50    H    GLN   7           HN       GLN   7   8.251  -4.924  -5.719
   51    HA   GLN   7           HA       GLN   7   7.910  -5.599  -8.606
   52   1HB   GLN   7           HB2      GLN   7   8.496  -3.223  -9.151
   53   2HB   GLN   7           HB1      GLN   7   6.943  -3.384  -8.330
   54   1HG   GLN   7           HG2      GLN   7   7.800  -2.586  -6.286
   55   2HG   GLN   7           HG1      GLN   7   9.470  -2.900  -6.760
   56   1HE2  GLN   7          HE22      GLN   7   9.865   0.385  -7.935
   57   2HE2  GLN   7          HE21      GLN   7  10.559  -0.991  -7.221
   58    H    ASP   8           HN       ASP   8   9.886  -5.587  -9.801
   59    HA   ASP   8           HA       ASP   8  12.307  -5.804  -8.080
   60   1HB   ASP   8           HB2      ASP   8  13.295  -6.924 -10.121
   61   2HB   ASP   8           HB1      ASP   8  11.921  -7.776  -9.418
   62    H    ARG   9           HN       ARG   9  14.386  -5.059  -9.258
   63    HA   ARG   9           HA       ARG   9  14.228  -2.255  -9.754
   64   1HB   ARG   9           HB2      ARG   9  16.588  -2.503 -10.559
   65   2HB   ARG   9           HB1      ARG   9  16.305  -3.271  -8.997
   66   1HG   ARG   9           HG2      ARG   9  16.264  -5.443  -9.943
   67   2HG   ARG   9           HG1      ARG   9  16.052  -4.815 -11.579
   68   1HD   ARG   9           HD2      ARG   9  18.347  -5.481 -11.416
   69   2HD   ARG   9           HD1      ARG   9  18.338  -3.719 -11.321
   70    HE   ARG   9           HE       ARG   9  18.182  -4.668  -8.668
   71   1HH1  ARG   9          HH21      ARG   9  20.363  -4.801 -11.370
   72   2HH1  ARG   9          HH22      ARG   9  21.776  -4.921 -10.375
   73   1HH2  ARG   9          HH11      ARG   9  20.022  -4.825  -7.388
   74   2HH2  ARG   9          HH12      ARG   9  21.582  -4.935  -8.132
   75    H    ASP  10           HN       ASP  10  13.643  -4.942 -11.827
   76    HA   ASP  10           HA       ASP  10  14.252  -3.581 -14.331
   77   1HB   ASP  10           HB2      ASP  10  12.811  -6.128 -13.600
   78   2HB   ASP  10           HB1      ASP  10  12.800  -5.522 -15.257
   79    H    GLY  11           HN       GLY  11  12.150  -2.603 -12.185
   80   1HA   GLY  11           HA2      GLY  11  10.172  -1.346 -12.279
   81   2HA   GLY  11           HA1      GLY  11  10.453  -1.215 -14.016
   82    H    LEU  12           HN       LEU  12   9.985  -4.203 -12.159
   83    HA   LEU  12           HA       LEU  12   7.548  -4.722 -13.816
   84   1HB   LEU  12           HB2      LEU  12   9.740  -6.234 -13.850
   85   2HB   LEU  12           HB1      LEU  12   9.001  -6.925 -12.405
   86    HG   LEU  12           HG       LEU  12   6.846  -7.099 -13.814
   87   1HD1  LEU  12          HD13      LEU  12   7.822  -5.598 -15.627
   88   2HD1  LEU  12          HD12      LEU  12   8.841  -6.962 -16.086
   89   3HD1  LEU  12          HD11      LEU  12   7.086  -7.096 -16.198
   90   1HD2  LEU  12          HD21      LEU  12   8.580  -8.942 -13.178
   91   2HD2  LEU  12          HD23      LEU  12   7.430  -9.284 -14.470
   92   3HD2  LEU  12          HD22      LEU  12   9.086  -8.823 -14.863
   93    H    ILE  13           HN       ILE  13   5.874  -6.080 -12.690
   94    HA   ILE  13           HA       ILE  13   5.901  -5.792  -9.728
   95    HB   ILE  13           HB       ILE  13   3.547  -4.964  -9.801
   96   1HG1  ILE  13          HG12      ILE  13   3.163  -3.870 -12.253
   97   2HG1  ILE  13          HG11      ILE  13   4.050  -5.325 -12.711
   98   1HG2  ILE  13          HG22      ILE  13   5.646  -3.324 -11.247
   99   2HG2  ILE  13          HG21      ILE  13   4.131  -2.661 -10.631
  100   3HG2  ILE  13          HG23      ILE  13   5.317  -3.338  -9.515
  101   1HD1  ILE  13          HD11      ILE  13   1.855  -5.642 -10.718
  102   2HD1  ILE  13          HD13      ILE  13   1.387  -5.332 -12.390
  103   3HD1  ILE  13          HD12      ILE  13   2.378  -6.737 -11.998
  104    H    GLY  14           HN       GLY  14   4.735  -7.370 -12.622
  105   1HA   GLY  14           HA2      GLY  14   4.326  -9.867 -11.233
  106   2HA   GLY  14           HA1      GLY  14   2.779  -9.110 -11.619
  107    H    LYS  15           HN       LYS  15   2.884 -11.336 -12.893
  108    HA   LYS  15           HA       LYS  15   3.161 -10.643 -15.698
  109   1HB   LYS  15           HB2      LYS  15   5.541 -11.206 -14.951
  110   2HB   LYS  15           HB1      LYS  15   4.971 -12.857 -14.709
  111   1HG   LYS  15           HG2      LYS  15   4.043 -12.613 -17.149
  112   2HG   LYS  15           HG1      LYS  15   5.216 -11.300 -17.269
  113   1HD   LYS  15           HD2      LYS  15   7.034 -12.801 -16.680
  114   2HD   LYS  15           HD1      LYS  15   5.898 -14.116 -16.378
  115   1HE   LYS  15           HE2      LYS  15   6.905 -14.385 -18.595
  116   2HE   LYS  15           HE1      LYS  15   5.187 -14.019 -18.757
  117   1HZ   LYS  15           HZ2      LYS  15   6.139 -11.574 -18.786
  118   2HZ   LYS  15           HZ1      LYS  15   7.509 -12.370 -19.398
  119   3HZ   LYS  15           HZ3      LYS  15   6.022 -12.507 -20.202
  120    H    ASP  16           HN       ASP  16   1.428 -11.642 -16.578
  121    HA   ASP  16           HA       ASP  16  -0.246 -13.232 -16.981
  122   1HB   ASP  16           HB2      ASP  16   2.141 -14.825 -16.191
  123   2HB   ASP  16           HB1      ASP  16   0.587 -15.660 -16.147
  124    H    GLY  17           HN       GLY  17  -0.190 -11.785 -14.428
  125   1HA   GLY  17           HA2      GLY  17  -1.792 -11.829 -12.653
  126   2HA   GLY  17           HA1      GLY  17  -2.032 -13.553 -12.944
  127    H    HIS  18           HN       HIS  18   0.192 -14.818 -12.572
  128    HA   HIS  18           HA       HIS  18   0.854 -14.410  -9.765
  129   1HB   HIS  18           HB2      HIS  18   2.379 -16.370 -10.132
  130   2HB   HIS  18           HB1      HIS  18   0.713 -16.682 -10.622
  131    HD1  HIS  18           HD1      HIS  18   4.002 -15.554 -12.195
  132    HD2  HIS  18           HD2      HIS  18   0.485 -17.531 -13.246
  133    HE1  HIS  18           HE1      HIS  18   4.304 -16.333 -14.585
  134    H    LEU  19           HN       LEU  19   3.287 -14.468  -9.148
  135    HA   LEU  19           HA       LEU  19   4.573 -12.189 -10.487
  136   1HB   LEU  19           HB2      LEU  19   5.316 -13.842  -8.059
  137   2HB   LEU  19           HB1      LEU  19   6.296 -12.504  -8.660
  138    HG   LEU  19           HG       LEU  19   3.367 -12.075  -8.149
  139   1HD1  LEU  19          HD13      LEU  19   5.584 -12.204  -6.097
  140   2HD1  LEU  19          HD12      LEU  19   4.114 -11.268  -5.832
  141   3HD1  LEU  19          HD11      LEU  19   4.019 -13.014  -6.058
  142   1HD2  LEU  19          HD21      LEU  19   5.170 -10.461  -9.242
  143   2HD2  LEU  19          HD23      LEU  19   3.957  -9.827  -8.129
  144   3HD2  LEU  19          HD22      LEU  19   5.593 -10.156  -7.557
  145    HA   PRO  20           HA       PRO  20   7.428 -14.606 -12.899
  146   1HB   PRO  20           HB2      PRO  20   9.500 -12.731 -13.011
  147   2HB   PRO  20           HB1      PRO  20   8.103 -12.797 -14.094
  148   1HG   PRO  20           HG2      PRO  20   8.723 -10.824 -12.104
  149   2HG   PRO  20           HG1      PRO  20   7.368 -10.856 -13.241
  150   1HD   PRO  20           HD2      PRO  20   7.383 -11.486 -10.398
  151   2HD   PRO  20           HD1      PRO  20   6.004 -11.260 -11.485
  152    H    TRP  21           HN       TRP  21   8.472 -13.221  -9.853
  153    HA   TRP  21           HA       TRP  21  10.737 -15.166  -9.749
  154   1HB   TRP  21           HB2      TRP  21  11.559 -13.743  -7.854
  155   2HB   TRP  21           HB1      TRP  21  11.455 -12.871  -9.383
  156    HD1  TRP  21           HD1      TRP  21   9.644 -13.260  -6.028
  157    HE1  TRP  21           HE1      TRP  21   8.148 -11.194  -5.655
  158    HE3  TRP  21           HE3      TRP  21  10.219 -10.931 -10.537
  159    HZ2  TRP  21           HZ2      TRP  21   7.306  -8.861  -7.082
  160    HZ3  TRP  21           HZ3      TRP  21   9.059  -8.791 -11.002
  161    HH2  TRP  21           HH2      TRP  21   7.605  -7.754  -9.282
  162    H    HIS  22           HN       HIS  22  11.103 -16.091  -7.492
  163    HA   HIS  22           HA       HIS  22   8.467 -16.682  -6.202
  164   1HB   HIS  22           HB2      HIS  22   9.646 -18.583  -7.466
  165   2HB   HIS  22           HB1      HIS  22  10.861 -18.527  -6.188
  166    HD1  HIS  22           HD1      HIS  22   7.033 -18.522  -6.238
  167    HD2  HIS  22           HD2      HIS  22  10.201 -20.345  -4.232
  168    HE1  HIS  22           HE1      HIS  22   5.999 -20.091  -4.540
  169    H    LEU  23           HN       LEU  23   8.590 -15.198  -4.511
  170    HA   LEU  23           HA       LEU  23  10.935 -15.492  -2.675
  171   1HB   LEU  23           HB2      LEU  23  10.618 -13.232  -3.830
  172   2HB   LEU  23           HB1      LEU  23   9.148 -13.058  -2.872
  173    HG   LEU  23           HG       LEU  23  10.509 -13.415  -0.803
  174   1HD1  LEU  23          HD11      LEU  23  12.703 -13.519  -2.869
  175   2HD1  LEU  23          HD13      LEU  23  13.042 -13.000  -1.218
  176   3HD1  LEU  23          HD12      LEU  23  12.407 -14.617  -1.521
  177   1HD2  LEU  23          HD23      LEU  23  10.117 -11.128  -2.197
  178   2HD2  LEU  23          HD22      LEU  23  10.990 -11.174  -0.665
  179   3HD2  LEU  23          HD21      LEU  23  11.880 -11.166  -2.188
  180    HA   PRO  24           HA       PRO  24   7.217 -17.475  -0.618
  181   1HB   PRO  24           HB2      PRO  24   9.258 -18.480   1.207
  182   2HB   PRO  24           HB1      PRO  24   8.152 -19.382   0.162
  183   1HG   PRO  24           HG2      PRO  24  10.941 -18.872  -0.227
  184   2HG   PRO  24           HG1      PRO  24   9.842 -19.808  -1.248
  185   1HD   PRO  24           HD2      PRO  24  11.010 -17.344  -1.902
  186   2HD   PRO  24           HD1      PRO  24   9.670 -18.127  -2.753
  187    H    ASP  25           HN       ASP  25  10.008 -15.758   0.760
  188    HA   ASP  25           HA       ASP  25   8.867 -15.202   3.321
  189   1HB   ASP  25           HB2      ASP  25  11.307 -14.848   2.412
  190   2HB   ASP  25           HB1      ASP  25  10.702 -13.255   1.954
  191    H    ASP  26           HN       ASP  26   8.813 -13.372   0.263
  192    HA   ASP  26           HA       ASP  26   7.368 -11.113   1.277
  193   1HB   ASP  26           HB2      ASP  26   8.587 -11.177  -0.915
  194   2HB   ASP  26           HB1      ASP  26   7.316 -12.225  -1.545
  195    H    LEU  27           HN       LEU  27   6.343 -14.244  -0.004
  196    HA   LEU  27           HA       LEU  27   3.533 -13.596  -0.172
  197   1HB   LEU  27           HB2      LEU  27   4.909 -16.283   0.144
  198   2HB   LEU  27           HB1      LEU  27   3.217 -16.051  -0.299
  199    HG   LEU  27           HG       LEU  27   5.556 -14.937  -1.873
  200   1HD1  LEU  27          HD13      LEU  27   4.085 -17.535  -1.985
  201   2HD1  LEU  27          HD12      LEU  27   4.510 -16.770  -3.516
  202   3HD1  LEU  27          HD11      LEU  27   5.773 -17.184  -2.357
  203   1HD2  LEU  27          HD23      LEU  27   2.559 -14.975  -2.218
  204   2HD2  LEU  27          HD22      LEU  27   3.667 -13.609  -2.352
  205   3HD2  LEU  27          HD21      LEU  27   3.623 -14.836  -3.617
  206    H    HIS  28           HN       HIS  28   5.659 -14.547   2.420
  207    HA   HIS  28           HA       HIS  28   3.466 -15.303   4.224
  208   1HB   HIS  28           HB2      HIS  28   6.453 -14.985   4.561
  209   2HB   HIS  28           HB1      HIS  28   5.389 -15.297   5.931
  210    HD1  HIS  28           HD1      HIS  28   3.422 -17.283   4.651
  211    HD2  HIS  28           HD2      HIS  28   7.556 -17.510   4.157
  212    HE1  HIS  28           HE1      HIS  28   3.939 -19.685   4.033
  213    H    TYR  29           HN       TYR  29   5.390 -12.473   3.480
  214    HA   TYR  29           HA       TYR  29   4.672 -10.985   5.870
  215   1HB   TYR  29           HB2      TYR  29   6.677 -10.528   4.370
  216   2HB   TYR  29           HB1      TYR  29   5.546  -9.844   3.203
  217    HD1  TYR  29           HD1      TYR  29   6.029  -9.671   6.928
  218    HD2  TYR  29           HD2      TYR  29   5.415  -7.526   3.258
  219    HE1  TYR  29           HE1      TYR  29   6.030  -7.529   8.178
  220    HE2  TYR  29           HE2      TYR  29   5.417  -5.384   4.508
  221    HH   TYR  29           HH       TYR  29   5.811  -4.413   6.485
  222    H    PHE  30           HN       PHE  30   3.194 -11.567   2.765
  223    HA   PHE  30           HA       PHE  30   1.418  -9.317   2.702
  224   1HB   PHE  30           HB2      PHE  30   1.910 -10.906   0.786
  225   2HB   PHE  30           HB1      PHE  30   0.859 -12.077   1.585
  226    HD1  PHE  30           HD2      PHE  30   0.900  -8.520   0.403
  227    HD2  PHE  30           HD1      PHE  30  -1.445 -12.035   1.175
  228    HE1  PHE  30           HE2      PHE  30  -1.089  -7.409  -0.579
  229    HE2  PHE  30           HE1      PHE  30  -3.433 -10.925   0.193
  230    HZ   PHE  30           HZ       PHE  30  -3.255  -8.611  -0.684
  231    H    ARG  31           HN       ARG  31   1.019 -12.631   3.967
  232    HA   ARG  31           HA       ARG  31  -1.677 -12.262   4.883
  233   1HB   ARG  31           HB2      ARG  31  -0.330 -14.460   4.591
  234   2HB   ARG  31           HB1      ARG  31   0.307 -14.116   6.199
  235   1HG   ARG  31           HG2      ARG  31  -1.811 -14.283   7.211
  236   2HG   ARG  31           HG1      ARG  31  -2.661 -14.058   5.682
  237   1HD   ARG  31           HD2      ARG  31  -2.833 -16.390   6.223
  238   2HD   ARG  31           HD1      ARG  31  -1.651 -16.260   4.921
  239    HE   ARG  31           HE       ARG  31   0.035 -16.945   6.437
  240   1HH1  ARG  31          HH21      ARG  31  -2.902 -16.112   8.095
  241   2HH1  ARG  31          HH22      ARG  31  -2.355 -16.724   9.621
  242   1HH2  ARG  31          HH11      ARG  31   0.734 -17.736   8.421
  243   2HH2  ARG  31          HH12      ARG  31  -0.306 -17.639   9.803
  244    H    ALA  32           HN       ALA  32   1.460 -11.509   6.271
  245    HA   ALA  32           HA       ALA  32   0.437 -11.010   8.954
  246   1HB   ALA  32           HB1      ALA  32   2.855 -11.592   8.309
  247   2HB   ALA  32           HB3      ALA  32   3.002  -9.912   7.791
  248   3HB   ALA  32           HB2      ALA  32   2.644 -10.288   9.477
  249    H    GLN  33           HN       GLN  33   0.906  -9.135   6.023
  250    HA   GLN  33           HA       GLN  33   0.187  -6.632   7.463
  251   1HB   GLN  33           HB2      GLN  33   1.347  -7.226   4.743
  252   2HB   GLN  33           HB1      GLN  33   0.644  -5.649   5.104
  253   1HG   GLN  33           HG2      GLN  33   2.769  -6.938   6.832
  254   2HG   GLN  33           HG1      GLN  33   3.145  -5.828   5.513
  255   1HE2  GLN  33          HE22      GLN  33   1.856  -4.352   9.047
  256   2HE2  GLN  33          HE21      GLN  33   2.161  -6.006   8.822
  257    H    THR  34           HN       THR  34  -1.760  -8.790   6.995
  258    HA   THR  34           HA       THR  34  -3.754  -7.189   5.471
  259    HB   THR  34           HB       THR  34  -4.621  -9.402   4.533
  260    HG1  THR  34           HG1      THR  34  -2.643 -10.865   4.373
  261   1HG2  THR  34          HG23      THR  34  -1.964  -8.210   3.741
  262   2HG2  THR  34          HG22      THR  34  -2.727  -9.489   2.796
  263   3HG2  THR  34          HG21      THR  34  -3.545  -7.941   3.008
  264    H    VAL  35           HN       VAL  35  -3.020  -9.643   7.880
  265    HA   VAL  35           HA       VAL  35  -5.732 -10.146   8.708
  266    HB   VAL  35           HB       VAL  35  -4.653 -11.022  10.797
  267   1HG1  VAL  35          HG12      VAL  35  -3.664 -11.809   8.060
  268   2HG1  VAL  35          HG11      VAL  35  -3.129 -12.681   9.497
  269   3HG1  VAL  35          HG13      VAL  35  -4.843 -12.629   9.084
  270   1HG2  VAL  35          HG23      VAL  35  -2.188  -9.895   9.438
  271   2HG2  VAL  35          HG22      VAL  35  -2.808  -9.486  11.037
  272   3HG2  VAL  35          HG21      VAL  35  -2.118 -11.081  10.741
  273    H    GLY  36           HN       GLY  36  -7.054  -8.891   9.936
  274   1HA   GLY  36           HA2      GLY  36  -7.741  -7.233  11.462
  275   2HA   GLY  36           HA1      GLY  36  -6.060  -7.082  11.978
  276    H    LYS  37           HN       LYS  37  -7.184  -6.734   8.648
  277    HA   LYS  37           HA       LYS  37  -7.047  -3.799   8.766
  278   1HB   LYS  37           HB2      LYS  37  -4.959  -5.487   7.383
  279   2HB   LYS  37           HB1      LYS  37  -5.307  -3.839   6.857
  280   1HG   LYS  37           HG2      LYS  37  -4.962  -3.145   9.297
  281   2HG   LYS  37           HG1      LYS  37  -4.281  -4.753   9.550
  282   1HD   LYS  37           HD2      LYS  37  -2.647  -4.318   7.723
  283   2HD   LYS  37           HD1      LYS  37  -3.290  -2.683   7.569
  284   1HE   LYS  37           HE2      LYS  37  -2.438  -2.007   9.631
  285   2HE   LYS  37           HE1      LYS  37  -2.381  -3.653  10.260
  286   1HZ   LYS  37           HZ1      LYS  37  -0.709  -3.837   8.194
  287   2HZ   LYS  37           HZ3      LYS  37  -0.449  -2.222   8.642
  288   3HZ   LYS  37           HZ2      LYS  37  -0.213  -3.464   9.776
  289    H    ILE  38           HN       ILE  38  -7.422  -2.906   6.463
  290    HA   ILE  38           HA       ILE  38  -9.475  -4.621   5.158
  291    HB   ILE  38           HB       ILE  38  -8.908  -1.670   4.745
  292   1HG1  ILE  38          HG12      ILE  38 -11.101  -2.939   6.409
  293   2HG1  ILE  38          HG11      ILE  38  -9.597  -2.330   7.100
  294   1HG2  ILE  38          HG23      ILE  38 -10.118  -2.812   2.905
  295   2HG2  ILE  38          HG22      ILE  38 -11.312  -3.394   4.066
  296   3HG2  ILE  38          HG21      ILE  38 -11.157  -1.665   3.751
  297   1HD1  ILE  38          HD11      ILE  38 -11.254  -0.571   5.308
  298   2HD1  ILE  38          HD13      ILE  38 -11.669  -0.743   7.013
  299   3HD1  ILE  38          HD12      ILE  38 -10.091  -0.105   6.551
  300    H    MET  39           HN       MET  39  -8.659  -5.811   3.503
  301    HA   MET  39           HA       MET  39  -6.329  -4.855   1.973
  302   1HB   MET  39           HB2      MET  39  -6.695  -7.280   2.698
  303   2HB   MET  39           HB1      MET  39  -7.953  -7.356   1.464
  304   1HG   MET  39           HG2      MET  39  -6.241  -6.580  -0.217
  305   2HG   MET  39           HG1      MET  39  -5.015  -6.749   1.038
  306   1HE   MET  39           HE2      MET  39  -7.978  -8.142  -0.495
  307   2HE   MET  39           HE1      MET  39  -7.528  -9.707  -1.170
  308   3HE   MET  39           HE3      MET  39  -8.135  -9.597   0.488
  309    H    VAL  40           HN       VAL  40  -6.834  -3.303   0.483
  310    HA   VAL  40           HA       VAL  40  -9.378  -3.492  -1.027
  311    HB   VAL  40           HB       VAL  40  -7.222  -1.363  -1.160
  312   1HG1  VAL  40          HG13      VAL  40 -10.097  -1.503  -2.105
  313   2HG1  VAL  40          HG12      VAL  40  -9.166  -0.007  -2.034
  314   3HG1  VAL  40          HG11      VAL  40  -8.655  -1.314  -3.103
  315   1HG2  VAL  40          HG23      VAL  40  -9.720  -1.601   0.541
  316   2HG2  VAL  40          HG22      VAL  40  -8.058  -1.411   1.100
  317   3HG2  VAL  40          HG21      VAL  40  -8.871  -0.077   0.281
  318    H    VAL  41           HN       VAL  41  -9.382  -4.582  -2.921
  319    HA   VAL  41           HA       VAL  41  -6.961  -4.443  -4.655
  320    HB   VAL  41           HB       VAL  41  -7.282  -6.871  -5.196
  321   1HG1  VAL  41          HG13      VAL  41  -6.706  -6.080  -2.329
  322   2HG1  VAL  41          HG12      VAL  41  -6.395  -7.694  -2.967
  323   3HG1  VAL  41          HG11      VAL  41  -5.540  -6.303  -3.634
  324   1HG2  VAL  41          HG22      VAL  41  -9.687  -6.899  -4.404
  325   2HG2  VAL  41          HG21      VAL  41  -8.706  -8.235  -3.799
  326   3HG2  VAL  41          HG23      VAL  41  -9.074  -6.866  -2.751
  327    H    GLY  42           HN       GLY  42  -7.473  -4.972  -6.936
  328   1HA   GLY  42           HA2      GLY  42 -10.124  -3.920  -7.670
  329   2HA   GLY  42           HA1      GLY  42  -8.794  -4.246  -8.782
  330    H    ARG  43           HN       ARG  43 -10.752  -5.220  -9.982
  331    HA   ARG  43           HA       ARG  43 -11.794  -7.757  -9.003
  332   1HB   ARG  43           HB2      ARG  43 -12.740  -7.936 -11.321
  333   2HB   ARG  43           HB1      ARG  43 -13.156  -6.424 -10.515
  334   1HG   ARG  43           HG2      ARG  43 -11.277  -5.300 -11.680
  335   2HG   ARG  43           HG1      ARG  43 -10.912  -6.808 -12.518
  336   1HD   ARG  43           HD2      ARG  43 -13.698  -5.700 -12.654
  337   2HD   ARG  43           HD1      ARG  43 -12.443  -5.000 -13.678
  338    HE   ARG  43           HE       ARG  43 -13.644  -7.640 -14.000
  339   1HH1  ARG  43          HH11      ARG  43 -10.835  -5.669 -14.540
  340   2HH1  ARG  43          HH12      ARG  43 -10.281  -6.616 -15.879
  341   1HH2  ARG  43          HH21      ARG  43 -12.916  -8.861 -15.740
  342   2HH2  ARG  43          HH22      ARG  43 -11.454  -8.414 -16.555
  343    H    ARG  44           HN       ARG  44  -9.189  -6.735 -11.151
  344    HA   ARG  44           HA       ARG  44  -8.605  -9.340 -12.233
  345   1HB   ARG  44           HB2      ARG  44  -7.011  -6.789 -11.951
  346   2HB   ARG  44           HB1      ARG  44  -6.298  -8.252 -12.635
  347   1HG   ARG  44           HG2      ARG  44  -8.341  -8.310 -14.199
  348   2HG   ARG  44           HG1      ARG  44  -8.634  -6.650 -13.681
  349   1HD   ARG  44           HD2      ARG  44  -6.619  -5.870 -14.614
  350   2HD   ARG  44           HD1      ARG  44  -5.918  -7.487 -14.678
  351    HE   ARG  44           HE       ARG  44  -8.285  -7.247 -16.349
  352   1HH1  ARG  44          HH21      ARG  44  -4.867  -6.662 -16.139
  353   2HH1  ARG  44          HH22      ARG  44  -4.631  -6.720 -17.854
  354   1HH2  ARG  44          HH11      ARG  44  -7.966  -7.320 -18.574
  355   2HH2  ARG  44          HH12      ARG  44  -6.377  -7.091 -19.224
  356    H    THR  45           HN       THR  45  -7.202  -7.492  -9.515
  357    HA   THR  45           HA       THR  45  -5.383  -9.597  -8.730
  358    HB   THR  45           HB       THR  45  -6.491  -7.406  -6.956
  359    HG1  THR  45           HG1      THR  45  -4.697  -6.208  -7.754
  360   1HG2  THR  45          HG22      THR  45  -5.013  -9.371  -6.103
  361   2HG2  THR  45          HG21      THR  45  -3.708  -8.553  -6.962
  362   3HG2  THR  45          HG23      THR  45  -4.560  -7.727  -5.658
  363    H    TYR  46           HN       TYR  46  -8.743  -8.908  -8.090
  364    HA   TYR  46           HA       TYR  46  -9.070 -10.463  -5.707
  365   1HB   TYR  46           HB2      TYR  46 -10.745  -8.833  -6.724
  366   2HB   TYR  46           HB1      TYR  46 -11.144 -10.100  -7.883
  367    HD1  TYR  46           HD1      TYR  46 -10.669  -9.687  -4.180
  368    HD2  TYR  46           HD2      TYR  46 -12.895 -11.539  -7.353
  369    HE1  TYR  46           HE1      TYR  46 -12.169 -10.744  -2.511
  370    HE2  TYR  46           HE2      TYR  46 -14.393 -12.597  -5.683
  371    HH   TYR  46           HH       TYR  46 -14.304 -13.253  -3.291
  372    H    GLU  47           HN       GLU  47  -9.357 -11.309  -9.158
  373    HA   GLU  47           HA       GLU  47  -9.930 -14.118  -8.530
  374   1HB   GLU  47           HB2      GLU  47  -9.384 -12.663 -11.133
  375   2HB   GLU  47           HB1      GLU  47  -9.750 -14.385 -11.033
  376   1HG   GLU  47           HG2      GLU  47 -11.870 -13.759  -9.791
  377   2HG   GLU  47           HG1      GLU  47 -11.528 -12.079 -10.206
  378    H    SER  48           HN       SER  48  -7.142 -12.143  -9.155
  379    HA   SER  48           HA       SER  48  -5.334 -14.149 -10.092
  380   1HB   SER  48           HB2      SER  48  -4.959 -11.623 -10.036
  381   2HB   SER  48           HB1      SER  48  -4.587 -11.809  -8.325
  382    HG   SER  48           HG       SER  48  -2.864 -13.087  -8.849
  383    H    PHE  49           HN       PHE  49  -6.646 -13.477  -6.941
  384    HA   PHE  49           HA       PHE  49  -4.632 -14.723  -5.332
  385   1HB   PHE  49           HB2      PHE  49  -7.612 -14.369  -4.914
  386   2HB   PHE  49           HB1      PHE  49  -6.531 -15.023  -3.682
  387    HD1  PHE  49           HD2      PHE  49  -4.193 -13.522  -3.596
  388    HD2  PHE  49           HD1      PHE  49  -8.126 -12.124  -4.609
  389    HE1  PHE  49           HE2      PHE  49  -3.542 -11.220  -2.943
  390    HE2  PHE  49           HE1      PHE  49  -7.476  -9.822  -3.955
  391    HZ   PHE  49           HZ       PHE  49  -5.184  -9.370  -3.122
  392    HA   PRO  50           HA       PRO  50  -5.378 -19.050  -6.072
  393   1HB   PRO  50           HB2      PRO  50  -4.640 -20.017  -3.558
  394   2HB   PRO  50           HB1      PRO  50  -3.533 -19.651  -4.888
  395   1HG   PRO  50           HG2      PRO  50  -3.812 -18.285  -2.380
  396   2HG   PRO  50           HG1      PRO  50  -2.671 -17.957  -3.692
  397   1HD   PRO  50           HD2      PRO  50  -5.121 -16.531  -2.993
  398   2HD   PRO  50           HD1      PRO  50  -3.815 -16.043  -4.085
  399    H    LYS  51           HN       LYS  51  -6.167 -18.737  -2.603
  400    HA   LYS  51           HA       LYS  51  -8.788 -20.042  -3.180
  401   1HB   LYS  51           HB2      LYS  51  -7.031 -21.000  -1.495
  402   2HB   LYS  51           HB1      LYS  51  -7.614 -19.725  -0.427
  403   1HG   LYS  51           HG2      LYS  51  -8.950 -21.648   0.061
  404   2HG   LYS  51           HG1      LYS  51  -9.971 -20.581  -0.905
  405   1HD   LYS  51           HD2      LYS  51  -9.557 -21.871  -2.901
  406   2HD   LYS  51           HD1      LYS  51  -8.325 -22.834  -2.083
  407   1HE   LYS  51           HE2      LYS  51 -11.167 -22.744  -1.073
  408   2HE   LYS  51           HE1      LYS  51 -10.677 -23.878  -2.331
  409   1HZ   LYS  51           HZ1      LYS  51  -8.856 -23.814  -0.122
  410   2HZ   LYS  51           HZ3      LYS  51 -10.423 -24.261   0.350
  411   3HZ   LYS  51           HZ2      LYS  51  -9.617 -25.141  -0.860
  412    H    ARG  52           HN       ARG  52  -9.908 -18.112  -3.768
  413    HA   ARG  52           HA       ARG  52 -10.063 -15.960  -1.727
  414   1HB   ARG  52           HB2      ARG  52 -11.375 -14.762  -3.498
  415   2HB   ARG  52           HB1      ARG  52  -9.749 -15.206  -4.018
  416   1HG   ARG  52           HG2      ARG  52 -10.785 -17.328  -4.990
  417   2HG   ARG  52           HG1      ARG  52 -12.355 -16.573  -4.717
  418   1HD   ARG  52           HD2      ARG  52 -10.319 -14.912  -6.108
  419   2HD   ARG  52           HD1      ARG  52 -10.977 -16.271  -7.018
  420    HE   ARG  52           HE       ARG  52 -12.465 -13.883  -6.158
  421   1HH1  ARG  52          HH21      ARG  52 -12.553 -17.148  -7.340
  422   2HH1  ARG  52          HH22      ARG  52 -14.159 -17.003  -7.971
  423   1HH2  ARG  52          HH11      ARG  52 -14.549 -13.706  -6.981
  424   2HH2  ARG  52          HH12      ARG  52 -15.283 -15.063  -7.769
  425    HA   PRO  53           HA       PRO  53 -11.590 -14.209  -1.587
  426   1HB   PRO  53           HB2      PRO  53 -13.151 -13.456   0.611
  427   2HB   PRO  53           HB1      PRO  53 -13.542 -13.157  -1.089
  428   1HG   PRO  53           HG2      PRO  53 -14.869 -14.906   0.748
  429   2HG   PRO  53           HG1      PRO  53 -15.266 -14.589  -0.948
  430   1HD   PRO  53           HD2      PRO  53 -13.900 -16.898   0.225
  431   2HD   PRO  53           HD1      PRO  53 -14.613 -16.716  -1.387
  432    H    LEU  54           HN       LEU  54  -9.956 -13.431  -0.237
  433    HA   LEU  54           HA       LEU  54  -8.709 -15.208   1.608
  434   1HB   LEU  54           HB2      LEU  54  -8.409 -12.200   1.375
  435   2HB   LEU  54           HB1      LEU  54  -7.282 -13.284   2.191
  436    HG   LEU  54           HG       LEU  54  -8.023 -13.489  -0.741
  437   1HD1  LEU  54          HD13      LEU  54  -6.567 -11.466   0.283
  438   2HD1  LEU  54          HD12      LEU  54  -5.298 -12.682   0.148
  439   3HD1  LEU  54          HD11      LEU  54  -6.206 -12.193  -1.282
  440   1HD2  LEU  54          HD21      LEU  54  -5.916 -14.840   0.976
  441   2HD2  LEU  54          HD23      LEU  54  -7.313 -15.614   0.228
  442   3HD2  LEU  54          HD22      LEU  54  -6.011 -14.982  -0.780
  443    HA   PRO  55           HA       PRO  55 -11.576 -14.214   5.013
  444   1HB   PRO  55           HB2      PRO  55 -10.731 -16.430   6.522
  445   2HB   PRO  55           HB1      PRO  55 -12.127 -16.372   5.438
  446   1HG   PRO  55           HG2      PRO  55  -9.704 -17.843   5.106
  447   2HG   PRO  55           HG1      PRO  55 -11.099 -17.774   4.020
  448   1HD   PRO  55           HD2      PRO  55  -8.507 -16.441   3.777
  449   2HD   PRO  55           HD1      PRO  55  -9.773 -16.662   2.558
  450    H    GLU  56           HN       GLU  56 -11.066 -14.382   7.580
  451    HA   GLU  56           HA       GLU  56  -9.825 -13.481   9.352
  452   1HB   GLU  56           HB2      GLU  56  -7.816 -14.839   7.634
  453   2HB   GLU  56           HB1      GLU  56  -7.179 -13.654   8.774
  454   1HG   GLU  56           HG2      GLU  56  -8.711 -14.852  10.511
  455   2HG   GLU  56           HG1      GLU  56  -8.724 -16.174   9.344
  456    H    ARG  57           HN       ARG  57 -10.634 -11.813   7.028
  457    HA   ARG  57           HA       ARG  57  -9.363  -9.368   7.782
  458   1HB   ARG  57           HB2      ARG  57  -8.119  -8.915   5.665
  459   2HB   ARG  57           HB1      ARG  57  -7.416 -10.241   6.591
  460   1HG   ARG  57           HG2      ARG  57  -9.006 -11.736   5.124
  461   2HG   ARG  57           HG1      ARG  57  -8.994 -10.346   4.038
  462   1HD   ARG  57           HD2      ARG  57  -7.173 -11.597   3.259
  463   2HD   ARG  57           HD1      ARG  57  -6.399 -10.446   4.349
  464    HE   ARG  57           HE       ARG  57  -6.870 -12.530   6.032
  465   1HH1  ARG  57          HH11      ARG  57  -5.561 -12.380   2.817
  466   2HH1  ARG  57          HH12      ARG  57  -4.557 -13.776   3.033
  467   1HH2  ARG  57          HH21      ARG  57  -5.563 -14.338   6.300
  468   2HH2  ARG  57          HH22      ARG  57  -4.558 -14.878   4.996
  469    H    THR  58           HN       THR  58  -9.877  -7.631   5.944
  470    HA   THR  58           HA       THR  58 -12.690  -8.159   5.121
  471    HB   THR  58           HB       THR  58 -11.279  -5.488   5.055
  472    HG1  THR  58           HG1      THR  58 -12.695  -5.539   7.186
  473   1HG2  THR  58          HG23      THR  58 -13.550  -5.934   3.946
  474   2HG2  THR  58          HG22      THR  58 -14.182  -6.126   5.581
  475   3HG2  THR  58          HG21      THR  58 -13.475  -4.589   5.084
  476    H    ASN  59           HN       ASN  59 -13.002  -8.703   3.027
  477    HA   ASN  59           HA       ASN  59 -10.898  -8.093   1.033
  478   1HB   ASN  59           HB2      ASN  59 -13.446  -9.711   0.728
  479   2HB   ASN  59           HB1      ASN  59 -12.107  -9.643  -0.418
  480   1HD2  ASN  59          HD22      ASN  59  -9.923 -11.329   2.115
  481   2HD2  ASN  59          HD21      ASN  59  -9.892  -9.827   1.326
  482    H    VAL  60           HN       VAL  60 -11.115  -6.010   0.301
  483    HA   VAL  60           HA       VAL  60 -13.848  -5.049  -0.418
  484    HB   VAL  60           HB       VAL  60 -11.288  -3.446  -0.142
  485   1HG1  VAL  60          HG11      VAL  60 -14.212  -2.670  -0.364
  486   2HG1  VAL  60          HG13      VAL  60 -12.901  -1.541  -0.016
  487   3HG1  VAL  60          HG12      VAL  60 -12.956  -2.378  -1.568
  488   1HG2  VAL  60          HG23      VAL  60 -13.541  -3.997   1.810
  489   2HG2  VAL  60          HG22      VAL  60 -11.826  -4.344   2.030
  490   3HG2  VAL  60          HG21      VAL  60 -12.393  -2.674   2.009
  491    H    VAL  61           HN       VAL  61 -14.349  -5.141  -2.543
  492    HA   VAL  61           HA       VAL  61 -12.117  -5.225  -4.526
  493    HB   VAL  61           HB       VAL  61 -15.017  -6.027  -4.906
  494   1HG1  VAL  61          HG11      VAL  61 -13.660  -5.373  -6.938
  495   2HG1  VAL  61          HG13      VAL  61 -12.562  -6.698  -6.550
  496   3HG1  VAL  61          HG12      VAL  61 -14.245  -7.037  -6.957
  497   1HG2  VAL  61          HG23      VAL  61 -13.808  -7.427  -3.217
  498   2HG2  VAL  61          HG22      VAL  61 -14.244  -8.330  -4.668
  499   3HG2  VAL  61          HG21      VAL  61 -12.584  -7.781  -4.436
  500    H    LEU  62           HN       LEU  62 -11.848  -3.482  -5.828
  501    HA   LEU  62           HA       LEU  62 -13.975  -1.394  -5.832
  502   1HB   LEU  62           HB2      LEU  62 -11.614  -0.799  -5.145
  503   2HB   LEU  62           HB1      LEU  62 -11.114  -1.151  -6.799
  504    HG   LEU  62           HG       LEU  62 -12.950   0.500  -7.524
  505   1HD1  LEU  62          HD11      LEU  62 -12.879   0.886  -4.547
  506   2HD1  LEU  62          HD13      LEU  62 -13.194   2.273  -5.589
  507   3HD1  LEU  62          HD12      LEU  62 -14.266   0.874  -5.636
  508   1HD2  LEU  62          HD22      LEU  62 -10.506   1.411  -5.975
  509   2HD2  LEU  62          HD21      LEU  62 -10.600   1.080  -7.704
  510   3HD2  LEU  62          HD23      LEU  62 -11.454   2.465  -7.025
  511    H    THR  63           HN       THR  63 -15.252  -1.306  -7.604
  512    HA   THR  63           HA       THR  63 -14.069  -1.884 -10.268
  513    HB   THR  63           HB       THR  63 -15.069  -4.005  -9.618
  514    HG1  THR  63           HG1      THR  63 -17.085  -3.648 -11.146
  515   1HG2  THR  63          HG22      THR  63 -17.433  -2.267  -8.906
  516   2HG2  THR  63          HG21      THR  63 -17.588  -4.006  -9.158
  517   3HG2  THR  63          HG23      THR  63 -16.556  -3.391  -7.867
  518    H    HIS  64           HN       HIS  64 -15.324  -0.939 -12.017
  519    HA   HIS  64           HA       HIS  64 -16.749   1.495 -11.170
  520   1HB   HIS  64           HB2      HIS  64 -15.028   1.325 -13.090
  521   2HB   HIS  64           HB1      HIS  64 -16.332   0.583 -14.017
  522    HD1  HIS  64           HD1      HIS  64 -16.999   2.448 -15.578
  523    HD2  HIS  64           HD2      HIS  64 -16.742   3.728 -11.619
  524    HE1  HIS  64           HE1      HIS  64 -17.890   4.818 -15.532
  525    H    GLN  65           HN       GLN  65 -17.468  -1.085 -13.554
  526    HA   GLN  65           HA       GLN  65 -20.319  -0.476 -13.479
  527   1HB   GLN  65           HB2      GLN  65 -18.811  -2.808 -14.703
  528   2HB   GLN  65           HB1      GLN  65 -20.517  -2.450 -14.974
  529   1HG   GLN  65           HG2      GLN  65 -20.012  -0.389 -16.073
  530   2HG   GLN  65           HG1      GLN  65 -18.330  -0.440 -15.542
  531   1HE2  GLN  65          HE22      GLN  65 -17.328  -2.774 -18.059
  532   2HE2  GLN  65          HE21      GLN  65 -16.924  -2.132 -16.541
  533    H    GLU  66           HN       GLU  66 -21.948  -1.725 -12.501
  534    HA   GLU  66           HA       GLU  66 -21.077  -3.311 -10.181
  535   1HB   GLU  66           HB2      GLU  66 -23.537  -3.401  -9.690
  536   2HB   GLU  66           HB1      GLU  66 -22.919  -1.757  -9.855
  537   1HG   GLU  66           HG2      GLU  66 -23.732  -1.641 -12.155
  538   2HG   GLU  66           HG1      GLU  66 -24.263  -3.321 -12.079
  539    H    ASP  67           HN       ASP  67 -20.621  -4.367 -12.909
  540    HA   ASP  67           HA       ASP  67 -22.551  -6.580 -13.178
  541   1HB   ASP  67           HB2      ASP  67 -20.143  -5.663 -14.748
  542   2HB   ASP  67           HB1      ASP  67 -20.885  -7.234 -15.053
  543    H    TYR  68           HN       TYR  68 -19.284  -6.015 -12.005
  544    HA   TYR  68           HA       TYR  68 -18.520  -8.793 -11.805
  545   1HB   TYR  68           HB2      TYR  68 -17.002  -6.705 -11.728
  546   2HB   TYR  68           HB1      TYR  68 -17.473  -6.584 -10.032
  547    HD1  TYR  68           HD1      TYR  68 -15.683  -8.609 -12.539
  548    HD2  TYR  68           HD2      TYR  68 -16.778  -8.255  -8.400
  549    HE1  TYR  68           HE1      TYR  68 -14.021 -10.353 -11.949
  550    HE2  TYR  68           HE2      TYR  68 -15.116  -9.999  -7.811
  551    HH   TYR  68           HH       TYR  68 -13.983 -12.109  -9.521
  552    H    GLN  69           HN       GLN  69 -19.256 -10.262 -10.360
  553    HA   GLN  69           HA       GLN  69 -20.736  -9.271  -7.967
  554   1HB   GLN  69           HB2      GLN  69 -20.756 -11.972  -9.351
  555   2HB   GLN  69           HB1      GLN  69 -21.679 -11.584  -7.899
  556   1HG   GLN  69           HG2      GLN  69 -23.297 -11.062  -9.437
  557   2HG   GLN  69           HG1      GLN  69 -22.440  -9.520  -9.462
  558   1HE2  GLN  69          HE22      GLN  69 -22.791 -10.940 -12.972
  559   2HE2  GLN  69          HE21      GLN  69 -23.923 -10.698 -11.730
  560    H    ALA  70           HN       ALA  70 -19.897  -9.635  -5.961
  561    HA   ALA  70           HA       ALA  70 -17.783 -11.709  -5.643
  562   1HB   ALA  70           HB1      ALA  70 -16.764  -9.406  -5.994
  563   2HB   ALA  70           HB3      ALA  70 -17.535  -8.923  -4.482
  564   3HB   ALA  70           HB2      ALA  70 -16.317 -10.198  -4.483
  565    H    GLN  71           HN       GLN  71 -18.651 -13.049  -4.138
  566    HA   GLN  71           HA       GLN  71 -20.460 -11.974  -2.062
  567   1HB   GLN  71           HB2      GLN  71 -19.613 -14.788  -2.800
  568   2HB   GLN  71           HB1      GLN  71 -20.693 -14.417  -1.455
  569   1HG   GLN  71           HG2      GLN  71 -22.321 -13.433  -2.938
  570   2HG   GLN  71           HG1      GLN  71 -21.209 -13.528  -4.305
  571   1HE2  GLN  71          HE22      GLN  71 -21.502 -17.211  -4.373
  572   2HE2  GLN  71          HE21      GLN  71 -20.253 -16.064  -4.318
  573    H    GLY  72           HN       GLY  72 -19.965 -11.972   0.141
  574   1HA   GLY  72           HA2      GLY  72 -18.642 -12.109   2.082
  575   2HA   GLY  72           HA1      GLY  72 -17.600 -13.248   1.227
  576    H    ALA  73           HN       ALA  73 -18.382  -9.998   0.090
  577    HA   ALA  73           HA       ALA  73 -15.826  -8.884   0.993
  578   1HB   ALA  73           HB2      ALA  73 -16.320  -9.629  -1.893
  579   2HB   ALA  73           HB1      ALA  73 -15.190  -8.349  -1.448
  580   3HB   ALA  73           HB3      ALA  73 -14.915 -10.001  -0.893
  581    H    VAL  74           HN       VAL  74 -15.890  -6.633   0.967
  582    HA   VAL  74           HA       VAL  74 -18.496  -5.403   0.520
  583    HB   VAL  74           HB       VAL  74 -15.843  -4.066   1.134
  584   1HG1  VAL  74          HG13      VAL  74 -18.734  -3.217   1.475
  585   2HG1  VAL  74          HG12      VAL  74 -17.357  -2.334   2.132
  586   3HG1  VAL  74          HG11      VAL  74 -17.547  -2.499   0.387
  587   1HG2  VAL  74          HG23      VAL  74 -17.957  -5.270   2.943
  588   2HG2  VAL  74          HG22      VAL  74 -16.253  -5.715   2.848
  589   3HG2  VAL  74          HG21      VAL  74 -16.720  -4.148   3.511
  590    H    VAL  75           HN       VAL  75 -18.967  -5.427  -1.687
  591    HA   VAL  75           HA       VAL  75 -17.029  -4.665  -3.711
  592    HB   VAL  75           HB       VAL  75 -20.052  -4.760  -3.936
  593   1HG1  VAL  75          HG11      VAL  75 -18.721  -3.619  -5.762
  594   2HG1  VAL  75          HG13      VAL  75 -17.918  -5.163  -6.047
  595   3HG1  VAL  75          HG12      VAL  75 -19.656  -5.013  -6.299
  596   1HG2  VAL  75          HG21      VAL  75 -17.965  -6.928  -4.339
  597   2HG2  VAL  75          HG23      VAL  75 -19.206  -6.896  -3.086
  598   3HG2  VAL  75          HG22      VAL  75 -19.667  -7.077  -4.779
  599    H    VAL  76           HN       VAL  76 -16.255  -2.584  -3.289
  600    HA   VAL  76           HA       VAL  76 -18.190  -0.383  -2.883
  601    HB   VAL  76           HB       VAL  76 -16.116   1.008  -2.645
  602   1HG1  VAL  76          HG12      VAL  76 -16.235  -1.523  -0.977
  603   2HG1  VAL  76          HG11      VAL  76 -15.384  -0.048  -0.521
  604   3HG1  VAL  76          HG13      VAL  76 -17.141  -0.041  -0.675
  605   1HG2  VAL  76          HG23      VAL  76 -14.753  -0.497  -4.170
  606   2HG2  VAL  76          HG22      VAL  76 -13.949  -0.044  -2.668
  607   3HG2  VAL  76          HG21      VAL  76 -14.666  -1.647  -2.835
  608    H    HIS  77           HN       HIS  77 -18.050   1.556  -4.278
  609    HA   HIS  77           HA       HIS  77 -16.982   1.020  -7.009
  610   1HB   HIS  77           HB2      HIS  77 -19.775   2.030  -6.382
  611   2HB   HIS  77           HB1      HIS  77 -19.075   1.900  -7.996
  612    HD1  HIS  77           HD1      HIS  77 -18.940  -0.428  -9.056
  613    HD2  HIS  77           HD2      HIS  77 -20.340  -0.510  -5.130
  614    HE1  HIS  77           HE1      HIS  77 -19.796  -2.776  -8.649
  615    H    ASP  78           HN       ASP  78 -16.122   2.742  -4.744
  616    HA   ASP  78           HA       ASP  78 -15.582   5.147  -6.244
  617   1HB   ASP  78           HB2      ASP  78 -18.017   5.430  -5.431
  618   2HB   ASP  78           HB1      ASP  78 -17.324   5.591  -3.817
  619    H    VAL  79           HN       VAL  79 -13.929   6.357  -5.244
  620    HA   VAL  79           HA       VAL  79 -12.353   4.974  -3.266
  621    HB   VAL  79           HB       VAL  79 -12.137   7.874  -4.130
  622   1HG1  VAL  79          HG13      VAL  79 -10.854   6.985  -2.078
  623   2HG1  VAL  79          HG12      VAL  79  -9.940   6.007  -3.228
  624   3HG1  VAL  79          HG11      VAL  79  -9.902   7.767  -3.341
  625   1HG2  VAL  79          HG21      VAL  79 -11.021   5.328  -5.344
  626   2HG2  VAL  79          HG23      VAL  79 -12.108   6.484  -6.112
  627   3HG2  VAL  79          HG22      VAL  79 -10.444   6.943  -5.757
  628    H    ALA  80           HN       ALA  80 -14.700   7.600  -3.127
  629    HA   ALA  80           HA       ALA  80 -14.130   8.421  -0.425
  630   1HB   ALA  80           HB3      ALA  80 -15.510   9.665  -2.213
  631   2HB   ALA  80           HB2      ALA  80 -16.839   8.601  -1.752
  632   3HB   ALA  80           HB1      ALA  80 -16.130   9.694  -0.563
  633    H    ALA  81           HN       ALA  81 -16.189   5.929  -1.840
  634    HA   ALA  81           HA       ALA  81 -17.643   5.282   0.557
  635   1HB   ALA  81           HB2      ALA  81 -18.157   4.580  -1.873
  636   2HB   ALA  81           HB1      ALA  81 -16.962   3.307  -1.624
  637   3HB   ALA  81           HB3      ALA  81 -18.409   3.368  -0.616
  638    H    VAL  82           HN       VAL  82 -14.573   4.154  -0.806
  639    HA   VAL  82           HA       VAL  82 -14.158   2.039   1.112
  640    HB   VAL  82           HB       VAL  82 -12.064   3.605  -0.426
  641   1HG1  VAL  82          HG11      VAL  82 -11.289   2.112   1.446
  642   2HG1  VAL  82          HG13      VAL  82 -12.044   0.755   0.610
  643   3HG1  VAL  82          HG12      VAL  82 -10.703   1.619  -0.142
  644   1HG2  VAL  82          HG23      VAL  82 -13.958   1.408  -1.211
  645   2HG2  VAL  82          HG22      VAL  82 -13.439   2.816  -2.139
  646   3HG2  VAL  82          HG21      VAL  82 -12.345   1.449  -1.925
  647    H    PHE  83           HN       PHE  83 -13.265   5.470   1.004
  648    HA   PHE  83           HA       PHE  83 -11.671   5.382   3.425
  649   1HB   PHE  83           HB2      PHE  83 -12.859   7.571   1.733
  650   2HB   PHE  83           HB1      PHE  83 -12.155   7.951   3.305
  651    HD1  PHE  83           HD2      PHE  83  -9.818   6.564   3.704
  652    HD2  PHE  83           HD1      PHE  83 -11.422   7.823  -0.076
  653    HE1  PHE  83           HE2      PHE  83  -7.546   6.478   2.711
  654    HE2  PHE  83           HE1      PHE  83  -9.151   7.737  -1.069
  655    HZ   PHE  83           HZ       PHE  83  -7.213   7.065   0.325
  656    H    ALA  84           HN       ALA  84 -15.068   5.897   2.686
  657    HA   ALA  84           HA       ALA  84 -15.839   6.986   5.235
  658   1HB   ALA  84           HB2      ALA  84 -17.456   5.387   3.226
  659   2HB   ALA  84           HB1      ALA  84 -18.131   6.303   4.573
  660   3HB   ALA  84           HB3      ALA  84 -17.299   7.143   3.264
  661    H    TYR  85           HN       TYR  85 -15.587   3.676   3.981
  662    HA   TYR  85           HA       TYR  85 -16.732   2.407   6.308
  663   1HB   TYR  85           HB2      TYR  85 -16.398   1.398   3.966
  664   2HB   TYR  85           HB1      TYR  85 -14.718   1.145   4.441
  665    HD1  TYR  85           HD2      TYR  85 -14.191  -0.275   6.447
  666    HD2  TYR  85           HD1      TYR  85 -18.152   0.012   4.811
  667    HE1  TYR  85           HE2      TYR  85 -14.847  -2.328   7.675
  668    HE2  TYR  85           HE1      TYR  85 -18.808  -2.041   6.039
  669    HH   TYR  85           HH       TYR  85 -16.434  -3.882   7.939
  670    H    ALA  86           HN       ALA  86 -13.481   3.432   5.412
  671    HA   ALA  86           HA       ALA  86 -12.111   2.038   7.538
  672   1HB   ALA  86           HB2      ALA  86 -11.373   4.460   5.874
  673   2HB   ALA  86           HB1      ALA  86 -10.285   3.731   7.054
  674   3HB   ALA  86           HB3      ALA  86 -10.818   2.800   5.655
  675    H    LYS  87           HN       LYS  87 -13.758   5.135   7.287
  676    HA   LYS  87           HA       LYS  87 -12.725   6.313   9.692
  677   1HB   LYS  87           HB2      LYS  87 -15.298   6.731   8.151
  678   2HB   LYS  87           HB1      LYS  87 -14.873   7.683   9.575
  679   1HG   LYS  87           HG2      LYS  87 -12.872   8.514   8.512
  680   2HG   LYS  87           HG1      LYS  87 -13.078   7.413   7.150
  681   1HD   LYS  87           HD2      LYS  87 -14.933   8.598   6.311
  682   2HD   LYS  87           HD1      LYS  87 -15.221   9.412   7.850
  683   1HE   LYS  87           HE2      LYS  87 -14.216  11.007   6.323
  684   2HE   LYS  87           HE1      LYS  87 -13.028  10.600   7.560
  685   1HZ   LYS  87           HZ1      LYS  87 -12.252   8.835   5.929
  686   2HZ   LYS  87           HZ3      LYS  87 -13.153   9.669   4.759
  687   3HZ   LYS  87           HZ2      LYS  87 -11.873  10.449   5.559
  688    H    GLN  88           HN       GLN  88 -15.541   4.244   9.038
  689    HA   GLN  88           HA       GLN  88 -16.603   4.341  11.712
  690   1HB   GLN  88           HB2      GLN  88 -16.921   2.382   9.430
  691   2HB   GLN  88           HB1      GLN  88 -17.744   2.167  10.976
  692   1HG   GLN  88           HG2      GLN  88 -18.710   4.467  10.716
  693   2HG   GLN  88           HG1      GLN  88 -17.996   4.539   9.105
  694   1HE2  GLN  88          HE22      GLN  88 -21.558   2.865   9.420
  695   2HE2  GLN  88          HE21      GLN  88 -20.905   4.006  10.493
  696    H    HIS  89           HN       HIS  89 -14.160   2.357  10.133
  697    HA   HIS  89           HA       HIS  89 -13.698   0.975  12.749
  698   1HB   HIS  89           HB2      HIS  89 -13.477  -0.012   9.909
  699   2HB   HIS  89           HB1      HIS  89 -12.572  -0.790  11.208
  700    HD1  HIS  89           HD1      HIS  89 -13.804  -2.685  12.236
  701    HD2  HIS  89           HD2      HIS  89 -16.421   0.232  10.816
  702    HE1  HIS  89           HE1      HIS  89 -16.144  -3.526  12.716
  703    HA   PRO  90           HA       PRO  90  -9.881   3.430  11.962
  704   1HB   PRO  90           HB2      PRO  90  -9.618   4.092  14.670
  705   2HB   PRO  90           HB1      PRO  90 -10.343   5.110  13.419
  706   1HG   PRO  90           HG2      PRO  90 -11.639   3.829  15.628
  707   2HG   PRO  90           HG1      PRO  90 -12.356   4.866  14.386
  708   1HD   PRO  90           HD2      PRO  90 -12.446   1.953  14.629
  709   2HD   PRO  90           HD1      PRO  90 -13.421   3.022  13.607
  710    H    ASP  91           HN       ASP  91 -10.698   0.842  14.132
  711    HA   ASP  91           HA       ASP  91  -8.090   0.322  15.215
  712   1HB   ASP  91           HB2      ASP  91  -9.005  -1.977  15.634
  713   2HB   ASP  91           HB1      ASP  91 -10.059  -0.690  16.223
  714    H    GLN  92           HN       GLN  92  -9.591  -0.394  12.144
  715    HA   GLN  92           HA       GLN  92  -7.436  -2.279  11.391
  716   1HB   GLN  92           HB2      GLN  92  -9.978  -1.342  10.062
  717   2HB   GLN  92           HB1      GLN  92  -8.754  -2.243   9.167
  718   1HG   GLN  92           HG2      GLN  92  -8.863  -3.987  11.024
  719   2HG   GLN  92           HG1      GLN  92 -10.302  -3.147  11.602
  720   1HE2  GLN  92          HE22      GLN  92 -12.394  -4.429   9.059
  721   2HE2  GLN  92          HE21      GLN  92 -12.266  -3.416  10.415
  722    H    GLU  93           HN       GLU  93  -6.703  -1.800   8.935
  723    HA   GLU  93           HA       GLU  93  -6.090   1.102   8.645
  724   1HB   GLU  93           HB2      GLU  93  -4.116  -1.181   8.768
  725   2HB   GLU  93           HB1      GLU  93  -3.725   0.335   7.953
  726   1HG   GLU  93           HG2      GLU  93  -4.771   0.267  10.788
  727   2HG   GLU  93           HG1      GLU  93  -3.048   0.158  10.424
  728    H    LEU  94           HN       LEU  94  -5.885   1.766   6.487
  729    HA   LEU  94           HA       LEU  94  -6.963  -0.107   4.488
  730   1HB   LEU  94           HB2      LEU  94  -7.581   2.398   4.753
  731   2HB   LEU  94           HB1      LEU  94  -6.048   2.715   3.939
  732    HG   LEU  94           HG       LEU  94  -6.866   1.036   2.154
  733   1HD1  LEU  94          HD12      LEU  94  -9.440   1.647   3.634
  734   2HD1  LEU  94          HD11      LEU  94  -9.385   0.977   2.003
  735   3HD1  LEU  94          HD13      LEU  94  -8.722   0.060   3.357
  736   1HD2  LEU  94          HD21      LEU  94  -8.087   3.765   2.615
  737   2HD2  LEU  94          HD23      LEU  94  -6.727   3.346   1.573
  738   3HD2  LEU  94          HD22      LEU  94  -8.363   2.855   1.130
  739    H    VAL  95           HN       VAL  95  -5.748  -1.123   2.950
  740    HA   VAL  95           HA       VAL  95  -2.979  -0.155   2.439
  741    HB   VAL  95           HB       VAL  95  -3.673  -3.060   2.966
  742   1HG1  VAL  95          HG12      VAL  95  -1.059  -1.591   2.506
  743   2HG1  VAL  95          HG11      VAL  95  -1.178  -3.277   3.011
  744   3HG1  VAL  95          HG13      VAL  95  -1.799  -2.783   1.436
  745   1HG2  VAL  95          HG21      VAL  95  -3.817  -1.704   5.029
  746   2HG2  VAL  95          HG23      VAL  95  -2.409  -2.764   5.069
  747   3HG2  VAL  95          HG22      VAL  95  -2.212  -1.048   4.709
  748    H    ILE  96           HN       ILE  96  -2.533  -0.153   0.282
  749    HA   ILE  96           HA       ILE  96  -4.519  -1.399  -1.543
  750    HB   ILE  96           HB       ILE  96  -2.237   0.481  -2.212
  751   1HG1  ILE  96          HG12      ILE  96  -3.809   1.541  -0.627
  752   2HG1  ILE  96          HG11      ILE  96  -3.948   2.263  -2.228
  753   1HG2  ILE  96          HG21      ILE  96  -3.229  -0.935  -4.052
  754   2HG2  ILE  96          HG23      ILE  96  -4.776  -0.144  -3.744
  755   3HG2  ILE  96          HG22      ILE  96  -3.396   0.802  -4.303
  756   1HD1  ILE  96          HD12      ILE  96  -5.912   0.811  -2.691
  757   2HD1  ILE  96          HD11      ILE  96  -5.789   0.150  -1.061
  758   3HD1  ILE  96          HD13      ILE  96  -6.181   1.853  -1.295
  759    H    ALA  97           HN       ALA  97  -4.027  -3.273  -2.564
  760    HA   ALA  97           HA       ALA  97  -1.169  -4.150  -2.585
  761   1HB   ALA  97           HB3      ALA  97  -3.780  -5.600  -2.359
  762   2HB   ALA  97           HB2      ALA  97  -2.427  -6.427  -3.132
  763   3HB   ALA  97           HB1      ALA  97  -2.278  -5.855  -1.470
  764    H    GLY  98           HN       GLY  98  -3.945  -3.429  -4.564
  765   1HA   GLY  98           HA2      GLY  98  -2.682  -2.930  -6.947
  766   2HA   GLY  98           HA1      GLY  98  -2.862  -4.684  -6.977
  767    H    GLY  99           HN       GLY  99  -5.943  -3.545  -8.609
  768   1HA   GLY  99           HA2      GLY  99  -3.216  -4.534  -9.014
  769   2HA   GLY  99           HA1      GLY  99  -4.392  -4.180 -10.279
  770    H    ALA 100           HN       ALA 100  -2.799  -3.005 -11.492
  771    HA   ALA 100           HA       ALA 100  -1.308  -0.797 -10.402
  772   1HB   ALA 100           HB3      ALA 100  -2.093  -1.513 -13.240
  773   2HB   ALA 100           HB2      ALA 100  -1.029  -0.164 -12.838
  774   3HB   ALA 100           HB1      ALA 100  -0.545  -1.815 -12.450
  775    H    GLN 101           HN       GLN 101  -4.394  -0.996 -12.177
  776    HA   GLN 101           HA       GLN 101  -4.847   1.830 -12.305
  777   1HB   GLN 101           HB2      GLN 101  -7.228   1.151 -12.701
  778   2HB   GLN 101           HB1      GLN 101  -6.082   0.321 -13.750
  779   1HG   GLN 101           HG2      GLN 101  -6.691  -0.991 -11.151
  780   2HG   GLN 101           HG1      GLN 101  -7.983  -0.989 -12.353
  781   1HE2  GLN 101          HE22      GLN 101  -6.364  -3.938 -13.538
  782   2HE2  GLN 101          HE21      GLN 101  -7.680  -3.350 -12.641
  783    H    ILE 102           HN       ILE 102  -5.216  -0.507  -9.760
  784    HA   ILE 102           HA       ILE 102  -7.094   1.072  -8.182
  785    HB   ILE 102           HB       ILE 102  -5.254  -1.156  -7.266
  786   1HG1  ILE 102          HG12      ILE 102  -6.645  -1.883  -9.175
  787   2HG1  ILE 102          HG11      ILE 102  -7.176  -2.655  -7.683
  788   1HG2  ILE 102          HG21      ILE 102  -7.794   0.056  -6.144
  789   2HG2  ILE 102          HG23      ILE 102  -7.092  -1.453  -5.561
  790   3HG2  ILE 102          HG22      ILE 102  -6.193   0.056  -5.404
  791   1HD1  ILE 102          HD13      ILE 102  -8.938  -0.876  -7.460
  792   2HD1  ILE 102          HD12      ILE 102  -8.460  -0.268  -9.045
  793   3HD1  ILE 102          HD11      ILE 102  -9.140  -1.887  -8.891
  794    H    PHE 103           HN       PHE 103  -3.583   0.682  -8.342
  795    HA   PHE 103           HA       PHE 103  -2.944   2.116  -5.946
  796   1HB   PHE 103           HB2      PHE 103  -1.426   1.600  -8.509
  797   2HB   PHE 103           HB1      PHE 103  -0.728   2.532  -7.184
  798    HD1  PHE 103           HD2      PHE 103  -1.464   1.274  -4.762
  799    HD2  PHE 103           HD1      PHE 103  -0.622  -0.583  -8.542
  800    HE1  PHE 103           HE2      PHE 103  -0.867  -0.831  -3.595
  801    HE2  PHE 103           HE1      PHE 103  -0.026  -2.688  -7.375
  802    HZ   PHE 103           HZ       PHE 103  -0.148  -2.812  -4.902
  803    H    THR 104           HN       THR 104  -3.102   3.205  -9.350
  804    HA   THR 104           HA       THR 104  -2.579   5.964  -8.786
  805    HB   THR 104           HB       THR 104  -4.301   5.004 -11.073
  806    HG1  THR 104           HG1      THR 104  -2.294   4.604 -12.135
  807   1HG2  THR 104          HG23      THR 104  -3.799   7.467 -10.631
  808   2HG2  THR 104          HG22      THR 104  -2.117   7.091 -11.004
  809   3HG2  THR 104          HG21      THR 104  -3.363   6.868 -12.231
  810    H    ALA 105           HN       ALA 105  -5.460   4.006  -8.558
  811    HA   ALA 105           HA       ALA 105  -7.390   6.142  -8.567
  812   1HB   ALA 105           HB3      ALA 105  -7.423   3.332  -7.449
  813   2HB   ALA 105           HB2      ALA 105  -8.808   4.416  -7.311
  814   3HB   ALA 105           HB1      ALA 105  -8.222   3.931  -8.903
  815    H    PHE 106           HN       PHE 106  -5.488   4.587  -6.008
  816    HA   PHE 106           HA       PHE 106  -6.653   6.486  -4.027
  817   1HB   PHE 106           HB2      PHE 106  -5.145   3.884  -3.774
  818   2HB   PHE 106           HB1      PHE 106  -5.319   4.978  -2.401
  819    HD1  PHE 106           HD2      PHE 106  -7.121   2.818  -4.795
  820    HD2  PHE 106           HD1      PHE 106  -7.468   5.344  -1.339
  821    HE1  PHE 106           HE2      PHE 106  -9.410   1.951  -4.392
  822    HE2  PHE 106           HE1      PHE 106  -9.757   4.478  -0.935
  823    HZ   PHE 106           HZ       PHE 106 -10.727   2.782  -2.462
  824    H    LYS 107           HN       LYS 107  -4.308   6.723  -6.172
  825    HA   LYS 107           HA       LYS 107  -1.964   7.323  -4.584
  826   1HB   LYS 107           HB2      LYS 107  -1.975   6.766  -7.056
  827   2HB   LYS 107           HB1      LYS 107  -2.622   8.382  -7.344
  828   1HG   LYS 107           HG2      LYS 107  -0.668   9.428  -6.446
  829   2HG   LYS 107           HG1      LYS 107  -0.075   7.903  -5.785
  830   1HD   LYS 107           HD2      LYS 107   0.424   7.036  -7.943
  831   2HD   LYS 107           HD1      LYS 107  -0.516   8.294  -8.748
  832   1HE   LYS 107           HE2      LYS 107   1.962   8.844  -7.095
  833   2HE   LYS 107           HE1      LYS 107   1.972   8.665  -8.849
  834   1HZ   LYS 107           HZ2      LYS 107   0.116  10.562  -7.573
  835   2HZ   LYS 107           HZ1      LYS 107   1.739  11.003  -7.818
  836   3HZ   LYS 107           HZ3      LYS 107   0.765  10.585  -9.143
  837    H    ASP 108           HN       ASP 108  -4.829   9.088  -5.474
  838    HA   ASP 108           HA       ASP 108  -3.825  11.753  -5.125
  839   1HB   ASP 108           HB2      ASP 108  -6.117  10.881  -6.089
  840   2HB   ASP 108           HB1      ASP 108  -6.648  11.018  -4.412
  841    H    ASP 109           HN       ASP 109  -5.306   9.428  -2.876
  842    HA   ASP 109           HA       ASP 109  -4.592  11.268  -0.630
  843   1HB   ASP 109           HB2      ASP 109  -6.695   9.115  -0.904
  844   2HB   ASP 109           HB1      ASP 109  -6.212   9.751   0.669
  845    H    VAL 110           HN       VAL 110  -2.636   9.586  -1.911
  846    HA   VAL 110           HA       VAL 110  -2.265   7.208  -0.250
  847    HB   VAL 110           HB       VAL 110  -1.484   7.258  -2.592
  848   1HG1  VAL 110          HG13      VAL 110  -0.864   9.750  -2.435
  849   2HG1  VAL 110          HG12      VAL 110   0.651   9.206  -1.716
  850   3HG1  VAL 110          HG11      VAL 110   0.227   8.715  -3.356
  851   1HG2  VAL 110          HG23      VAL 110  -0.249   6.041  -0.590
  852   2HG2  VAL 110          HG22      VAL 110   0.469   6.058  -2.200
  853   3HG2  VAL 110          HG21      VAL 110   1.039   7.186  -0.969
  854    H    ASP 111           HN       ASP 111  -0.554   6.940   1.302
  855    HA   ASP 111           HA       ASP 111   0.639   9.488   2.314
  856   1HB   ASP 111           HB2      ASP 111  -0.653   7.266   3.924
  857   2HB   ASP 111           HB1      ASP 111   0.315   8.560   4.631
  858    H    THR 112           HN       THR 112   0.816   6.017   3.177
  859    HA   THR 112           HA       THR 112   3.758   6.229   3.315
  860    HB   THR 112           HB       THR 112   2.158   3.704   3.724
  861    HG1  THR 112           HG1      THR 112   1.618   5.874   4.951
  862   1HG2  THR 112          HG21      THR 112   4.712   4.808   4.929
  863   2HG2  THR 112          HG23      THR 112   3.981   3.255   5.341
  864   3HG2  THR 112          HG22      THR 112   4.605   3.533   3.715
  865    H    LEU 113           HN       LEU 113   5.084   4.533   2.202
  866    HA   LEU 113           HA       LEU 113   3.841   3.434  -0.264
  867   1HB   LEU 113           HB2      LEU 113   6.130   5.389  -0.130
  868   2HB   LEU 113           HB1      LEU 113   5.998   4.250  -1.469
  869    HG   LEU 113           HG       LEU 113   3.657   5.965  -0.653
  870   1HD1  LEU 113          HD12      LEU 113   5.609   7.443  -1.110
  871   2HD1  LEU 113          HD11      LEU 113   5.799   6.668  -2.683
  872   3HD1  LEU 113          HD13      LEU 113   4.348   7.606  -2.332
  873   1HD2  LEU 113          HD23      LEU 113   4.514   4.504  -3.168
  874   2HD2  LEU 113          HD22      LEU 113   3.127   4.139  -2.141
  875   3HD2  LEU 113          HD21      LEU 113   3.142   5.611  -3.111
  876    H    LEU 114           HN       LEU 114   4.137   1.356   0.694
  877    HA   LEU 114           HA       LEU 114   6.871   0.533   1.456
  878   1HB   LEU 114           HB2      LEU 114   4.228  -0.958   1.425
  879   2HB   LEU 114           HB1      LEU 114   5.754  -1.651   1.979
  880    HG   LEU 114           HG       LEU 114   4.700   0.935   3.122
  881   1HD1  LEU 114          HD11      LEU 114   4.113  -1.896   4.038
  882   2HD1  LEU 114          HD13      LEU 114   3.784  -0.450   4.991
  883   3HD1  LEU 114          HD12      LEU 114   2.936  -0.715   3.468
  884   1HD2  LEU 114          HD23      LEU 114   6.706  -1.175   3.937
  885   2HD2  LEU 114          HD22      LEU 114   6.982   0.547   3.679
  886   3HD2  LEU 114          HD21      LEU 114   6.075   0.002   5.089
  887    H    VAL 115           HN       VAL 115   8.232  -0.128  -0.125
  888    HA   VAL 115           HA       VAL 115   7.076  -1.636  -2.434
  889    HB   VAL 115           HB       VAL 115   7.722   0.647  -3.125
  890   1HG1  VAL 115          HG11      VAL 115   9.478   0.921  -1.338
  891   2HG1  VAL 115          HG13      VAL 115  10.533  -0.120  -2.294
  892   3HG1  VAL 115          HG12      VAL 115  10.000   1.430  -2.944
  893   1HG2  VAL 115          HG23      VAL 115   8.009  -1.211  -4.725
  894   2HG2  VAL 115          HG22      VAL 115   9.260   0.011  -4.954
  895   3HG2  VAL 115          HG21      VAL 115   9.638  -1.491  -4.112
  896    H    THR 116           HN       THR 116   8.144  -3.518  -2.959
  897    HA   THR 116           HA       THR 116  10.521  -4.212  -1.285
  898    HB   THR 116           HB       THR 116   8.660  -6.094  -2.763
  899    HG1  THR 116           HG1      THR 116   7.367  -5.832  -1.154
  900   1HG2  THR 116          HG23      THR 116  10.755  -6.513  -0.614
  901   2HG2  THR 116          HG22      THR 116   9.677  -7.767  -1.228
  902   3HG2  THR 116          HG21      THR 116  10.869  -7.027  -2.297
  903    H    ARG 117           HN       ARG 117  12.275  -3.618  -2.525
  904    HA   ARG 117           HA       ARG 117  12.286  -4.130  -5.428
  905   1HB   ARG 117           HB2      ARG 117  14.428  -2.999  -3.599
  906   2HB   ARG 117           HB1      ARG 117  14.508  -3.046  -5.361
  907   1HG   ARG 117           HG2      ARG 117  12.088  -1.806  -4.135
  908   2HG   ARG 117           HG1      ARG 117  13.597  -0.896  -4.051
  909   1HD   ARG 117           HD2      ARG 117  12.566  -2.103  -6.626
  910   2HD   ARG 117           HD1      ARG 117  12.161  -0.464  -6.116
  911    HE   ARG 117           HE       ARG 117  14.769  -1.369  -7.102
  912   1HH1  ARG 117          HH11      ARG 117  12.999   1.004  -5.283
  913   2HH1  ARG 117          HH12      ARG 117  14.203   2.231  -5.486
  914   1HH2  ARG 117          HH21      ARG 117  16.326   0.231  -7.356
  915   2HH2  ARG 117          HH22      ARG 117  16.078   1.794  -6.653
  916    H    LEU 118           HN       LEU 118  13.269  -5.863  -6.377
  917    HA   LEU 118           HA       LEU 118  14.724  -7.758  -4.583
  918   1HB   LEU 118           HB2      LEU 118  12.860  -8.087  -6.867
  919   2HB   LEU 118           HB1      LEU 118  14.229  -9.199  -6.842
  920    HG   LEU 118           HG       LEU 118  13.662  -9.738  -4.453
  921   1HD1  LEU 118          HD11      LEU 118  11.213  -8.078  -5.126
  922   2HD1  LEU 118          HD13      LEU 118  11.360  -9.112  -3.704
  923   3HD1  LEU 118          HD12      LEU 118  12.420  -7.715  -3.892
  924   1HD2  LEU 118          HD22      LEU 118  12.794 -10.946  -6.615
  925   2HD2  LEU 118          HD21      LEU 118  12.067 -11.347  -5.058
  926   3HD2  LEU 118          HD23      LEU 118  11.238 -10.249  -6.163
  927    H    ALA 119           HN       ALA 119  16.836  -8.261  -5.044
  928    HA   ALA 119           HA       ALA 119  18.312  -6.619  -6.899
  929   1HB   ALA 119           HB2      ALA 119  19.287  -7.586  -4.814
  930   2HB   ALA 119           HB1      ALA 119  19.181  -9.189  -5.540
  931   3HB   ALA 119           HB3      ALA 119  20.242  -7.970  -6.246
  932    H    GLY 120           HN       GLY 120  17.049  -9.922  -7.010
  933   1HA   GLY 120           HA2      GLY 120  18.378 -10.681  -9.454
  934   2HA   GLY 120           HA1      GLY 120  16.957 -11.475  -8.772
  935    H    SER 121           HN       SER 121  17.867 -10.144 -11.525
  936    HA   SER 121           HA       SER 121  15.696  -8.259 -12.031
  937   1HB   SER 121           HB2      SER 121  16.494  -8.465 -14.418
  938   2HB   SER 121           HB1      SER 121  17.745  -7.979 -13.278
  939    HG   SER 121           HG       SER 121  18.531 -10.058 -13.285
  940    H    PHE 122           HN       PHE 122  13.776  -8.677 -13.146
  941    HA   PHE 122           HA       PHE 122  13.273 -11.410 -14.165
  942   1HB   PHE 122           HB2      PHE 122  11.614 -10.104 -11.986
  943   2HB   PHE 122           HB1      PHE 122  11.156 -11.570 -12.853
  944    HD1  PHE 122           HD1      PHE 122  12.691 -13.595 -12.739
  945    HD2  PHE 122           HD2      PHE 122  13.141 -10.182 -10.169
  946    HE1  PHE 122           HE1      PHE 122  14.069 -14.948 -11.183
  947    HE2  PHE 122           HE2      PHE 122  14.519 -11.535  -8.614
  948    HZ   PHE 122           HZ       PHE 122  14.984 -13.918  -9.120
  949    H    GLU 123           HN       GLU 123  12.546 -10.975 -16.187
  950    HA   GLU 123           HA       GLU 123  11.109  -8.471 -16.762
  951   1HB   GLU 123           HB2      GLU 123  12.017 -10.788 -18.491
  952   2HB   GLU 123           HB1      GLU 123  11.107  -9.415 -19.122
  953   1HG   GLU 123           HG2      GLU 123  12.852  -7.872 -18.381
  954   2HG   GLU 123           HG1      GLU 123  13.747  -9.202 -17.647
  955    H    GLY 124           HN       GLY 124   8.951  -8.395 -17.563
  956   1HA   GLY 124           HA2      GLY 124   7.360 -10.885 -17.564
  957   2HA   GLY 124           HA1      GLY 124   6.908  -9.671 -16.366
  958    H    ASP 125           HN       ASP 125   5.131  -8.615 -17.090
  959    HA   ASP 125           HA       ASP 125   5.204  -7.472 -19.837
  960   1HB   ASP 125           HB2      ASP 125   3.083  -9.269 -18.676
  961   2HB   ASP 125           HB1      ASP 125   2.661  -8.063 -19.893
  962    H    THR 126           HN       THR 126   3.887  -7.466 -16.570
  963    HA   THR 126           HA       THR 126   2.612  -4.827 -17.018
  964    HB   THR 126           HB       THR 126   2.724  -6.271 -14.376
  965    HG1  THR 126           HG1      THR 126   0.645  -6.713 -16.192
  966   1HG2  THR 126          HG22      THR 126   0.866  -4.329 -15.751
  967   2HG2  THR 126          HG21      THR 126   0.368  -5.243 -14.327
  968   3HG2  THR 126          HG23      THR 126   1.727  -4.124 -14.225
  969    H    LYS 127           HN       LYS 127   3.286  -2.949 -15.901
  970    HA   LYS 127           HA       LYS 127   5.912  -3.156 -14.484
  971   1HB   LYS 127           HB2      LYS 127   5.036  -1.060 -16.493
  972   2HB   LYS 127           HB1      LYS 127   6.499  -0.950 -15.514
  973   1HG   LYS 127           HG2      LYS 127   7.356  -3.016 -16.504
  974   2HG   LYS 127           HG1      LYS 127   5.869  -3.214 -17.431
  975   1HD   LYS 127           HD2      LYS 127   6.332  -1.346 -18.800
  976   2HD   LYS 127           HD1      LYS 127   7.536  -0.712 -17.677
  977   1HE   LYS 127           HE2      LYS 127   9.088  -2.461 -18.221
  978   2HE   LYS 127           HE1      LYS 127   7.862  -3.352 -19.123
  979   1HZ   LYS 127           HZ1      LYS 127   8.696  -0.612 -19.870
  980   2HZ   LYS 127           HZ3      LYS 127   9.483  -1.991 -20.468
  981   3HZ   LYS 127           HZ2      LYS 127   7.838  -1.741 -20.805
  982    H    MET 128           HN       MET 128   6.303  -0.995 -13.232
  983    HA   MET 128           HA       MET 128   3.806  -0.414 -11.728
  984   1HB   MET 128           HB2      MET 128   5.927  -1.163 -10.546
  985   2HB   MET 128           HB1      MET 128   6.638   0.383 -11.009
  986   1HG   MET 128           HG2      MET 128   5.743   0.654  -8.789
  987   2HG   MET 128           HG1      MET 128   4.669   1.516  -9.893
  988   1HE   MET 128           HE2      MET 128   2.590   1.647  -8.688
  989   2HE   MET 128           HE1      MET 128   1.880   0.396  -7.672
  990   3HE   MET 128           HE3      MET 128   3.446   1.102  -7.248
  991    H    ILE 129           HN       ILE 129   3.174   1.773 -11.311
  992    HA   ILE 129           HA       ILE 129   3.651   3.597 -13.514
  993    HB   ILE 129           HB       ILE 129   2.253   5.171 -12.149
  994   1HG1  ILE 129          HG12      ILE 129   2.066   2.868 -10.190
  995   2HG1  ILE 129          HG11      ILE 129   3.141   4.246  -9.945
  996   1HG2  ILE 129          HG22      ILE 129   1.414   3.152 -13.617
  997   2HG2  ILE 129          HG21      ILE 129   0.934   2.473 -12.061
  998   3HG2  ILE 129          HG23      ILE 129   0.272   4.020 -12.590
  999   1HD1  ILE 129          HD11      ILE 129   1.119   5.747 -10.207
 1000   2HD1  ILE 129          HD13      ILE 129   0.121   4.294 -10.172
 1001   3HD1  ILE 129          HD12      ILE 129   1.096   4.728  -8.768
 1002    HA   PRO 130           HA       PRO 130   6.992   6.009 -11.838
 1003   1HB   PRO 130           HB2      PRO 130   6.245   8.524 -12.821
 1004   2HB   PRO 130           HB1      PRO 130   7.157   7.292 -13.706
 1005   1HG   PRO 130           HG2      PRO 130   4.492   8.214 -14.197
 1006   2HG   PRO 130           HG1      PRO 130   5.416   7.002 -15.095
 1007   1HD   PRO 130           HD2      PRO 130   3.274   6.610 -13.144
 1008   2HD   PRO 130           HD1      PRO 130   3.976   5.451 -14.284
 1009    H    LEU 131           HN       LEU 131   6.688   6.068  -9.585
 1010    HA   LEU 131           HA       LEU 131   4.739   7.954  -8.424
 1011   1HB   LEU 131           HB2      LEU 131   6.708   6.010  -7.184
 1012   2HB   LEU 131           HB1      LEU 131   5.637   7.050  -6.245
 1013    HG   LEU 131           HG       LEU 131   4.600   5.183  -8.384
 1014   1HD1  LEU 131          HD11      LEU 131   5.897   4.045  -6.459
 1015   2HD1  LEU 131          HD13      LEU 131   4.580   4.596  -5.423
 1016   3HD1  LEU 131          HD12      LEU 131   4.248   3.496  -6.761
 1017   1HD2  LEU 131          HD23      LEU 131   3.354   6.613  -6.016
 1018   2HD2  LEU 131          HD22      LEU 131   3.084   6.973  -7.721
 1019   3HD2  LEU 131          HD21      LEU 131   2.503   5.455  -7.038
 1020    H    ASN 132           HN       ASN 132   5.285   9.903  -7.490
 1021    HA   ASN 132           HA       ASN 132   7.943  10.985  -8.074
 1022   1HB   ASN 132           HB2      ASN 132   5.647  12.222  -8.136
 1023   2HB   ASN 132           HB1      ASN 132   5.862  12.370  -6.391
 1024   1HD2  ASN 132          HD22      ASN 132   7.637  15.093  -8.582
 1025   2HD2  ASN 132          HD21      ASN 132   6.204  14.263  -8.958
 1026    H    TRP 133           HN       TRP 133   9.251   9.612  -6.699
 1027    HA   TRP 133           HA       TRP 133   8.827   9.436  -3.848
 1028   1HB   TRP 133           HB2      TRP 133  11.354   9.018  -5.472
 1029   2HB   TRP 133           HB1      TRP 133  11.123   8.521  -3.795
 1030    HD1  TRP 133           HD1      TRP 133  10.109   7.657  -7.356
 1031    HE1  TRP 133           HE1      TRP 133   8.951   5.353  -7.364
 1032    HE3  TRP 133           HE3      TRP 133   9.706   6.854  -2.329
 1033    HZ2  TRP 133           HZ2      TRP 133   7.982   3.425  -5.486
 1034    HZ3  TRP 133           HZ3      TRP 133   8.663   4.778  -1.467
 1035    HH2  TRP 133           HH2      TRP 133   7.801   3.064  -3.037
 1036    H    ASP 134           HN       ASP 134  10.109  11.891  -5.885
 1037    HA   ASP 134           HA       ASP 134  11.992  13.118  -4.119
 1038   1HB   ASP 134           HB2      ASP 134  11.493  13.631  -6.614
 1039   2HB   ASP 134           HB1      ASP 134  10.219  14.679  -5.993
 1040    H    ASP 135           HN       ASP 135   8.510  13.068  -4.159
 1041    HA   ASP 135           HA       ASP 135   8.271  15.348  -2.308
 1042   1HB   ASP 135           HB2      ASP 135   6.332  13.477  -3.652
 1043   2HB   ASP 135           HB1      ASP 135   5.805  14.474  -2.295
 1044    H    PHE 136           HN       PHE 136   8.330  11.842  -2.209
 1045    HA   PHE 136           HA       PHE 136   7.479  11.766   0.614
 1046   1HB   PHE 136           HB2      PHE 136   8.379   9.615  -1.324
 1047   2HB   PHE 136           HB1      PHE 136   7.926   9.295   0.350
 1048    HD1  PHE 136           HD2      PHE 136   6.707  10.407  -2.954
 1049    HD2  PHE 136           HD1      PHE 136   5.619   9.446   1.089
 1050    HE1  PHE 136           HE2      PHE 136   4.314  10.371  -3.606
 1051    HE2  PHE 136           HE1      PHE 136   3.227   9.411   0.437
 1052    HZ   PHE 136           HZ       PHE 136   2.574   9.872  -1.910
 1053    H    THR 137           HN       THR 137   8.945  10.453   2.139
 1054    HA   THR 137           HA       THR 137  11.835  10.912   1.580
 1055    HB   THR 137           HB       THR 137  10.635  11.606   4.262
 1056    HG1  THR 137           HG1      THR 137  10.563  13.735   3.547
 1057   1HG2  THR 137          HG22      THR 137  13.142  11.190   3.834
 1058   2HG2  THR 137          HG21      THR 137  13.107  12.702   2.925
 1059   3HG2  THR 137          HG23      THR 137  12.701  12.694   4.641
 1060    H    LYS 138           HN       LYS 138  13.093   9.231   2.286
 1061    HA   LYS 138           HA       LYS 138  11.836   6.819   3.251
 1062   1HB   LYS 138           HB2      LYS 138  14.006   7.063   1.864
 1063   2HB   LYS 138           HB1      LYS 138  14.796   7.388   3.407
 1064   1HG   LYS 138           HG2      LYS 138  13.772   5.233   4.266
 1065   2HG   LYS 138           HG1      LYS 138  13.285   4.890   2.606
 1066   1HD   LYS 138           HD2      LYS 138  16.145   5.550   3.316
 1067   2HD   LYS 138           HD1      LYS 138  15.530   3.899   3.384
 1068   1HE   LYS 138           HE2      LYS 138  15.409   5.690   0.940
 1069   2HE   LYS 138           HE1      LYS 138  16.593   4.408   1.193
 1070   1HZ   LYS 138           HZ2      LYS 138  13.647   4.045   1.092
 1071   2HZ   LYS 138           HZ1      LYS 138  14.737   3.643  -0.149
 1072   3HZ   LYS 138           HZ3      LYS 138  14.790   2.811   1.328
 1073    H    VAL 139           HN       VAL 139  12.015   5.856   5.326
 1074    HA   VAL 139           HA       VAL 139  13.151   7.542   7.502
 1075    HB   VAL 139           HB       VAL 139  11.103   7.078   8.874
 1076   1HG1  VAL 139          HG11      VAL 139  11.450   9.213   7.589
 1077   2HG1  VAL 139          HG13      VAL 139  10.506   8.516   6.272
 1078   3HG1  VAL 139          HG12      VAL 139   9.752   8.807   7.840
 1079   1HG2  VAL 139          HG22      VAL 139  10.038   6.102   6.203
 1080   2HG2  VAL 139          HG21      VAL 139  10.302   5.111   7.638
 1081   3HG2  VAL 139          HG23      VAL 139   9.060   6.363   7.648
 1082    H    SER 140           HN       SER 140  11.966   4.410   6.389
 1083    HA   SER 140           HA       SER 140  13.906   3.083   8.181
 1084   1HB   SER 140           HB2      SER 140  12.131   1.460   8.938
 1085   2HB   SER 140           HB1      SER 140  11.932   3.089   9.576
 1086    HG   SER 140           HG       SER 140  10.080   3.144   8.604
 1087    H    SER 141           HN       SER 141  14.281   0.833   7.528
 1088    HA   SER 141           HA       SER 141  13.032  -0.138   5.057
 1089   1HB   SER 141           HB2      SER 141  14.810   1.482   4.290
 1090   2HB   SER 141           HB1      SER 141  16.007   0.451   5.070
 1091    HG   SER 141           HG       SER 141  14.337  -1.011   3.544
 1092    H    ARG 142           HN       ARG 142  12.829  -2.292   5.377
 1093    HA   ARG 142           HA       ARG 142  14.633  -3.632   7.319
 1094   1HB   ARG 142           HB2      ARG 142  12.058  -3.817   7.368
 1095   2HB   ARG 142           HB1      ARG 142  12.235  -4.869   5.963
 1096   1HG   ARG 142           HG2      ARG 142  12.250  -6.352   7.811
 1097   2HG   ARG 142           HG1      ARG 142  13.950  -6.173   7.378
 1098   1HD   ARG 142           HD2      ARG 142  14.367  -4.687   9.181
 1099   2HD   ARG 142           HD1      ARG 142  12.647  -4.402   9.448
 1100    HE   ARG 142           HE       ARG 142  13.524  -7.185   9.833
 1101   1HH1  ARG 142          HH21      ARG 142  12.863  -4.077  11.240
 1102   2HH1  ARG 142          HH22      ARG 142  12.647  -4.713  12.836
 1103   1HH2  ARG 142          HH11      ARG 142  13.241  -7.998  11.908
 1104   2HH2  ARG 142          HH12      ARG 142  12.860  -6.923  13.211
 1105    H    THR 143           HN       THR 143  16.506  -4.138   6.199
 1106    HA   THR 143           HA       THR 143  16.399  -5.223   3.476
 1107    HB   THR 143           HB       THR 143  18.817  -5.238   5.282
 1108    HG1  THR 143           HG1      THR 143  18.453  -3.167   5.423
 1109   1HG2  THR 143          HG21      THR 143  18.608  -6.249   2.857
 1110   2HG2  THR 143          HG23      THR 143  18.750  -4.562   2.362
 1111   3HG2  THR 143          HG22      THR 143  20.036  -5.315   3.303
 1112    H    VAL 144           HN       VAL 144  16.868  -7.378   2.900
 1113    HA   VAL 144           HA       VAL 144  17.344  -9.353   5.047
 1114    HB   VAL 144           HB       VAL 144  14.884  -9.146   4.955
 1115   1HG1  VAL 144          HG13      VAL 144  14.864  -8.383   2.536
 1116   2HG1  VAL 144          HG12      VAL 144  15.094 -10.072   2.081
 1117   3HG1  VAL 144          HG11      VAL 144  13.639  -9.583   2.950
 1118   1HG2  VAL 144          HG21      VAL 144  16.063 -11.387   5.283
 1119   2HG2  VAL 144          HG23      VAL 144  14.390 -11.479   4.734
 1120   3HG2  VAL 144          HG22      VAL 144  15.709 -11.719   3.588
 1121    H    GLU 145           HN       GLU 145  18.695 -10.927   4.302
 1122    HA   GLU 145           HA       GLU 145  19.108 -11.100   1.345
 1123   1HB   GLU 145           HB2      GLU 145  20.977 -11.484   3.684
 1124   2HB   GLU 145           HB1      GLU 145  21.360 -12.125   2.086
 1125   1HG   GLU 145           HG2      GLU 145  22.363 -10.009   2.024
 1126   2HG   GLU 145           HG1      GLU 145  20.801  -9.706   1.262
 1127    H    ASP 146           HN       ASP 146  18.271 -12.924   0.479
 1128    HA   ASP 146           HA       ASP 146  17.566 -15.210   2.172
 1129   1HB   ASP 146           HB2      ASP 146  16.423 -14.210  -0.051
 1130   2HB   ASP 146           HB1      ASP 146  17.463 -15.423  -0.797
 1131    H    THR 147           HN       THR 147  18.117 -17.440   0.798
 1132    HA   THR 147           HA       THR 147  20.901 -17.905   1.272
 1133    HB   THR 147           HB       THR 147  20.466 -20.061   0.010
 1134    HG1  THR 147           HG1      THR 147  18.061 -20.275  -0.297
 1135   1HG2  THR 147          HG21      THR 147  20.030 -19.691   2.481
 1136   2HG2  THR 147          HG23      THR 147  18.340 -19.410   2.062
 1137   3HG2  THR 147          HG22      THR 147  19.079 -20.978   1.739
 1138    H    ASN 148           HN       ASN 148  19.066 -17.372  -1.738
 1139    HA   ASN 148           HA       ASN 148  21.563 -17.393  -3.314
 1140   1HB   ASN 148           HB2      ASN 148  18.989 -18.129  -3.914
 1141   2HB   ASN 148           HB1      ASN 148  19.056 -16.512  -4.616
 1142   1HD2  ASN 148          HD22      ASN 148  20.589 -17.936  -7.456
 1143   2HD2  ASN 148          HD21      ASN 148  19.307 -17.013  -6.838
 1144    HA   PRO 149           HA       PRO 149  22.039 -12.965  -3.280
 1145   1HB   PRO 149           HB2      PRO 149  23.313 -12.720  -5.771
 1146   2HB   PRO 149           HB1      PRO 149  24.101 -13.046  -4.222
 1147   1HG   PRO 149           HG2      PRO 149  23.829 -14.797  -6.463
 1148   2HG   PRO 149           HG1      PRO 149  24.612 -15.120  -4.909
 1149   1HD   PRO 149           HD2      PRO 149  21.994 -15.997  -5.869
 1150   2HD   PRO 149           HD1      PRO 149  22.933 -16.579  -4.485
 1151    H    ALA 150           HN       ALA 150  20.393 -14.543  -5.904
 1152    HA   ALA 150           HA       ALA 150  19.473 -12.038  -7.136
 1153   1HB   ALA 150           HB3      ALA 150  19.853 -14.058  -8.517
 1154   2HB   ALA 150           HB2      ALA 150  18.598 -14.905  -7.612
 1155   3HB   ALA 150           HB1      ALA 150  18.177 -13.518  -8.617
 1156    H    LEU 151           HN       LEU 151  18.412 -14.263  -4.685
 1157    HA   LEU 151           HA       LEU 151  15.633 -13.265  -4.743
 1158   1HB   LEU 151           HB2      LEU 151  17.103 -15.317  -3.084
 1159   2HB   LEU 151           HB1      LEU 151  15.475 -14.783  -2.663
 1160    HG   LEU 151           HG       LEU 151  16.077 -15.672  -5.472
 1161   1HD1  LEU 151          HD12      LEU 151  16.891 -17.447  -3.899
 1162   2HD1  LEU 151          HD11      LEU 151  15.274 -17.509  -3.196
 1163   3HD1  LEU 151          HD13      LEU 151  15.522 -17.965  -4.882
 1164   1HD2  LEU 151          HD21      LEU 151  13.621 -15.745  -3.686
 1165   2HD2  LEU 151          HD23      LEU 151  13.923 -14.589  -4.984
 1166   3HD2  LEU 151          HD22      LEU 151  13.673 -16.293  -5.362
 1167    H    THR 152           HN       THR 152  18.161 -11.638  -3.973
 1168    HA   THR 152           HA       THR 152  17.617 -10.951  -1.163
 1169    HB   THR 152           HB       THR 152  19.441  -9.508  -3.101
 1170    HG1  THR 152           HG1      THR 152  20.950 -10.977  -2.670
 1171   1HG2  THR 152          HG21      THR 152  19.105  -9.630  -0.115
 1172   2HG2  THR 152          HG23      THR 152  20.666  -9.207  -0.818
 1173   3HG2  THR 152          HG22      THR 152  19.247  -8.214  -1.157
 1174    H    HIS 153           HN       HIS 153  16.583  -9.067  -0.479
 1175    HA   HIS 153           HA       HIS 153  15.825  -6.985  -2.397
 1176   1HB   HIS 153           HB2      HIS 153  13.371  -7.258  -1.940
 1177   2HB   HIS 153           HB1      HIS 153  14.062  -8.589  -2.868
 1178    HD1  HIS 153           HD1      HIS 153  14.842 -10.724  -1.306
 1179    HD2  HIS 153           HD2      HIS 153  12.057  -8.096   0.344
 1180    HE1  HIS 153           HE1      HIS 153  13.751 -11.954   0.621
 1181    H    THR 154           HN       THR 154  14.484  -5.265  -1.231
 1182    HA   THR 154           HA       THR 154  14.949  -5.284   1.714
 1183    HB   THR 154           HB       THR 154  15.559  -2.897  -0.050
 1184    HG1  THR 154           HG1      THR 154  17.758  -3.486   0.461
 1185   1HG2  THR 154          HG22      THR 154  14.951  -2.819   2.523
 1186   2HG2  THR 154          HG21      THR 154  16.618  -3.364   2.712
 1187   3HG2  THR 154          HG23      THR 154  16.276  -1.843   1.887
 1188    H    TYR 155           HN       TYR 155  13.230  -4.451   2.841
 1189    HA   TYR 155           HA       TYR 155  10.877  -3.580   1.287
 1190   1HB   TYR 155           HB2      TYR 155  11.286  -4.139   4.239
 1191   2HB   TYR 155           HB1      TYR 155   9.747  -3.646   3.532
 1192    HD1  TYR 155           HD2      TYR 155   8.742  -5.084   1.676
 1193    HD2  TYR 155           HD1      TYR 155  11.996  -6.395   4.155
 1194    HE1  TYR 155           HE2      TYR 155   8.281  -7.436   1.038
 1195    HE2  TYR 155           HE1      TYR 155  11.534  -8.747   3.517
 1196    HH   TYR 155           HH       TYR 155   8.689  -9.623   1.661
 1197    H    GLU 156           HN       GLU 156  11.497  -1.479   0.601
 1198    HA   GLU 156           HA       GLU 156  12.506   0.523   2.435
 1199   1HB   GLU 156           HB2      GLU 156  11.309   0.655  -0.340
 1200   2HB   GLU 156           HB1      GLU 156  11.819   2.100   0.533
 1201   1HG   GLU 156           HG2      GLU 156  14.092   1.190   0.748
 1202   2HG   GLU 156           HG1      GLU 156  13.592  -0.282  -0.087
 1203    H    VAL 157           HN       VAL 157  11.357   2.198   3.456
 1204    HA   VAL 157           HA       VAL 157   8.378   2.080   3.282
 1205    HB   VAL 157           HB       VAL 157   9.950   2.372   5.858
 1206   1HG1  VAL 157          HG11      VAL 157   7.677   3.459   5.702
 1207   2HG1  VAL 157          HG13      VAL 157   6.999   1.860   5.396
 1208   3HG1  VAL 157          HG12      VAL 157   7.791   2.202   6.933
 1209   1HG2  VAL 157          HG23      VAL 157   8.744   0.001   4.462
 1210   2HG2  VAL 157          HG22      VAL 157  10.261   0.115   5.354
 1211   3HG2  VAL 157          HG21      VAL 157   8.728   0.060   6.224
 1212    H    TRP 158           HN       TRP 158   8.017   4.033   2.290
 1213    HA   TRP 158           HA       TRP 158   9.485   6.426   3.287
 1214   1HB   TRP 158           HB2      TRP 158   7.766   6.013   0.822
 1215   2HB   TRP 158           HB1      TRP 158   8.546   7.534   1.256
 1216    HD1  TRP 158           HD1      TRP 158   9.680   3.844   0.883
 1217    HE1  TRP 158           HE1      TRP 158  11.965   3.833  -0.312
 1218    HE3  TRP 158           HE3      TRP 158  10.389   8.866   0.289
 1219    HZ2  TRP 158           HZ2      TRP 158  13.845   5.707  -1.379
 1220    HZ3  TRP 158           HZ3      TRP 158  12.433   9.725  -0.819
 1221    HH2  TRP 158           HH2      TRP 158  14.161   8.153  -1.653
 1222    H    GLN 159           HN       GLN 159   8.087   8.462   3.421
 1223    HA   GLN 159           HA       GLN 159   5.275   7.920   4.195
 1224   1HB   GLN 159           HB2      GLN 159   7.432   8.983   6.015
 1225   2HB   GLN 159           HB1      GLN 159   5.739   9.401   6.277
 1226   1HG   GLN 159           HG2      GLN 159   5.227   6.914   6.220
 1227   2HG   GLN 159           HG1      GLN 159   6.969   6.635   6.259
 1228   1HE2  GLN 159          HE22      GLN 159   5.078   8.024   9.623
 1229   2HE2  GLN 159          HE21      GLN 159   4.280   8.078   8.125
 1230    H    LYS 160           HN       LYS 160   3.937   9.674   3.786
 1231    HA   LYS 160           HA       LYS 160   4.946  11.774   2.078
 1232   1HB   LYS 160           HB2      LYS 160   2.574  10.781   2.121
 1233   2HB   LYS 160           HB1      LYS 160   2.290  11.818   3.520
 1234   1HG   LYS 160           HG2      LYS 160   2.977  13.790   2.161
 1235   2HG   LYS 160           HG1      LYS 160   3.148  12.732   0.759
 1236   1HD   LYS 160           HD2      LYS 160   0.973  13.526   0.471
 1237   2HD   LYS 160           HD1      LYS 160   0.683  12.025   1.351
 1238   1HE   LYS 160           HE2      LYS 160   1.120  14.579   2.874
 1239   2HE   LYS 160           HE1      LYS 160  -0.464  14.236   2.177
 1240   1HZ   LYS 160           HZ1      LYS 160   0.230  11.893   3.352
 1241   2HZ   LYS 160           HZ3      LYS 160   0.833  13.044   4.442
 1242   3HZ   LYS 160           HZ2      LYS 160  -0.812  13.059   4.017
 1243    H    LYS 161           HN       LYS 161   6.269  13.311   2.942
 1244    HA   LYS 161           HA       LYS 161   5.238  14.956   5.161
 1245   1HB   LYS 161           HB2      LYS 161   6.681  12.992   6.075
 1246   2HB   LYS 161           HB1      LYS 161   8.044  13.885   5.401
 1247   1HG   LYS 161           HG2      LYS 161   7.232  15.910   6.681
 1248   2HG   LYS 161           HG1      LYS 161   6.075  14.851   7.488
 1249   1HD   LYS 161           HD2      LYS 161   7.918  13.447   8.317
 1250   2HD   LYS 161           HD1      LYS 161   9.085  14.480   7.492
 1251   1HE   LYS 161           HE2      LYS 161   8.613  16.328   8.906
 1252   2HE   LYS 161           HE1      LYS 161   7.130  15.591   9.508
 1253   1HZ   LYS 161           HZ3      LYS 161   8.726  13.746  10.311
 1254   2HZ   LYS 161           HZ2      LYS 161   9.924  14.940  10.161
 1255   3HZ   LYS 161           HZ1      LYS 161   8.606  15.182  11.205
 1256    H    ALA 162           HN       ALA 162   6.259  17.037   5.230
 1257    HA   ALA 162           HA       ALA 162   7.457  17.832   2.665
 1258   1HB   ALA 162           HB1      ALA 162   6.741  19.444   5.133
 1259   2HB   ALA 162           HB3      ALA 162   7.300  20.129   3.607
 1260   3HB   ALA 162           HB2      ALA 162   5.757  19.277   3.679
 1261   1H9   TMQ 170           H91      TMQ 170   0.181 -10.264  -6.446
 1262   2H9   TMQ 170           H92      TMQ 170  -0.764 -11.062  -5.180
 1263    HN1  TMQ 170           H1N      TMQ 170   1.352 -12.247  -6.777
 1264   1H17  TMQ 170           HM1      TMQ 170  -0.399  -7.366  -4.753
 1265   2H17  TMQ 170           HM2      TMQ 170  -1.072  -8.958  -5.102
 1266   3H17  TMQ 170           HM3      TMQ 170  -1.269  -8.256  -3.496
 1267   1H21  TMQ 170          HW11      TMQ 170   0.215 -13.054  -1.560
 1268   2H21  TMQ 170          HW12      TMQ 170  -0.852 -13.608  -0.261
 1269   3H21  TMQ 170          HW13      TMQ 170  -1.502 -12.621  -1.579
 1270   1H22  TMQ 170           HI1      TMQ 170   1.309 -17.490  -3.193
 1271   2H22  TMQ 170           HI2      TMQ 170   0.177 -18.303  -2.102
 1272   3H22  TMQ 170           HI3      TMQ 170   0.584 -16.599  -1.846
 1273   1H23  TMQ 170          HW21      TMQ 170   1.007 -16.493  -7.875
 1274   2H23  TMQ 170          HW22      TMQ 170   1.600 -18.085  -7.374
 1275   3H23  TMQ 170          HW23      TMQ 170   2.296 -16.619  -6.668
 1276   1HN2  TMQ 170          HN21      TMQ 170   4.070  -6.095   0.473
 1277   2HN2  TMQ 170          HN22      TMQ 170   5.089  -7.471   0.204
 1278   1HN5  TMQ 170          HN41      TMQ 170   0.203  -5.480  -1.762
 1279   2HN5  TMQ 170          HN42      TMQ 170  -0.427  -6.541  -2.945
 1280    HN   TMQ 170           H1       TMQ 170   4.481  -9.051  -1.329
 1281    H7   TMQ 170           H7       TMQ 170   2.584 -11.810  -4.588
 1282    H8   TMQ 170           H8       TMQ 170   4.057 -10.839  -2.884
 1283    H12  TMQ 170           HP2      TMQ 170  -0.304 -12.395  -3.546
 1284    H16  TMQ 170           HP6      TMQ 170   0.999 -14.622  -7.014
   
  No H/Q in entry =        1284
  Start of MODEL    4
    1   1H    THR   1           HT2      THR   1  -2.860   5.685   4.610
    2   2H    THR   1           HT1      THR   1  -3.936   6.574   3.641
    3   3H    THR   1           HT3      THR   1  -4.524   5.346   4.652
    4    HA   THR   1           HA       THR   1  -4.235   3.820   3.093
    5    HB   THR   1           HB       THR   1  -3.039   5.963   1.326
    6    HG1  THR   1           HG1      THR   1  -5.181   6.294   2.648
    7   1HG2  THR   1          HG21      THR   1  -4.595   3.417   0.938
    8   2HG2  THR   1          HG23      THR   1  -4.600   4.668  -0.304
    9   3HG2  THR   1          HG22      THR   1  -3.082   3.913   0.181
   10    H    ALA   2           HN       ALA   2  -2.716   2.244   3.058
   11    HA   ALA   2           HA       ALA   2   0.160   3.064   3.107
   12   1HB   ALA   2           HB3      ALA   2  -1.158   0.524   4.121
   13   2HB   ALA   2           HB2      ALA   2   0.572   0.866   4.183
   14   3HB   ALA   2           HB1      ALA   2  -0.555   1.847   5.121
   15    H    PHE   3           HN       PHE   3   0.788   2.985   0.974
   16    HA   PHE   3           HA       PHE   3  -0.224   1.023  -0.905
   17   1HB   PHE   3           HB2      PHE   3   1.950   3.099  -0.952
   18   2HB   PHE   3           HB1      PHE   3   1.860   1.896  -2.237
   19    HD1  PHE   3           HD2      PHE   3  -0.690   3.856  -0.288
   20    HD2  PHE   3           HD1      PHE   3   0.836   2.735  -4.144
   21    HE1  PHE   3           HE2      PHE   3  -2.502   5.148  -1.381
   22    HE2  PHE   3           HE1      PHE   3  -0.976   4.028  -5.236
   23    HZ   PHE   3           HZ       PHE   3  -2.644   5.235  -3.856
   24    H    LEU   4           HN       LEU   4   0.726  -0.903  -1.557
   25    HA   LEU   4           HA       LEU   4   3.416  -1.636  -0.611
   26   1HB   LEU   4           HB2      LEU   4   1.892  -2.199   1.298
   27   2HB   LEU   4           HB1      LEU   4   0.999  -3.271   0.220
   28    HG   LEU   4           HG       LEU   4   3.352  -4.321  -0.259
   29   1HD1  LEU   4          HD11      LEU   4   3.771  -2.707   2.250
   30   2HD1  LEU   4          HD13      LEU   4   4.666  -4.204   1.989
   31   3HD1  LEU   4          HD12      LEU   4   4.831  -2.868   0.849
   32   1HD2  LEU   4          HD21      LEU   4   1.930  -4.698   2.398
   33   2HD2  LEU   4          HD23      LEU   4   1.494  -5.480   0.878
   34   3HD2  LEU   4          HD22      LEU   4   3.031  -5.859   1.656
   35    H    TRP   5           HN       TRP   5   4.246  -2.367  -2.514
   36    HA   TRP   5           HA       TRP   5   2.752  -4.488  -3.954
   37   1HB   TRP   5           HB2      TRP   5   3.148  -3.413  -6.130
   38   2HB   TRP   5           HB1      TRP   5   2.187  -2.364  -5.093
   39    HD1  TRP   5           HD1      TRP   5   5.218  -2.383  -7.171
   40    HE1  TRP   5           HE1      TRP   5   6.626  -0.262  -6.771
   41    HE3  TRP   5           HE3      TRP   5   2.966  -0.606  -2.940
   42    HZ2  TRP   5           HZ2      TRP   5   6.780   1.899  -4.908
   43    HZ3  TRP   5           HZ3      TRP   5   3.769   1.482  -1.877
   44    HH2  TRP   5           HH2      TRP   5   5.668   2.737  -2.855
   45    H    ALA   6           HN       ALA   6   4.101  -6.024  -4.896
   46    HA   ALA   6           HA       ALA   6   6.960  -5.845  -4.155
   47   1HB   ALA   6           HB3      ALA   6   5.495  -7.918  -3.771
   48   2HB   ALA   6           HB2      ALA   6   5.577  -8.165  -5.516
   49   3HB   ALA   6           HB1      ALA   6   7.052  -8.195  -4.551
   50    H    GLN   7           HN       GLN   7   8.214  -4.796  -5.630
   51    HA   GLN   7           HA       GLN   7   7.848  -5.510  -8.510
   52   1HB   GLN   7           HB2      GLN   7   8.519  -3.151  -9.053
   53   2HB   GLN   7           HB1      GLN   7   6.969  -3.263  -8.219
   54   1HG   GLN   7           HG2      GLN   7   7.877  -2.519  -6.173
   55   2HG   GLN   7           HG1      GLN   7   9.530  -2.867  -6.680
   56   1HE2  GLN   7          HE22      GLN   7   9.972   0.437  -7.781
   57   2HE2  GLN   7          HE21      GLN   7  10.637  -0.948  -7.059
   58    H    ASP   8           HN       ASP   8   9.804  -5.560  -9.737
   59    HA   ASP   8           HA       ASP   8  12.236  -5.911  -8.060
   60   1HB   ASP   8           HB2      ASP   8  13.159  -6.981 -10.162
   61   2HB   ASP   8           HB1      ASP   8  11.768  -7.813  -9.466
   62    H    ARG   9           HN       ARG   9  14.331  -5.184  -9.197
   63    HA   ARG   9           HA       ARG   9  14.267  -2.362  -9.598
   64   1HB   ARG   9           HB2      ARG   9  16.620  -2.660 -10.410
   65   2HB   ARG   9           HB1      ARG   9  16.307  -3.468  -8.874
   66   1HG   ARG   9           HG2      ARG   9  15.977  -5.605 -10.042
   67   2HG   ARG   9           HG1      ARG   9  16.238  -4.808 -11.594
   68   1HD   ARG   9           HD2      ARG   9  18.300  -4.708  -9.389
   69   2HD   ARG   9           HD1      ARG   9  18.259  -6.022 -10.566
   70    HE   ARG   9           HE       ARG   9  18.227  -3.411 -11.843
   71   1HH1  ARG   9          HH21      ARG   9  20.231  -5.839 -10.374
   72   2HH1  ARG   9          HH22      ARG   9  21.648  -5.369 -11.250
   73   1HH2  ARG   9          HH11      ARG   9  20.074  -2.810 -12.974
   74   2HH2  ARG   9          HH12      ARG   9  21.559  -3.662 -12.714
   75    H    ASP  10           HN       ASP  10  13.587  -4.950 -11.762
   76    HA   ASP  10           HA       ASP  10  14.248  -3.520 -14.217
   77   1HB   ASP  10           HB2      ASP  10  12.719  -6.045 -13.588
   78   2HB   ASP  10           HB1      ASP  10  12.761  -5.384 -15.222
   79    H    GLY  11           HN       GLY  11  12.195  -2.529 -12.049
   80   1HA   GLY  11           HA2      GLY  11  10.255  -1.212 -12.098
   81   2HA   GLY  11           HA1      GLY  11  10.520  -1.058 -13.836
   82    H    LEU  12           HN       LEU  12  10.071  -4.132 -12.165
   83    HA   LEU  12           HA       LEU  12   7.546  -4.502 -13.723
   84   1HB   LEU  12           HB2      LEU  12   9.692  -6.056 -13.924
   85   2HB   LEU  12           HB1      LEU  12   9.013  -6.794 -12.473
   86    HG   LEU  12           HG       LEU  12   6.786  -6.858 -13.789
   87   1HD1  LEU  12          HD11      LEU  12   7.713  -5.336 -15.599
   88   2HD1  LEU  12          HD13      LEU  12   8.704  -6.697 -16.126
   89   3HD1  LEU  12          HD12      LEU  12   6.945  -6.811 -16.187
   90   1HD2  LEU  12          HD21      LEU  12   8.535  -8.754 -13.285
   91   2HD2  LEU  12          HD23      LEU  12   7.266  -9.044 -14.475
   92   3HD2  LEU  12          HD22      LEU  12   8.895  -8.623 -15.006
   93    H    ILE  13           HN       ILE  13   5.887  -5.883 -12.605
   94    HA   ILE  13           HA       ILE  13   6.015  -5.707  -9.633
   95    HB   ILE  13           HB       ILE  13   3.632  -4.916  -9.635
   96   1HG1  ILE  13          HG12      ILE  13   4.159  -4.384 -12.575
   97   2HG1  ILE  13          HG11      ILE  13   3.164  -5.711 -11.978
   98   1HG2  ILE  13          HG21      ILE  13   5.820  -3.252 -10.885
   99   2HG2  ILE  13          HG23      ILE  13   4.239  -2.565 -10.514
  100   3HG2  ILE  13          HG22      ILE  13   5.238  -3.226  -9.220
  101   1HD1  ILE  13          HD11      ILE  13   1.812  -3.943 -10.717
  102   2HD1  ILE  13          HD13      ILE  13   2.665  -2.743 -11.689
  103   3HD1  ILE  13          HD12      ILE  13   1.638  -3.945 -12.472
  104    H    GLY  14           HN       GLY  14   4.659  -7.149 -12.538
  105   1HA   GLY  14           HA2      GLY  14   4.357  -9.717 -11.238
  106   2HA   GLY  14           HA1      GLY  14   2.791  -8.952 -11.513
  107    H    LYS  15           HN       LYS  15   2.842 -11.124 -12.885
  108    HA   LYS  15           HA       LYS  15   3.043 -10.293 -15.675
  109   1HB   LYS  15           HB2      LYS  15   5.403 -11.005 -15.049
  110   2HB   LYS  15           HB1      LYS  15   4.760 -12.629 -14.802
  111   1HG   LYS  15           HG2      LYS  15   3.813 -12.468 -17.169
  112   2HG   LYS  15           HG1      LYS  15   4.818 -11.031 -17.367
  113   1HD   LYS  15           HD2      LYS  15   6.145 -12.824 -18.193
  114   2HD   LYS  15           HD1      LYS  15   6.779 -12.492 -16.579
  115   1HE   LYS  15           HE2      LYS  15   5.733 -14.388 -15.646
  116   2HE   LYS  15           HE1      LYS  15   4.607 -14.542 -16.995
  117   1HZ   LYS  15           HZ1      LYS  15   6.916 -14.777 -18.272
  118   2HZ   LYS  15           HZ3      LYS  15   7.369 -15.422 -16.770
  119   3HZ   LYS  15           HZ2      LYS  15   6.075 -16.107 -17.632
  120    H    ASP  16           HN       ASP  16   1.312 -11.219 -16.643
  121    HA   ASP  16           HA       ASP  16  -0.447 -12.705 -17.085
  122   1HB   ASP  16           HB2      ASP  16   1.818 -14.437 -16.234
  123   2HB   ASP  16           HB1      ASP  16   0.216 -15.176 -16.217
  124    H    GLY  17           HN       GLY  17  -0.279 -11.280 -14.483
  125   1HA   GLY  17           HA2      GLY  17  -1.988 -11.218 -12.786
  126   2HA   GLY  17           HA1      GLY  17  -2.272 -12.940 -13.044
  127    H    HIS  18           HN       HIS  18  -0.160 -14.294 -12.550
  128    HA   HIS  18           HA       HIS  18   0.483 -13.806  -9.755
  129   1HB   HIS  18           HB2      HIS  18   1.919 -15.847 -10.021
  130   2HB   HIS  18           HB1      HIS  18   0.249 -16.099 -10.527
  131    HD1  HIS  18           HD1      HIS  18   3.720 -15.611 -11.927
  132    HD2  HIS  18           HD2      HIS  18  -0.092 -16.615 -13.280
  133    HE1  HIS  18           HE1      HIS  18   3.991 -16.382 -14.324
  134    H    LEU  19           HN       LEU  19   3.017 -14.203  -9.246
  135    HA   LEU  19           HA       LEU  19   4.382 -11.911 -10.503
  136   1HB   LEU  19           HB2      LEU  19   5.022 -13.686  -8.138
  137   2HB   LEU  19           HB1      LEU  19   6.155 -12.477  -8.744
  138    HG   LEU  19           HG       LEU  19   3.299 -11.783  -8.041
  139   1HD1  LEU  19          HD11      LEU  19   5.718 -12.074  -6.286
  140   2HD1  LEU  19          HD13      LEU  19   4.549 -10.800  -5.938
  141   3HD1  LEU  19          HD12      LEU  19   4.038 -12.487  -5.945
  142   1HD2  LEU  19          HD22      LEU  19   5.823 -10.322  -8.732
  143   2HD2  LEU  19          HD21      LEU  19   4.169 -10.005  -9.256
  144   3HD2  LEU  19          HD23      LEU  19   4.682  -9.550  -7.631
  145    HA   PRO  20           HA       PRO  20   7.020 -14.416 -13.076
  146   1HB   PRO  20           HB2      PRO  20   9.179 -12.652 -13.225
  147   2HB   PRO  20           HB1      PRO  20   7.734 -12.601 -14.244
  148   1HG   PRO  20           HG2      PRO  20   8.557 -10.737 -12.220
  149   2HG   PRO  20           HG1      PRO  20   7.155 -10.651 -13.295
  150   1HD   PRO  20           HD2      PRO  20   7.255 -11.391 -10.477
  151   2HD   PRO  20           HD1      PRO  20   5.848 -11.031 -11.490
  152    H    TRP  21           HN       TRP  21   8.237 -13.164 -10.037
  153    HA   TRP  21           HA       TRP  21  10.408 -15.218 -10.061
  154   1HB   TRP  21           HB2      TRP  21  11.352 -13.889  -8.152
  155   2HB   TRP  21           HB1      TRP  21  11.248 -12.974  -9.655
  156    HD1  TRP  21           HD1      TRP  21   9.491 -13.375  -6.269
  157    HE1  TRP  21           HE1      TRP  21   8.119 -11.243  -5.799
  158    HE3  TRP  21           HE3      TRP  21  10.109 -10.930 -10.710
  159    HZ2  TRP  21           HZ2      TRP  21   7.382  -8.821  -7.131
  160    HZ3  TRP  21           HZ3      TRP  21   9.062  -8.715 -11.081
  161    HH2  TRP  21           HH2      TRP  21   7.700  -7.659  -9.300
  162    H    HIS  22           HN       HIS  22  10.826 -16.128  -7.766
  163    HA   HIS  22           HA       HIS  22   8.203 -16.669  -6.427
  164   1HB   HIS  22           HB2      HIS  22   9.244 -18.589  -7.782
  165   2HB   HIS  22           HB1      HIS  22  10.507 -18.623  -6.550
  166    HD1  HIS  22           HD1      HIS  22   6.681 -18.520  -6.530
  167    HD2  HIS  22           HD2      HIS  22   9.837 -20.380  -4.542
  168    HE1  HIS  22           HE1      HIS  22   5.636 -20.063  -4.815
  169    H    LEU  23           HN       LEU  23   8.419 -15.302  -4.666
  170    HA   LEU  23           HA       LEU  23  10.830 -15.731  -2.943
  171   1HB   LEU  23           HB2      LEU  23  10.498 -13.415  -4.061
  172   2HB   LEU  23           HB1      LEU  23   9.169 -13.211  -2.920
  173    HG   LEU  23           HG       LEU  23  10.756 -13.714  -1.052
  174   1HD1  LEU  23          HD13      LEU  23  12.675 -13.832  -3.377
  175   2HD1  LEU  23          HD12      LEU  23  13.235 -13.420  -1.756
  176   3HD1  LEU  23          HD11      LEU  23  12.476 -14.984  -2.056
  177   1HD2  LEU  23          HD23      LEU  23  10.321 -11.356  -2.314
  178   2HD2  LEU  23          HD22      LEU  23  11.369 -11.507  -0.903
  179   3HD2  LEU  23          HD21      LEU  23  12.068 -11.485  -2.521
  180    HA   PRO  24           HA       PRO  24   7.141 -17.609  -0.766
  181   1HB   PRO  24           HB2      PRO  24   9.218 -18.642   1.006
  182   2HB   PRO  24           HB1      PRO  24   8.056 -19.528   0.010
  183   1HG   PRO  24           HG2      PRO  24  10.838 -19.100  -0.482
  184   2HG   PRO  24           HG1      PRO  24   9.675 -19.994  -1.470
  185   1HD   PRO  24           HD2      PRO  24  10.900 -17.557  -2.142
  186   2HD   PRO  24           HD1      PRO  24   9.525 -18.305  -2.968
  187    H    ASP  25           HN       ASP  25  10.007 -15.973   0.564
  188    HA   ASP  25           HA       ASP  25   8.916 -15.369   3.136
  189   1HB   ASP  25           HB2      ASP  25  11.357 -15.088   2.145
  190   2HB   ASP  25           HB1      ASP  25  10.786 -13.460   1.777
  191    H    ASP  26           HN       ASP  26   9.039 -13.410   0.145
  192    HA   ASP  26           HA       ASP  26   7.572 -11.188   1.191
  193   1HB   ASP  26           HB2      ASP  26   8.908 -11.141  -0.921
  194   2HB   ASP  26           HB1      ASP  26   7.683 -12.156  -1.682
  195    H    LEU  27           HN       LEU  27   6.574 -14.282  -0.130
  196    HA   LEU  27           HA       LEU  27   3.793 -13.562  -0.523
  197   1HB   LEU  27           HB2      LEU  27   5.068 -16.288  -0.130
  198   2HB   LEU  27           HB1      LEU  27   3.436 -15.993  -0.734
  199    HG   LEU  27           HG       LEU  27   5.959 -14.950  -2.054
  200   1HD1  LEU  27          HD11      LEU  27   4.352 -17.459  -2.413
  201   2HD1  LEU  27          HD13      LEU  27   5.089 -16.705  -3.827
  202   3HD1  LEU  27          HD12      LEU  27   6.101 -17.234  -2.483
  203   1HD2  LEU  27          HD23      LEU  27   3.031 -14.670  -2.523
  204   2HD2  LEU  27          HD22      LEU  27   4.341 -13.546  -2.888
  205   3HD2  LEU  27          HD21      LEU  27   4.034 -14.920  -3.951
  206    H    HIS  28           HN       HIS  28   5.716 -14.527   2.206
  207    HA   HIS  28           HA       HIS  28   3.363 -15.244   3.837
  208   1HB   HIS  28           HB2      HIS  28   6.339 -15.155   4.344
  209   2HB   HIS  28           HB1      HIS  28   5.189 -15.379   5.662
  210    HD1  HIS  28           HD1      HIS  28   3.204 -17.316   4.748
  211    HD2  HIS  28           HD2      HIS  28   7.175 -17.645   3.519
  212    HE1  HIS  28           HE1      HIS  28   3.534 -19.720   4.023
  213    H    TYR  29           HN       TYR  29   5.456 -12.511   3.248
  214    HA   TYR  29           HA       TYR  29   4.802 -11.035   5.646
  215   1HB   TYR  29           HB2      TYR  29   6.765 -10.625   4.042
  216   2HB   TYR  29           HB1      TYR  29   5.597  -9.821   2.994
  217    HD1  TYR  29           HD1      TYR  29   6.317  -9.904   6.683
  218    HD2  TYR  29           HD2      TYR  29   5.581  -7.506   3.197
  219    HE1  TYR  29           HE1      TYR  29   6.497  -7.848   8.059
  220    HE2  TYR  29           HE2      TYR  29   5.761  -5.450   4.571
  221    HH   TYR  29           HH       TYR  29   6.226  -4.617   6.578
  222    H    PHE  30           HN       PHE  30   3.230 -11.518   2.568
  223    HA   PHE  30           HA       PHE  30   1.515  -9.228   2.571
  224   1HB   PHE  30           HB2      PHE  30   1.867 -10.807   0.636
  225   2HB   PHE  30           HB1      PHE  30   0.863 -11.983   1.485
  226    HD1  PHE  30           HD2      PHE  30   0.821  -8.401   0.371
  227    HD2  PHE  30           HD1      PHE  30  -1.449 -11.964   1.148
  228    HE1  PHE  30           HE2      PHE  30  -1.219  -7.290  -0.497
  229    HE2  PHE  30           HE1      PHE  30  -3.489 -10.853   0.280
  230    HZ   PHE  30           HZ       PHE  30  -3.374  -8.516  -0.543
  231    H    ARG  31           HN       ARG  31   1.030 -12.530   3.847
  232    HA   ARG  31           HA       ARG  31  -1.608 -12.080   4.861
  233   1HB   ARG  31           HB2      ARG  31  -0.419 -14.321   4.564
  234   2HB   ARG  31           HB1      ARG  31   0.434 -13.960   6.066
  235   1HG   ARG  31           HG2      ARG  31  -1.546 -14.001   7.344
  236   2HG   ARG  31           HG1      ARG  31  -2.573 -13.808   5.924
  237   1HD   ARG  31           HD2      ARG  31  -2.037 -16.050   5.162
  238   2HD   ARG  31           HD1      ARG  31  -0.854 -16.248   6.456
  239    HE   ARG  31           HE       ARG  31  -3.762 -16.469   6.730
  240   1HH1  ARG  31          HH11      ARG  31  -0.721 -15.895   8.309
  241   2HH1  ARG  31          HH12      ARG  31  -1.305 -16.371   9.868
  242   1HH2  ARG  31          HH21      ARG  31  -4.508 -17.085   8.759
  243   2HH2  ARG  31          HH22      ARG  31  -3.439 -17.040  10.121
  244    H    ALA  32           HN       ALA  32   1.584 -11.358   6.128
  245    HA   ALA  32           HA       ALA  32   0.666 -10.793   8.835
  246   1HB   ALA  32           HB2      ALA  32   3.222  -9.990   7.411
  247   2HB   ALA  32           HB1      ALA  32   2.932  -9.848   9.144
  248   3HB   ALA  32           HB3      ALA  32   3.004 -11.440   8.388
  249    H    GLN  33           HN       GLN  33   1.074  -8.975   5.859
  250    HA   GLN  33           HA       GLN  33   0.437  -6.437   7.275
  251   1HB   GLN  33           HB2      GLN  33   1.348  -7.024   4.443
  252   2HB   GLN  33           HB1      GLN  33   0.912  -5.413   5.015
  253   1HG   GLN  33           HG2      GLN  33   2.985  -7.115   6.411
  254   2HG   GLN  33           HG1      GLN  33   3.401  -5.999   5.110
  255   1HE2  GLN  33          HE22      GLN  33   2.556  -3.070   7.079
  256   2HE2  GLN  33          HE21      GLN  33   2.465  -3.659   5.490
  257    H    THR  34           HN       THR  34  -1.572  -8.538   6.959
  258    HA   THR  34           HA       THR  34  -3.597  -6.938   5.483
  259    HB   THR  34           HB       THR  34  -4.516  -9.121   4.549
  260    HG1  THR  34           HG1      THR  34  -1.983  -9.953   5.490
  261   1HG2  THR  34          HG22      THR  34  -1.819  -8.056   3.693
  262   2HG2  THR  34          HG21      THR  34  -2.728  -9.230   2.743
  263   3HG2  THR  34          HG23      THR  34  -3.402  -7.628   3.045
  264    H    VAL  35           HN       VAL  35  -2.807  -9.446   7.827
  265    HA   VAL  35           HA       VAL  35  -5.508  -9.866   8.763
  266    HB   VAL  35           HB       VAL  35  -4.371 -10.882  10.755
  267   1HG1  VAL  35          HG11      VAL  35  -3.462 -11.619   7.966
  268   2HG1  VAL  35          HG13      VAL  35  -3.086 -12.611   9.375
  269   3HG1  VAL  35          HG12      VAL  35  -4.765 -12.343   8.908
  270   1HG2  VAL  35          HG21      VAL  35  -1.926  -9.822   9.313
  271   2HG2  VAL  35          HG23      VAL  35  -2.437  -9.460  10.961
  272   3HG2  VAL  35          HG22      VAL  35  -1.848 -11.072  10.555
  273    H    GLY  36           HN       GLY  36  -6.704  -8.532  10.024
  274   1HA   GLY  36           HA2      GLY  36  -7.186  -6.972  11.742
  275   2HA   GLY  36           HA1      GLY  36  -5.456  -6.834  12.061
  276    H    LYS  37           HN       LYS  37  -6.944  -6.425   8.887
  277    HA   LYS  37           HA       LYS  37  -6.805  -3.493   9.041
  278   1HB   LYS  37           HB2      LYS  37  -4.837  -5.151   7.472
  279   2HB   LYS  37           HB1      LYS  37  -5.282  -3.532   6.928
  280   1HG   LYS  37           HG2      LYS  37  -4.773  -2.855   9.412
  281   2HG   LYS  37           HG1      LYS  37  -3.842  -4.353   9.433
  282   1HD   LYS  37           HD2      LYS  37  -2.477  -3.615   7.584
  283   2HD   LYS  37           HD1      LYS  37  -3.502  -2.203   7.327
  284   1HE   LYS  37           HE2      LYS  37  -2.756  -1.149   9.298
  285   2HE   LYS  37           HE1      LYS  37  -2.138  -2.655   9.976
  286   1HZ   LYS  37           HZ2      LYS  37  -1.037  -1.272   7.589
  287   2HZ   LYS  37           HZ1      LYS  37  -0.360  -1.228   9.147
  288   3HZ   LYS  37           HZ3      LYS  37  -0.425  -2.692   8.293
  289    H    ILE  38           HN       ILE  38  -7.394  -2.572   6.782
  290    HA   ILE  38           HA       ILE  38  -9.630  -4.210   5.727
  291    HB   ILE  38           HB       ILE  38  -8.904  -1.330   5.108
  292   1HG1  ILE  38          HG12      ILE  38 -10.988  -2.373   7.049
  293   2HG1  ILE  38          HG11      ILE  38  -9.393  -1.806   7.546
  294   1HG2  ILE  38          HG23      ILE  38 -10.386  -2.562   3.483
  295   2HG2  ILE  38          HG22      ILE  38 -11.527  -2.821   4.802
  296   3HG2  ILE  38          HG21      ILE  38 -11.168  -1.182   4.256
  297   1HD1  ILE  38          HD13      ILE  38 -10.009   0.334   6.171
  298   2HD1  ILE  38          HD12      ILE  38 -11.666  -0.238   6.353
  299   3HD1  ILE  38          HD11      ILE  38 -10.698   0.125   7.781
  300    H    MET  39           HN       MET  39  -8.697  -5.665   4.290
  301    HA   MET  39           HA       MET  39  -6.584  -4.961   2.450
  302   1HB   MET  39           HB2      MET  39  -7.272  -7.310   3.281
  303   2HB   MET  39           HB1      MET  39  -8.532  -7.234   2.049
  304   1HG   MET  39           HG2      MET  39  -5.716  -6.565   1.272
  305   2HG   MET  39           HG1      MET  39  -6.162  -8.260   1.472
  306   1HE   MET  39           HE3      MET  39  -7.551  -9.478   0.494
  307   2HE   MET  39           HE2      MET  39  -9.096  -8.843  -0.063
  308   3HE   MET  39           HE1      MET  39  -7.908  -9.405  -1.236
  309    H    VAL  40           HN       VAL  40  -6.741  -4.042   0.451
  310    HA   VAL  40           HA       VAL  40  -9.413  -3.940  -0.870
  311    HB   VAL  40           HB       VAL  40  -7.550  -1.559  -0.612
  312   1HG1  VAL  40          HG12      VAL  40  -8.972  -1.659  -2.659
  313   2HG1  VAL  40          HG11      VAL  40 -10.399  -1.787  -1.631
  314   3HG1  VAL  40          HG13      VAL  40  -9.415  -0.323  -1.597
  315   1HG2  VAL  40          HG21      VAL  40 -10.172  -2.159   0.796
  316   2HG2  VAL  40          HG23      VAL  40  -8.583  -2.133   1.557
  317   3HG2  VAL  40          HG22      VAL  40  -9.274  -0.646   0.909
  318    H    VAL  41           HN       VAL  41  -9.155  -4.807  -2.859
  319    HA   VAL  41           HA       VAL  41  -6.647  -4.198  -4.361
  320    HB   VAL  41           HB       VAL  41  -6.715  -6.544  -5.248
  321   1HG1  VAL  41          HG13      VAL  41  -6.239  -5.852  -2.379
  322   2HG1  VAL  41          HG12      VAL  41  -6.165  -7.552  -2.840
  323   3HG1  VAL  41          HG11      VAL  41  -5.092  -6.383  -3.610
  324   1HG2  VAL  41          HG22      VAL  41  -9.132  -6.922  -4.725
  325   2HG2  VAL  41          HG21      VAL  41  -8.093  -8.197  -4.091
  326   3HG2  VAL  41          HG23      VAL  41  -8.724  -6.956  -3.010
  327    H    GLY  42           HN       GLY  42  -7.078  -5.091  -6.770
  328   1HA   GLY  42           HA2      GLY  42  -9.551  -3.719  -7.641
  329   2HA   GLY  42           HA1      GLY  42  -8.217  -4.208  -8.687
  330    H    ARG  43           HN       ARG  43 -10.160  -5.027  -9.979
  331    HA   ARG  43           HA       ARG  43 -11.486  -7.437  -8.975
  332   1HB   ARG  43           HB2      ARG  43 -12.439  -5.705 -10.645
  333   2HB   ARG  43           HB1      ARG  43 -11.444  -6.522 -11.851
  334   1HG   ARG  43           HG2      ARG  43 -12.532  -8.684 -11.214
  335   2HG   ARG  43           HG1      ARG  43 -13.600  -7.787 -10.134
  336   1HD   ARG  43           HD2      ARG  43 -14.829  -8.030 -12.158
  337   2HD   ARG  43           HD1      ARG  43 -14.224  -6.373 -12.181
  338    HE   ARG  43           HE       ARG  43 -12.313  -8.040 -13.481
  339   1HH1  ARG  43          HH11      ARG  43 -15.541  -6.818 -13.884
  340   2HH1  ARG  43          HH12      ARG  43 -15.467  -6.856 -15.614
  341   1HH2  ARG  43          HH21      ARG  43 -12.230  -8.084 -15.727
  342   2HH2  ARG  43          HH22      ARG  43 -13.601  -7.570 -16.651
  343    H    ARG  44           HN       ARG  44  -8.898  -6.667 -11.284
  344    HA   ARG  44           HA       ARG  44  -8.516  -9.421 -12.119
  345   1HB   ARG  44           HB2      ARG  44  -7.827  -7.323 -13.410
  346   2HB   ARG  44           HB1      ARG  44  -6.473  -7.196 -12.286
  347   1HG   ARG  44           HG2      ARG  44  -5.844  -9.559 -12.896
  348   2HG   ARG  44           HG1      ARG  44  -7.084  -9.506 -14.150
  349   1HD   ARG  44           HD2      ARG  44  -5.912  -7.363 -14.970
  350   2HD   ARG  44           HD1      ARG  44  -4.565  -7.854 -13.944
  351    HE   ARG  44           HE       ARG  44  -5.279 -10.084 -15.550
  352   1HH1  ARG  44          HH11      ARG  44  -3.977  -6.878 -15.869
  353   2HH1  ARG  44          HH12      ARG  44  -3.064  -7.262 -17.289
  354   1HH2  ARG  44          HH21      ARG  44  -4.088 -10.570 -17.394
  355   2HH2  ARG  44          HH22      ARG  44  -3.126  -9.343 -18.147
  356    H    THR  45           HN       THR  45  -7.187  -7.351  -9.598
  357    HA   THR  45           HA       THR  45  -5.047  -9.189  -8.875
  358    HB   THR  45           HB       THR  45  -6.258  -7.013  -7.150
  359    HG1  THR  45           HG1      THR  45  -5.006  -6.835  -9.514
  360   1HG2  THR  45          HG21      THR  45  -3.594  -8.436  -7.258
  361   2HG2  THR  45          HG23      THR  45  -3.823  -6.921  -6.385
  362   3HG2  THR  45          HG22      THR  45  -4.728  -8.359  -5.910
  363    H    TYR  46           HN       TYR  46  -8.394  -8.693  -7.933
  364    HA   TYR  46           HA       TYR  46  -8.365 -10.224  -5.512
  365   1HB   TYR  46           HB2      TYR  46 -10.227  -8.695  -6.364
  366   2HB   TYR  46           HB1      TYR  46 -10.698 -10.020  -7.428
  367    HD1  TYR  46           HD2      TYR  46  -9.687  -9.588  -3.833
  368    HD2  TYR  46           HD1      TYR  46 -12.398 -11.388  -6.636
  369    HE1  TYR  46           HE2      TYR  46 -10.912 -10.658  -1.961
  370    HE2  TYR  46           HE1      TYR  46 -13.623 -12.459  -4.763
  371    HH   TYR  46           HH       TYR  46 -13.603 -12.897  -2.569
  372    H    GLU  47           HN       GLU  47  -9.494 -11.186  -8.777
  373    HA   GLU  47           HA       GLU  47  -9.719 -13.970  -8.138
  374   1HB   GLU  47           HB2      GLU  47  -9.337 -12.568 -10.800
  375   2HB   GLU  47           HB1      GLU  47  -9.725 -14.281 -10.629
  376   1HG   GLU  47           HG2      GLU  47 -11.850 -13.833  -9.709
  377   2HG   GLU  47           HG1      GLU  47 -11.423 -12.170  -9.307
  378    H    SER  48           HN       SER  48  -6.980 -11.989  -8.713
  379    HA   SER  48           HA       SER  48  -5.185 -13.867  -9.900
  380   1HB   SER  48           HB2      SER  48  -4.834 -11.350  -9.531
  381   2HB   SER  48           HB1      SER  48  -4.383 -11.765  -7.880
  382    HG   SER  48           HG       SER  48  -2.506 -12.263  -8.658
  383    H    PHE  49           HN       PHE  49  -6.330 -13.459  -6.612
  384    HA   PHE  49           HA       PHE  49  -4.297 -15.011  -5.299
  385   1HB   PHE  49           HB2      PHE  49  -7.201 -14.662  -4.489
  386   2HB   PHE  49           HB1      PHE  49  -5.868 -15.137  -3.437
  387    HD1  PHE  49           HD2      PHE  49  -3.700 -13.414  -3.918
  388    HD2  PHE  49           HD1      PHE  49  -7.886 -12.472  -4.111
  389    HE1  PHE  49           HE2      PHE  49  -3.182 -11.027  -3.493
  390    HE2  PHE  49           HE1      PHE  49  -7.368 -10.084  -3.686
  391    HZ   PHE  49           HZ       PHE  49  -5.016  -9.361  -3.377
  392    HA   PRO  50           HA       PRO  50  -5.536 -19.168  -6.285
  393   1HB   PRO  50           HB2      PRO  50  -4.842 -20.392  -3.862
  394   2HB   PRO  50           HB1      PRO  50  -3.751 -20.077  -5.218
  395   1HG   PRO  50           HG2      PRO  50  -3.747 -18.862  -2.627
  396   2HG   PRO  50           HG1      PRO  50  -2.644 -18.568  -3.978
  397   1HD   PRO  50           HD2      PRO  50  -4.884 -16.938  -3.045
  398   2HD   PRO  50           HD1      PRO  50  -3.581 -16.513  -4.167
  399    H    LYS  51           HN       LYS  51  -6.227 -18.904  -2.783
  400    HA   LYS  51           HA       LYS  51  -8.946 -20.004  -3.334
  401   1HB   LYS  51           HB2      LYS  51  -8.950 -20.523  -0.879
  402   2HB   LYS  51           HB1      LYS  51  -7.659 -21.339  -1.761
  403   1HG   LYS  51           HG2      LYS  51  -6.026 -19.740  -1.009
  404   2HG   LYS  51           HG1      LYS  51  -7.275 -18.695  -0.335
  405   1HD   LYS  51           HD2      LYS  51  -7.835 -20.343   1.350
  406   2HD   LYS  51           HD1      LYS  51  -6.756 -21.527   0.610
  407   1HE   LYS  51           HE2      LYS  51  -5.826 -18.861   1.710
  408   2HE   LYS  51           HE1      LYS  51  -5.773 -20.370   2.621
  409   1HZ   LYS  51           HZ3      LYS  51  -4.577 -21.172   0.432
  410   2HZ   LYS  51           HZ2      LYS  51  -4.177 -19.524   0.325
  411   3HZ   LYS  51           HZ1      LYS  51  -3.722 -20.424   1.692
  412    H    ARG  52           HN       ARG  52 -10.776 -18.894  -2.605
  413    HA   ARG  52           HA       ARG  52 -10.393 -16.356  -1.116
  414   1HB   ARG  52           HB2      ARG  52 -11.429 -16.624  -3.920
  415   2HB   ARG  52           HB1      ARG  52 -12.111 -15.382  -2.871
  416   1HG   ARG  52           HG2      ARG  52  -9.819 -14.533  -2.418
  417   2HG   ARG  52           HG1      ARG  52  -9.173 -15.738  -3.535
  418   1HD   ARG  52           HD2      ARG  52 -11.345 -13.886  -4.467
  419   2HD   ARG  52           HD1      ARG  52  -9.682 -13.304  -4.399
  420    HE   ARG  52           HE       ARG  52  -9.091 -14.887  -6.114
  421   1HH1  ARG  52          HH11      ARG  52 -12.419 -15.074  -5.132
  422   2HH1  ARG  52          HH12      ARG  52 -12.895 -16.018  -6.504
  423   1HH2  ARG  52          HH21      ARG  52  -9.721 -16.113  -7.890
  424   2HH2  ARG  52          HH22      ARG  52 -11.374 -16.603  -8.057
  425    HA   PRO  53           HA       PRO  53 -11.975 -14.544  -1.044
  426   1HB   PRO  53           HB2      PRO  53 -13.363 -13.610   1.201
  427   2HB   PRO  53           HB1      PRO  53 -13.898 -13.473  -0.480
  428   1HG   PRO  53           HG2      PRO  53 -15.031 -15.064   1.613
  429   2HG   PRO  53           HG1      PRO  53 -15.577 -14.903  -0.062
  430   1HD   PRO  53           HD2      PRO  53 -14.080 -17.084   1.186
  431   2HD   PRO  53           HD1      PRO  53 -14.924 -17.052  -0.371
  432    H    LEU  54           HN       LEU  54 -10.364 -13.485   0.204
  433    HA   LEU  54           HA       LEU  54  -8.820 -15.096   1.977
  434   1HB   LEU  54           HB2      LEU  54  -8.813 -12.078   1.691
  435   2HB   LEU  54           HB1      LEU  54  -7.524 -13.054   2.396
  436    HG   LEU  54           HG       LEU  54  -8.520 -13.356  -0.451
  437   1HD1  LEU  54          HD12      LEU  54  -6.393 -11.658   0.788
  438   2HD1  LEU  54          HD11      LEU  54  -6.051 -12.406  -0.772
  439   3HD1  LEU  54          HD13      LEU  54  -7.430 -11.321  -0.597
  440   1HD2  LEU  54          HD22      LEU  54  -6.275 -14.570   1.169
  441   2HD2  LEU  54          HD21      LEU  54  -7.536 -15.402   0.261
  442   3HD2  LEU  54          HD23      LEU  54  -6.243 -14.559  -0.594
  443    HA   PRO  55           HA       PRO  55 -11.487 -14.267   5.582
  444   1HB   PRO  55           HB2      PRO  55 -10.373 -16.384   7.047
  445   2HB   PRO  55           HB1      PRO  55 -11.833 -16.461   6.052
  446   1HG   PRO  55           HG2      PRO  55  -9.312 -17.726   5.585
  447   2HG   PRO  55           HG1      PRO  55 -10.778 -17.804   4.596
  448   1HD   PRO  55           HD2      PRO  55  -8.339 -16.251   4.155
  449   2HD   PRO  55           HD1      PRO  55  -9.657 -16.612   3.029
  450    H    GLU  56           HN       GLU  56 -10.879 -14.115   8.033
  451    HA   GLU  56           HA       GLU  56  -9.592 -13.075   9.690
  452   1HB   GLU  56           HB2      GLU  56  -7.217 -13.962   8.025
  453   2HB   GLU  56           HB1      GLU  56  -7.216 -13.552   9.740
  454   1HG   GLU  56           HG2      GLU  56  -8.664 -15.448  10.240
  455   2HG   GLU  56           HG1      GLU  56  -8.807 -15.827   8.523
  456    H    ARG  57           HN       ARG  57 -10.376 -11.674   7.125
  457    HA   ARG  57           HA       ARG  57  -9.183  -9.142   7.680
  458   1HB   ARG  57           HB2      ARG  57  -7.827  -8.877   5.606
  459   2HB   ARG  57           HB1      ARG  57  -7.161 -10.099   6.689
  460   1HG   ARG  57           HG2      ARG  57  -8.665 -11.742   5.279
  461   2HG   ARG  57           HG1      ARG  57  -8.580 -10.462   4.069
  462   1HD   ARG  57           HD2      ARG  57  -6.673 -11.606   3.481
  463   2HD   ARG  57           HD1      ARG  57  -5.980 -10.568   4.727
  464    HE   ARG  57           HE       ARG  57  -6.728 -12.712   6.210
  465   1HH1  ARG  57          HH21      ARG  57  -5.103 -12.480   3.148
  466   2HH1  ARG  57          HH22      ARG  57  -4.215 -13.949   3.373
  467   1HH2  ARG  57          HH11      ARG  57  -5.570 -14.616   6.491
  468   2HH2  ARG  57          HH12      ARG  57  -4.478 -15.153   5.258
  469    H    THR  58           HN       THR  58 -10.189  -7.483   6.453
  470    HA   THR  58           HA       THR  58 -12.686  -8.278   5.159
  471    HB   THR  58           HB       THR  58 -11.495  -5.498   5.288
  472    HG1  THR  58           HG1      THR  58 -12.475  -7.143   7.253
  473   1HG2  THR  58          HG21      THR  58 -14.315  -6.585   5.077
  474   2HG2  THR  58          HG23      THR  58 -13.924  -4.883   5.321
  475   3HG2  THR  58          HG22      THR  58 -13.429  -5.696   3.838
  476    H    ASN  59           HN       ASN  59 -12.928  -8.630   3.010
  477    HA   ASN  59           HA       ASN  59 -10.696  -7.861   1.196
  478   1HB   ASN  59           HB2      ASN  59 -12.948  -9.867   0.989
  479   2HB   ASN  59           HB1      ASN  59 -11.981  -9.407  -0.412
  480   1HD2  ASN  59          HD22      ASN  59  -9.811 -11.089   2.649
  481   2HD2  ASN  59          HD21      ASN  59 -10.943  -9.877   3.003
  482    H    VAL  60           HN       VAL  60 -10.979  -6.000   0.085
  483    HA   VAL  60           HA       VAL  60 -13.772  -5.174  -0.606
  484    HB   VAL  60           HB       VAL  60 -11.321  -3.407  -0.337
  485   1HG1  VAL  60          HG11      VAL  60 -14.268  -2.901  -0.787
  486   2HG1  VAL  60          HG13      VAL  60 -13.180  -1.646  -0.193
  487   3HG1  VAL  60          HG12      VAL  60 -12.910  -2.369  -1.780
  488   1HG2  VAL  60          HG23      VAL  60 -13.621  -3.893   1.585
  489   2HG2  VAL  60          HG22      VAL  60 -11.945  -4.381   1.837
  490   3HG2  VAL  60          HG21      VAL  60 -12.369  -2.669   1.790
  491    H    VAL  61           HN       VAL  61 -14.168  -4.484  -2.744
  492    HA   VAL  61           HA       VAL  61 -11.914  -4.789  -4.679
  493    HB   VAL  61           HB       VAL  61 -14.723  -5.851  -5.107
  494   1HG1  VAL  61          HG11      VAL  61 -12.151  -6.031  -6.702
  495   2HG1  VAL  61          HG13      VAL  61 -13.594  -6.983  -7.051
  496   3HG1  VAL  61          HG12      VAL  61 -13.644  -5.225  -7.185
  497   1HG2  VAL  61          HG23      VAL  61 -13.495  -7.145  -3.386
  498   2HG2  VAL  61          HG22      VAL  61 -13.702  -8.081  -4.866
  499   3HG2  VAL  61          HG21      VAL  61 -12.145  -7.337  -4.504
  500    H    LEU  62           HN       LEU  62 -11.715  -2.896  -5.752
  501    HA   LEU  62           HA       LEU  62 -14.074  -1.099  -5.964
  502   1HB   LEU  62           HB2      LEU  62 -11.832  -0.271  -5.097
  503   2HB   LEU  62           HB1      LEU  62 -11.206  -0.498  -6.730
  504    HG   LEU  62           HG       LEU  62 -13.251   0.934  -7.467
  505   1HD1  LEU  62          HD13      LEU  62 -13.108   1.417  -4.490
  506   2HD1  LEU  62          HD12      LEU  62 -13.742   2.643  -5.588
  507   3HD1  LEU  62          HD11      LEU  62 -14.527   1.068  -5.477
  508   1HD2  LEU  62          HD22      LEU  62 -10.843   2.013  -5.977
  509   2HD2  LEU  62          HD21      LEU  62 -11.020   1.785  -7.717
  510   3HD2  LEU  62          HD23      LEU  62 -11.940   3.045  -6.895
  511    H    THR  63           HN       THR  63 -15.270  -1.595  -7.754
  512    HA   THR  63           HA       THR  63 -13.843  -1.672 -10.369
  513    HB   THR  63           HB       THR  63 -14.294  -4.002  -9.827
  514    HG1  THR  63           HG1      THR  63 -14.931  -2.962 -11.956
  515   1HG2  THR  63          HG21      THR  63 -17.079  -2.975  -9.248
  516   2HG2  THR  63          HG23      THR  63 -16.721  -4.686  -9.487
  517   3HG2  THR  63          HG22      THR  63 -15.984  -3.810  -8.146
  518    H    HIS  64           HN       HIS  64 -15.214  -1.020 -12.166
  519    HA   HIS  64           HA       HIS  64 -17.403   0.790 -11.288
  520   1HB   HIS  64           HB2      HIS  64 -17.183   1.730 -13.606
  521   2HB   HIS  64           HB1      HIS  64 -15.697   1.843 -12.663
  522    HD1  HIS  64           HD1      HIS  64 -13.653   0.710 -13.602
  523    HD2  HIS  64           HD2      HIS  64 -17.143  -0.520 -15.520
  524    HE1  HIS  64           HE1      HIS  64 -12.927  -0.732 -15.553
  525    H    GLN  65           HN       GLN  65 -16.766  -2.044 -13.264
  526    HA   GLN  65           HA       GLN  65 -19.342  -2.075 -14.590
  527   1HB   GLN  65           HB2      GLN  65 -17.188  -3.304 -15.294
  528   2HB   GLN  65           HB1      GLN  65 -17.616  -4.498 -14.068
  529   1HG   GLN  65           HG2      GLN  65 -18.604  -5.353 -16.030
  530   2HG   GLN  65           HG1      GLN  65 -19.941  -4.536 -15.219
  531   1HE2  GLN  65          HE22      GLN  65 -18.653  -3.183 -18.818
  532   2HE2  GLN  65          HE21      GLN  65 -17.944  -4.535 -18.077
  533    H    GLU  66           HN       GLU  66 -21.256  -2.627 -13.685
  534    HA   GLU  66           HA       GLU  66 -21.324  -3.729 -10.962
  535   1HB   GLU  66           HB2      GLU  66 -23.523  -2.921 -12.888
  536   2HB   GLU  66           HB1      GLU  66 -23.804  -3.479 -11.238
  537   1HG   GLU  66           HG2      GLU  66 -22.153  -1.614 -10.537
  538   2HG   GLU  66           HG1      GLU  66 -22.417  -0.962 -12.155
  539    H    ASP  67           HN       ASP  67 -20.307  -5.407 -13.193
  540    HA   ASP  67           HA       ASP  67 -22.406  -7.519 -13.327
  541   1HB   ASP  67           HB2      ASP  67 -21.167  -6.663 -15.418
  542   2HB   ASP  67           HB1      ASP  67 -19.764  -7.529 -14.793
  543    H    TYR  68           HN       TYR  68 -19.111  -6.881 -12.225
  544    HA   TYR  68           HA       TYR  68 -18.557  -9.606 -11.416
  545   1HB   TYR  68           HB2      TYR  68 -16.867  -7.707 -11.848
  546   2HB   TYR  68           HB1      TYR  68 -17.278  -7.141 -10.229
  547    HD1  TYR  68           HD2      TYR  68 -16.140 -10.175 -12.097
  548    HD2  TYR  68           HD1      TYR  68 -16.272  -8.108  -8.334
  549    HE1  TYR  68           HE2      TYR  68 -14.613 -11.865 -11.116
  550    HE2  TYR  68           HE1      TYR  68 -14.745  -9.799  -7.352
  551    HH   TYR  68           HH       TYR  68 -14.145 -12.230  -7.831
  552    H    GLN  69           HN       GLN  69 -18.881 -10.567  -9.414
  553    HA   GLN  69           HA       GLN  69 -19.994  -8.927  -7.204
  554   1HB   GLN  69           HB2      GLN  69 -21.353 -11.364  -8.395
  555   2HB   GLN  69           HB1      GLN  69 -21.813 -10.618  -6.864
  556   1HG   GLN  69           HG2      GLN  69 -22.239  -8.482  -8.042
  557   2HG   GLN  69           HG1      GLN  69 -21.816  -9.252  -9.572
  558   1HE2  GLN  69          HE21      GLN  69 -24.419  -8.618  -7.450
  559   2HE2  GLN  69          HE22      GLN  69 -25.540  -9.701  -8.122
  560    H    ALA  70           HN       ALA  70 -18.367  -9.355  -5.756
  561    HA   ALA  70           HA       ALA  70 -17.263 -12.080  -5.515
  562   1HB   ALA  70           HB1      ALA  70 -16.620  -9.409  -4.275
  563   2HB   ALA  70           HB3      ALA  70 -15.944 -10.896  -3.611
  564   3HB   ALA  70           HB2      ALA  70 -15.593 -10.435  -5.276
  565    H    GLN  71           HN       GLN  71 -18.272 -13.541  -4.240
  566    HA   GLN  71           HA       GLN  71 -20.284 -12.717  -2.285
  567   1HB   GLN  71           HB2      GLN  71 -19.137 -15.405  -3.080
  568   2HB   GLN  71           HB1      GLN  71 -20.358 -15.220  -1.820
  569   1HG   GLN  71           HG2      GLN  71 -21.813 -14.033  -3.485
  570   2HG   GLN  71           HG1      GLN  71 -20.622 -14.414  -4.730
  571   1HE2  GLN  71          HE22      GLN  71 -21.626 -17.795  -5.032
  572   2HE2  GLN  71          HE21      GLN  71 -20.519 -16.600  -5.510
  573    H    GLY  72           HN       GLY  72 -19.839 -12.222  -0.202
  574   1HA   GLY  72           HA2      GLY  72 -18.852 -12.471   1.947
  575   2HA   GLY  72           HA1      GLY  72 -17.725 -13.644   1.264
  576    H    ALA  73           HN       ALA  73 -18.344 -10.383   0.029
  577    HA   ALA  73           HA       ALA  73 -15.842  -9.338   1.159
  578   1HB   ALA  73           HB2      ALA  73 -15.296 -10.709  -0.977
  579   2HB   ALA  73           HB1      ALA  73 -16.072  -9.387  -1.849
  580   3HB   ALA  73           HB3      ALA  73 -14.645  -9.074  -0.859
  581    H    VAL  74           HN       VAL  74 -15.804  -7.070   1.107
  582    HA   VAL  74           HA       VAL  74 -18.358  -5.760   0.646
  583    HB   VAL  74           HB       VAL  74 -15.658  -4.495   1.200
  584   1HG1  VAL  74          HG11      VAL  74 -17.462  -2.972   0.404
  585   2HG1  VAL  74          HG13      VAL  74 -18.485  -3.528   1.727
  586   3HG1  VAL  74          HG12      VAL  74 -16.999  -2.644   2.074
  587   1HG2  VAL  74          HG22      VAL  74 -16.241  -6.207   2.896
  588   2HG2  VAL  74          HG21      VAL  74 -16.329  -4.580   3.571
  589   3HG2  VAL  74          HG23      VAL  74 -17.809  -5.432   3.128
  590    H    VAL  75           HN       VAL  75 -18.805  -5.918  -1.586
  591    HA   VAL  75           HA       VAL  75 -16.855  -5.095  -3.592
  592    HB   VAL  75           HB       VAL  75 -19.851  -5.463  -3.894
  593   1HG1  VAL  75          HG13      VAL  75 -18.476  -4.265  -5.705
  594   2HG1  VAL  75          HG12      VAL  75 -17.677  -5.816  -5.964
  595   3HG1  VAL  75          HG11      VAL  75 -19.414  -5.665  -6.225
  596   1HG2  VAL  75          HG23      VAL  75 -17.545  -7.416  -3.953
  597   2HG2  VAL  75          HG22      VAL  75 -19.049  -7.531  -3.040
  598   3HG2  VAL  75          HG21      VAL  75 -19.060  -7.750  -4.790
  599    H    VAL  76           HN       VAL  76 -16.273  -2.951  -3.410
  600    HA   VAL  76           HA       VAL  76 -18.409  -0.911  -3.072
  601    HB   VAL  76           HB       VAL  76 -16.476   0.663  -2.798
  602   1HG1  VAL  76          HG13      VAL  76 -17.528  -0.483  -0.858
  603   2HG1  VAL  76          HG12      VAL  76 -16.369  -1.801  -1.031
  604   3HG1  VAL  76          HG11      VAL  76 -15.809  -0.186  -0.598
  605   1HG2  VAL  76          HG23      VAL  76 -14.913  -1.917  -3.122
  606   2HG2  VAL  76          HG22      VAL  76 -14.803  -0.475  -4.132
  607   3HG2  VAL  76          HG21      VAL  76 -14.226  -0.432  -2.466
  608    H    HIS  77           HN       HIS  77 -18.522   0.894  -4.568
  609    HA   HIS  77           HA       HIS  77 -17.202   0.431  -7.204
  610   1HB   HIS  77           HB2      HIS  77 -20.142   0.983  -6.709
  611   2HB   HIS  77           HB1      HIS  77 -19.376   1.095  -8.293
  612    HD1  HIS  77           HD1      HIS  77 -19.096  -1.048  -9.580
  613    HD2  HIS  77           HD2      HIS  77 -19.974  -1.741  -5.565
  614    HE1  HIS  77           HE1      HIS  77 -19.446  -3.546  -9.344
  615    H    ASP  78           HN       ASP  78 -16.723   2.329  -4.959
  616    HA   ASP  78           HA       ASP  78 -16.581   4.766  -6.573
  617   1HB   ASP  78           HB2      ASP  78 -18.512   4.470  -4.296
  618   2HB   ASP  78           HB1      ASP  78 -17.718   6.025  -4.542
  619    H    VAL  79           HN       VAL  79 -14.917   6.093  -5.845
  620    HA   VAL  79           HA       VAL  79 -13.012   4.974  -3.999
  621    HB   VAL  79           HB       VAL  79 -13.177   7.834  -4.999
  622   1HG1  VAL  79          HG11      VAL  79 -11.603   7.313  -3.096
  623   2HG1  VAL  79          HG13      VAL  79 -10.784   6.172  -4.162
  624   3HG1  VAL  79          HG12      VAL  79 -10.801   7.891  -4.557
  625   1HG2  VAL  79          HG22      VAL  79 -11.893   5.370  -6.223
  626   2HG2  VAL  79          HG21      VAL  79 -13.241   6.289  -6.893
  627   3HG2  VAL  79          HG23      VAL  79 -11.638   7.019  -6.795
  628    H    ALA  80           HN       ALA  80 -15.548   7.412  -3.709
  629    HA   ALA  80           HA       ALA  80 -14.761   8.338  -1.081
  630   1HB   ALA  80           HB3      ALA  80 -17.442   8.453  -2.499
  631   2HB   ALA  80           HB2      ALA  80 -17.040   9.330  -1.021
  632   3HB   ALA  80           HB1      ALA  80 -16.198   9.704  -2.525
  633    H    ALA  81           HN       ALA  81 -16.793   5.730  -2.289
  634    HA   ALA  81           HA       ALA  81 -18.096   5.099   0.195
  635   1HB   ALA  81           HB1      ALA  81 -18.738   4.271  -2.129
  636   2HB   ALA  81           HB3      ALA  81 -17.399   3.131  -1.998
  637   3HB   ALA  81           HB2      ALA  81 -18.744   3.047  -0.860
  638    H    VAL  82           HN       VAL  82 -15.008   4.137  -1.238
  639    HA   VAL  82           HA       VAL  82 -14.389   2.085   0.689
  640    HB   VAL  82           HB       VAL  82 -12.455   3.797  -0.901
  641   1HG1  VAL  82          HG12      VAL  82 -12.243   1.030   0.323
  642   2HG1  VAL  82          HG11      VAL  82 -11.018   1.773  -0.706
  643   3HG1  VAL  82          HG13      VAL  82 -11.395   2.476   0.867
  644   1HG2  VAL  82          HG21      VAL  82 -14.198   1.467  -1.635
  645   2HG2  VAL  82          HG23      VAL  82 -13.781   2.891  -2.588
  646   3HG2  VAL  82          HG22      VAL  82 -12.600   1.599  -2.371
  647    H    PHE  83           HN       PHE  83 -13.699   5.567   0.518
  648    HA   PHE  83           HA       PHE  83 -12.097   5.607   2.934
  649   1HB   PHE  83           HB2      PHE  83 -13.457   7.735   1.277
  650   2HB   PHE  83           HB1      PHE  83 -12.633   8.129   2.786
  651    HD1  PHE  83           HD1      PHE  83 -10.235   6.815   2.987
  652    HD2  PHE  83           HD2      PHE  83 -12.186   8.010  -0.648
  653    HE1  PHE  83           HE1      PHE  83  -8.054   6.786   1.807
  654    HE2  PHE  83           HE2      PHE  83 -10.005   7.981  -1.828
  655    HZ   PHE  83           HZ       PHE  83  -7.939   7.369  -0.601
  656    H    ALA  84           HN       ALA  84 -15.521   5.966   2.201
  657    HA   ALA  84           HA       ALA  84 -16.320   7.025   4.756
  658   1HB   ALA  84           HB2      ALA  84 -17.716   7.025   2.645
  659   2HB   ALA  84           HB1      ALA  84 -17.982   5.301   2.899
  660   3HB   ALA  84           HB3      ALA  84 -18.569   6.468   4.084
  661    H    TYR  85           HN       TYR  85 -15.835   3.751   3.517
  662    HA   TYR  85           HA       TYR  85 -17.006   2.392   5.779
  663   1HB   TYR  85           HB2      TYR  85 -16.526   1.386   3.491
  664   2HB   TYR  85           HB1      TYR  85 -14.828   1.325   3.967
  665    HD1  TYR  85           HD1      TYR  85 -18.241   0.269   5.077
  666    HD2  TYR  85           HD2      TYR  85 -14.015  -0.476   5.242
  667    HE1  TYR  85           HE1      TYR  85 -18.661  -1.839   6.313
  668    HE2  TYR  85           HE2      TYR  85 -14.434  -2.584   6.477
  669    HH   TYR  85           HH       TYR  85 -16.228  -4.196   6.804
  670    H    ALA  86           HN       ALA  86 -13.764   3.582   5.027
  671    HA   ALA  86           HA       ALA  86 -12.460   2.314   7.274
  672   1HB   ALA  86           HB1      ALA  86 -11.723   4.686   5.543
  673   2HB   ALA  86           HB3      ALA  86 -10.677   4.071   6.823
  674   3HB   ALA  86           HB2      ALA  86 -11.083   3.046   5.446
  675    H    LYS  87           HN       LYS  87 -14.183   5.346   6.806
  676    HA   LYS  87           HA       LYS  87 -13.334   6.606   9.254
  677   1HB   LYS  87           HB2      LYS  87 -15.699   6.994   7.416
  678   2HB   LYS  87           HB1      LYS  87 -15.521   7.931   8.901
  679   1HG   LYS  87           HG2      LYS  87 -13.278   8.678   8.139
  680   2HG   LYS  87           HG1      LYS  87 -13.512   7.790   6.632
  681   1HD   LYS  87           HD2      LYS  87 -15.613   9.153   6.265
  682   2HD   LYS  87           HD1      LYS  87 -15.129  10.142   7.643
  683   1HE   LYS  87           HE2      LYS  87 -12.857  10.362   6.380
  684   2HE   LYS  87           HE1      LYS  87 -13.780   9.848   4.968
  685   1HZ   LYS  87           HZ3      LYS  87 -14.758  12.032   6.692
  686   2HZ   LYS  87           HZ2      LYS  87 -13.609  12.339   5.479
  687   3HZ   LYS  87           HZ1      LYS  87 -15.131  11.706   5.070
  688    H    GLN  88           HN       GLN  88 -15.948   4.381   8.424
  689    HA   GLN  88           HA       GLN  88 -17.351   4.605  10.938
  690   1HB   GLN  88           HB2      GLN  88 -18.218   3.618   8.723
  691   2HB   GLN  88           HB1      GLN  88 -17.332   2.158   9.166
  692   1HG   GLN  88           HG2      GLN  88 -18.672   1.755  11.044
  693   2HG   GLN  88           HG1      GLN  88 -19.209   3.432  11.140
  694   1HE2  GLN  88          HE22      GLN  88 -21.632   3.022   8.472
  695   2HE2  GLN  88          HE21      GLN  88 -20.529   4.158   9.084
  696    H    HIS  89           HN       HIS  89 -14.659   2.647   9.787
  697    HA   HIS  89           HA       HIS  89 -14.445   1.465  12.530
  698   1HB   HIS  89           HB2      HIS  89 -13.859   0.287   9.813
  699   2HB   HIS  89           HB1      HIS  89 -13.116  -0.368  11.273
  700    HD1  HIS  89           HD1      HIS  89 -14.411  -2.388  11.944
  701    HD2  HIS  89           HD2      HIS  89 -16.922   0.674  10.639
  702    HE1  HIS  89           HE1      HIS  89 -16.781  -3.220  12.263
  703    HA   PRO  90           HA       PRO  90 -10.649   4.017  11.939
  704   1HB   PRO  90           HB2      PRO  90 -10.738   4.966  14.571
  705   2HB   PRO  90           HB1      PRO  90 -11.343   5.815  13.142
  706   1HG   PRO  90           HG2      PRO  90 -12.849   4.708  15.310
  707   2HG   PRO  90           HG1      PRO  90 -13.446   5.582  13.893
  708   1HD   PRO  90           HD2      PRO  90 -13.473   2.708  14.427
  709   2HD   PRO  90           HD1      PRO  90 -14.350   3.626  13.191
  710    H    ASP  91           HN       ASP  91 -11.158   1.151  13.027
  711    HA   ASP  91           HA       ASP  91  -8.951   1.001  15.020
  712   1HB   ASP  91           HB2      ASP  91 -11.188  -0.176  15.390
  713   2HB   ASP  91           HB1      ASP  91 -10.727  -1.260  14.077
  714    H    GLN  92           HN       GLN  92  -9.821   0.083  11.744
  715    HA   GLN  92           HA       GLN  92  -7.197  -1.310  11.441
  716   1HB   GLN  92           HB2      GLN  92  -9.774  -1.399   9.867
  717   2HB   GLN  92           HB1      GLN  92  -8.262  -2.013   9.199
  718   1HG   GLN  92           HG2      GLN  92  -8.085  -3.706  10.816
  719   2HG   GLN  92           HG1      GLN  92  -9.179  -2.885  11.931
  720   1HE2  GLN  92          HE22      GLN  92 -12.093  -3.813   9.849
  721   2HE2  GLN  92          HE21      GLN  92 -11.444  -2.391  10.509
  722    H    GLU  93           HN       GLU  93  -6.392  -0.971   9.005
  723    HA   GLU  93           HA       GLU  93  -6.563   1.953   8.387
  724   1HB   GLU  93           HB2      GLU  93  -4.155   0.159   8.629
  725   2HB   GLU  93           HB1      GLU  93  -4.107   1.582   7.587
  726   1HG   GLU  93           HG2      GLU  93  -3.308   2.347   9.690
  727   2HG   GLU  93           HG1      GLU  93  -4.984   2.893   9.617
  728    H    LEU  94           HN       LEU  94  -6.216   2.470   6.118
  729    HA   LEU  94           HA       LEU  94  -7.311   0.419   4.334
  730   1HB   LEU  94           HB2      LEU  94  -7.826   2.949   4.285
  731   2HB   LEU  94           HB1      LEU  94  -6.262   3.121   3.489
  732    HG   LEU  94           HG       LEU  94  -7.099   1.282   1.876
  733   1HD1  LEU  94          HD11      LEU  94  -9.621   2.072   3.331
  734   2HD1  LEU  94          HD13      LEU  94  -9.675   1.475   1.673
  735   3HD1  LEU  94          HD12      LEU  94  -9.030   0.454   2.958
  736   1HD2  LEU  94          HD21      LEU  94  -8.263   4.077   1.973
  737   2HD2  LEU  94          HD23      LEU  94  -6.832   3.539   1.093
  738   3HD2  LEU  94          HD22      LEU  94  -8.434   3.015   0.575
  739    H    VAL  95           HN       VAL  95  -6.063  -0.989   3.219
  740    HA   VAL  95           HA       VAL  95  -3.243  -0.195   2.603
  741    HB   VAL  95           HB       VAL  95  -4.230  -2.993   3.235
  742   1HG1  VAL  95          HG12      VAL  95  -1.456  -1.819   2.872
  743   2HG1  VAL  95          HG11      VAL  95  -1.798  -3.479   3.360
  744   3HG1  VAL  95          HG13      VAL  95  -2.271  -2.915   1.756
  745   1HG2  VAL  95          HG23      VAL  95  -4.305  -1.460   5.207
  746   2HG2  VAL  95          HG22      VAL  95  -3.090  -2.726   5.385
  747   3HG2  VAL  95          HG21      VAL  95  -2.601  -1.088   4.949
  748    H    ILE  96           HN       ILE  96  -2.956  -0.055   0.441
  749    HA   ILE  96           HA       ILE  96  -4.832  -1.497  -1.359
  750    HB   ILE  96           HB       ILE  96  -2.749   0.591  -2.057
  751   1HG1  ILE  96          HG12      ILE  96  -4.410   1.507  -0.475
  752   2HG1  ILE  96          HG11      ILE  96  -4.631   2.194  -2.082
  753   1HG2  ILE  96          HG22      ILE  96  -3.502  -0.833  -3.928
  754   2HG2  ILE  96          HG21      ILE  96  -5.179  -0.435  -3.553
  755   3HG2  ILE  96          HG23      ILE  96  -4.079   0.823  -4.116
  756   1HD1  ILE  96          HD11      ILE  96  -6.403   0.433  -2.493
  757   2HD1  ILE  96          HD13      ILE  96  -6.269  -0.005  -0.791
  758   3HD1  ILE  96          HD12      ILE  96  -6.818   1.608  -1.246
  759    H    ALA  97           HN       ALA  97  -4.170  -3.332  -2.353
  760    HA   ALA  97           HA       ALA  97  -1.254  -3.966  -2.343
  761   1HB   ALA  97           HB2      ALA  97  -3.757  -5.614  -2.281
  762   2HB   ALA  97           HB1      ALA  97  -2.306  -6.310  -3.003
  763   3HB   ALA  97           HB3      ALA  97  -2.286  -5.779  -1.322
  764    H    GLY  98           HN       GLY  98  -3.996  -3.373  -4.407
  765   1HA   GLY  98           HA2      GLY  98  -2.613  -2.757  -6.725
  766   2HA   GLY  98           HA1      GLY  98  -2.818  -4.507  -6.816
  767    H    GLY  99           HN       GLY  99  -5.825  -3.273  -8.516
  768   1HA   GLY  99           HA2      GLY  99  -3.076  -4.262  -8.833
  769   2HA   GLY  99           HA1      GLY  99  -4.222  -3.938 -10.135
  770    H    ALA 100           HN       ALA 100  -2.516  -2.788 -11.269
  771    HA   ALA 100           HA       ALA 100  -1.164  -0.509 -10.151
  772   1HB   ALA 100           HB1      ALA 100  -0.553  -1.853 -12.263
  773   2HB   ALA 100           HB3      ALA 100  -1.773  -0.881 -13.086
  774   3HB   ALA 100           HB2      ALA 100  -0.372  -0.100 -12.352
  775    H    GLN 101           HN       GLN 101  -4.236  -0.922 -11.834
  776    HA   GLN 101           HA       GLN 101  -4.720   1.912 -12.218
  777   1HB   GLN 101           HB2      GLN 101  -6.499  -0.532 -12.286
  778   2HB   GLN 101           HB1      GLN 101  -7.126   1.096 -12.544
  779   1HG   GLN 101           HG2      GLN 101  -5.844   1.407 -14.505
  780   2HG   GLN 101           HG1      GLN 101  -4.772   0.061 -14.120
  781   1HE2  GLN 101          HE22      GLN 101  -7.851  -0.706 -16.473
  782   2HE2  GLN 101          HE21      GLN 101  -7.126   0.815 -16.262
  783    H    ILE 102           HN       ILE 102  -5.268  -0.374  -9.623
  784    HA   ILE 102           HA       ILE 102  -7.173   1.246  -8.162
  785    HB   ILE 102           HB       ILE 102  -5.290  -0.872  -7.086
  786   1HG1  ILE 102          HG12      ILE 102  -6.602  -1.736  -8.993
  787   2HG1  ILE 102          HG11      ILE 102  -7.150  -2.453  -7.480
  788   1HG2  ILE 102          HG21      ILE 102  -7.909   0.286  -6.093
  789   2HG2  ILE 102          HG23      ILE 102  -7.143  -1.148  -5.407
  790   3HG2  ILE 102          HG22      ILE 102  -6.330   0.414  -5.318
  791   1HD1  ILE 102          HD13      ILE 102  -8.997  -0.792  -7.384
  792   2HD1  ILE 102          HD12      ILE 102  -8.467  -0.137  -8.934
  793   3HD1  ILE 102          HD11      ILE 102  -9.081  -1.788  -8.837
  794    H    PHE 103           HN       PHE 103  -3.643   0.921  -8.135
  795    HA   PHE 103           HA       PHE 103  -3.145   2.524  -5.819
  796   1HB   PHE 103           HB2      PHE 103  -1.488   1.938  -8.284
  797   2HB   PHE 103           HB1      PHE 103  -0.880   2.898  -6.935
  798    HD1  PHE 103           HD2      PHE 103  -1.746   1.667  -4.541
  799    HD2  PHE 103           HD1      PHE 103  -0.659  -0.234  -8.237
  800    HE1  PHE 103           HE2      PHE 103  -1.196  -0.414  -3.310
  801    HE2  PHE 103           HE1      PHE 103  -0.110  -2.315  -7.005
  802    HZ   PHE 103           HZ       PHE 103  -0.377  -2.404  -4.541
  803    H    THR 104           HN       THR 104  -3.271   3.384  -9.284
  804    HA   THR 104           HA       THR 104  -2.758   6.176  -8.927
  805    HB   THR 104           HB       THR 104  -4.539   5.120 -11.114
  806    HG1  THR 104           HG1      THR 104  -2.291   4.782 -12.088
  807   1HG2  THR 104          HG23      THR 104  -2.414   7.253 -10.853
  808   2HG2  THR 104          HG22      THR 104  -3.046   6.730 -12.414
  809   3HG2  THR 104          HG21      THR 104  -4.124   7.467 -11.229
  810    H    ALA 105           HN       ALA 105  -5.611   4.238  -8.452
  811    HA   ALA 105           HA       ALA 105  -7.510   6.438  -8.548
  812   1HB   ALA 105           HB3      ALA 105  -7.626   3.602  -7.514
  813   2HB   ALA 105           HB2      ALA 105  -8.972   4.721  -7.296
  814   3HB   ALA 105           HB1      ALA 105  -8.440   4.286  -8.921
  815    H    PHE 106           HN       PHE 106  -5.752   4.730  -5.972
  816    HA   PHE 106           HA       PHE 106  -6.810   6.706  -4.002
  817   1HB   PHE 106           HB2      PHE 106  -5.486   4.003  -3.689
  818   2HB   PHE 106           HB1      PHE 106  -5.749   5.094  -2.328
  819    HD1  PHE 106           HD2      PHE 106  -8.190   6.045  -2.081
  820    HD2  PHE 106           HD1      PHE 106  -7.178   2.508  -4.298
  821    HE1  PHE 106           HE2      PHE 106 -10.537   5.264  -1.906
  822    HE2  PHE 106           HE1      PHE 106  -9.525   1.727  -4.123
  823    HZ   PHE 106           HZ       PHE 106 -11.205   3.105  -2.927
  824    H    LYS 107           HN       LYS 107  -4.547   7.018  -6.068
  825    HA   LYS 107           HA       LYS 107  -2.117   7.243  -4.475
  826   1HB   LYS 107           HB2      LYS 107  -2.702   7.173  -7.197
  827   2HB   LYS 107           HB1      LYS 107  -2.190   8.839  -6.936
  828   1HG   LYS 107           HG2      LYS 107  -0.605   6.512  -5.842
  829   2HG   LYS 107           HG1      LYS 107  -0.348   7.119  -7.478
  830   1HD   LYS 107           HD2      LYS 107  -0.210   8.833  -4.982
  831   2HD   LYS 107           HD1      LYS 107   1.195   8.152  -5.800
  832   1HE   LYS 107           HE2      LYS 107   0.213   9.305  -7.926
  833   2HE   LYS 107           HE1      LYS 107  -0.713  10.268  -6.775
  834   1HZ   LYS 107           HZ2      LYS 107   2.131   9.963  -6.234
  835   2HZ   LYS 107           HZ1      LYS 107   1.717  10.930  -7.568
  836   3HZ   LYS 107           HZ3      LYS 107   1.124  11.314  -6.026
  837    H    ASP 108           HN       ASP 108  -4.836   9.287  -5.189
  838    HA   ASP 108           HA       ASP 108  -3.494  11.788  -4.497
  839   1HB   ASP 108           HB2      ASP 108  -5.593  11.460  -5.991
  840   2HB   ASP 108           HB1      ASP 108  -6.478  11.364  -4.468
  841    H    ASP 109           HN       ASP 109  -3.727   9.364  -2.569
  842    HA   ASP 109           HA       ASP 109  -4.131  10.983  -0.167
  843   1HB   ASP 109           HB2      ASP 109  -6.127   8.922  -1.052
  844   2HB   ASP 109           HB1      ASP 109  -5.807   9.122   0.671
  845    H    VAL 110           HN       VAL 110  -1.929   9.528  -1.293
  846    HA   VAL 110           HA       VAL 110  -1.693   7.090   0.373
  847    HB   VAL 110           HB       VAL 110  -0.935   6.988  -1.974
  848   1HG1  VAL 110          HG11      VAL 110  -0.289   9.382  -2.168
  849   2HG1  VAL 110          HG13      VAL 110   1.109   9.067  -1.140
  850   3HG1  VAL 110          HG12      VAL 110   0.987   8.300  -2.722
  851   1HG2  VAL 110          HG23      VAL 110   0.267   5.797   0.021
  852   2HG2  VAL 110          HG22      VAL 110   1.055   5.815  -1.556
  853   3HG2  VAL 110          HG21      VAL 110   1.568   6.942  -0.301
  854    H    ASP 111           HN       ASP 111   0.052   6.848   1.899
  855    HA   ASP 111           HA       ASP 111   1.441   9.354   2.708
  856   1HB   ASP 111           HB2      ASP 111   0.926   8.809   5.104
  857   2HB   ASP 111           HB1      ASP 111  -0.505   9.235   4.164
  858    H    THR 112           HN       THR 112   1.121   5.839   3.219
  859    HA   THR 112           HA       THR 112   4.039   5.736   3.847
  860    HB   THR 112           HB       THR 112   1.959   3.569   4.257
  861    HG1  THR 112           HG1      THR 112   2.162   5.823   5.520
  862   1HG2  THR 112          HG22      THR 112   4.841   3.951   5.050
  863   2HG2  THR 112          HG21      THR 112   3.782   2.865   5.950
  864   3HG2  THR 112          HG23      THR 112   4.098   2.573   4.240
  865    H    LEU 113           HN       LEU 113   5.340   5.041   2.231
  866    HA   LEU 113           HA       LEU 113   4.108   3.474   0.004
  867   1HB   LEU 113           HB2      LEU 113   6.477   5.344   0.128
  868   2HB   LEU 113           HB1      LEU 113   6.257   4.220  -1.213
  869    HG   LEU 113           HG       LEU 113   4.031   6.060  -0.345
  870   1HD1  LEU 113          HD12      LEU 113   6.053   7.430  -0.833
  871   2HD1  LEU 113          HD11      LEU 113   6.172   6.652  -2.412
  872   3HD1  LEU 113          HD13      LEU 113   4.781   7.669  -2.031
  873   1HD2  LEU 113          HD21      LEU 113   3.537   4.147  -1.855
  874   2HD2  LEU 113          HD23      LEU 113   3.295   5.697  -2.662
  875   3HD2  LEU 113          HD22      LEU 113   4.746   4.750  -2.988
  876    H    LEU 114           HN       LEU 114   4.392   1.346   0.615
  877    HA   LEU 114           HA       LEU 114   7.089   0.507   1.569
  878   1HB   LEU 114           HB2      LEU 114   4.404  -0.906   1.609
  879   2HB   LEU 114           HB1      LEU 114   5.916  -1.637   2.152
  880    HG   LEU 114           HG       LEU 114   4.975   1.009   3.256
  881   1HD1  LEU 114          HD11      LEU 114   4.164  -1.788   4.047
  882   2HD1  LEU 114          HD13      LEU 114   4.171  -0.470   5.219
  883   3HD1  LEU 114          HD12      LEU 114   3.135  -0.379   3.795
  884   1HD2  LEU 114          HD21      LEU 114   6.778  -1.202   4.294
  885   2HD2  LEU 114          HD23      LEU 114   7.314   0.350   3.650
  886   3HD2  LEU 114          HD22      LEU 114   6.400   0.289   5.157
  887    H    VAL 115           HN       VAL 115   8.360   0.081  -0.191
  888    HA   VAL 115           HA       VAL 115   7.163  -1.547  -2.395
  889    HB   VAL 115           HB       VAL 115   7.927   0.691  -3.109
  890   1HG1  VAL 115          HG13      VAL 115   9.664   0.994  -1.369
  891   2HG1  VAL 115          HG12      VAL 115  10.654  -0.236  -2.155
  892   3HG1  VAL 115          HG11      VAL 115  10.308   1.282  -2.985
  893   1HG2  VAL 115          HG22      VAL 115   9.635  -1.631  -4.053
  894   2HG2  VAL 115          HG21      VAL 115   8.107  -1.086  -4.748
  895   3HG2  VAL 115          HG23      VAL 115   9.547  -0.075  -4.879
  896    H    THR 116           HN       THR 116   8.191  -3.454  -2.968
  897    HA   THR 116           HA       THR 116  10.500  -4.266  -1.251
  898    HB   THR 116           HB       THR 116   8.587  -6.083  -2.741
  899    HG1  THR 116           HG1      THR 116   7.973  -4.581  -0.769
  900   1HG2  THR 116          HG22      THR 116  10.932  -6.848  -1.981
  901   2HG2  THR 116          HG21      THR 116  10.299  -6.714  -0.340
  902   3HG2  THR 116          HG23      THR 116   9.557  -7.833  -1.484
  903    H    ARG 117           HN       ARG 117  12.270  -3.720  -2.506
  904    HA   ARG 117           HA       ARG 117  12.275  -4.238  -5.400
  905   1HB   ARG 117           HB2      ARG 117  14.462  -3.260  -3.536
  906   2HB   ARG 117           HB1      ARG 117  14.580  -3.321  -5.296
  907   1HG   ARG 117           HG2      ARG 117  12.579  -1.823  -5.433
  908   2HG   ARG 117           HG1      ARG 117  12.609  -1.683  -3.675
  909   1HD   ARG 117           HD2      ARG 117  13.777   0.226  -4.637
  910   2HD   ARG 117           HD1      ARG 117  14.949  -0.816  -3.830
  911    HE   ARG 117           HE       ARG 117  14.731  -1.558  -6.597
  912   1HH1  ARG 117          HH11      ARG 117  15.984   0.902  -4.488
  913   2HH1  ARG 117          HH12      ARG 117  17.260   1.348  -5.572
  914   1HH2  ARG 117          HH21      ARG 117  16.391  -0.971  -7.993
  915   2HH2  ARG 117          HH22      ARG 117  17.490   0.291  -7.546
  916    H    LEU 118           HN       LEU 118  13.492  -5.846  -6.430
  917    HA   LEU 118           HA       LEU 118  14.689  -7.917  -4.629
  918   1HB   LEU 118           HB2      LEU 118  12.751  -8.117  -6.843
  919   2HB   LEU 118           HB1      LEU 118  14.088  -9.259  -6.962
  920    HG   LEU 118           HG       LEU 118  13.643  -9.898  -4.558
  921   1HD1  LEU 118          HD12      LEU 118  11.131  -8.265  -5.044
  922   2HD1  LEU 118          HD11      LEU 118  11.432  -9.283  -3.637
  923   3HD1  LEU 118          HD13      LEU 118  12.423  -7.852  -3.917
  924   1HD2  LEU 118          HD23      LEU 118  11.384 -10.267  -6.555
  925   2HD2  LEU 118          HD22      LEU 118  12.824 -11.278  -6.419
  926   3HD2  LEU 118          HD21      LEU 118  11.636 -11.255  -5.115
  927    H    ALA 119           HN       ALA 119  16.763  -8.549  -5.113
  928    HA   ALA 119           HA       ALA 119  18.327  -6.968  -6.949
  929   1HB   ALA 119           HB2      ALA 119  19.271  -8.004  -4.898
  930   2HB   ALA 119           HB1      ALA 119  19.028  -9.599  -5.609
  931   3HB   ALA 119           HB3      ALA 119  20.170  -8.472  -6.341
  932    H    GLY 120           HN       GLY 120  16.853 -10.178  -7.111
  933   1HA   GLY 120           HA2      GLY 120  18.127 -10.948  -9.593
  934   2HA   GLY 120           HA1      GLY 120  16.700 -11.712  -8.888
  935    H    SER 121           HN       SER 121  17.627 -10.256 -11.612
  936    HA   SER 121           HA       SER 121  15.417  -8.382 -12.013
  937   1HB   SER 121           HB2      SER 121  16.254  -8.324 -14.361
  938   2HB   SER 121           HB1      SER 121  17.530  -8.019 -13.186
  939    HG   SER 121           HG       SER 121  18.483  -9.611 -14.183
  940    H    PHE 122           HN       PHE 122  13.526  -8.777 -13.183
  941    HA   PHE 122           HA       PHE 122  13.115 -11.447 -14.393
  942   1HB   PHE 122           HB2      PHE 122  11.368 -10.340 -12.173
  943   2HB   PHE 122           HB1      PHE 122  11.002 -11.777 -13.128
  944    HD1  PHE 122           HD1      PHE 122  12.501 -13.777 -13.004
  945    HD2  PHE 122           HD2      PHE 122  12.984 -10.394 -10.402
  946    HE1  PHE 122           HE1      PHE 122  13.910 -15.144 -11.488
  947    HE2  PHE 122           HE2      PHE 122  14.392 -11.761  -8.886
  948    HZ   PHE 122           HZ       PHE 122  14.856 -14.136  -9.429
  949    H    GLU 123           HN       GLU 123  12.430 -10.874 -16.396
  950    HA   GLU 123           HA       GLU 123  11.000  -8.369 -16.875
  951   1HB   GLU 123           HB2      GLU 123  11.638 -10.692 -18.721
  952   2HB   GLU 123           HB1      GLU 123  10.966  -9.145 -19.237
  953   1HG   GLU 123           HG2      GLU 123  12.983  -8.037 -18.159
  954   2HG   GLU 123           HG1      GLU 123  13.673  -9.650 -17.983
  955    H    GLY 124           HN       GLY 124   8.824  -8.197 -17.599
  956   1HA   GLY 124           HA2      GLY 124   7.143 -10.635 -17.569
  957   2HA   GLY 124           HA1      GLY 124   6.759  -9.390 -16.380
  958    H    ASP 125           HN       ASP 125   4.985  -8.315 -17.098
  959    HA   ASP 125           HA       ASP 125   5.075  -7.145 -19.827
  960   1HB   ASP 125           HB2      ASP 125   2.971  -8.997 -18.739
  961   2HB   ASP 125           HB1      ASP 125   2.517  -7.741 -19.891
  962    H    THR 126           HN       THR 126   3.828  -7.165 -16.551
  963    HA   THR 126           HA       THR 126   2.523  -4.527 -16.974
  964    HB   THR 126           HB       THR 126   2.566  -6.028 -14.364
  965    HG1  THR 126           HG1      THR 126   0.705  -7.114 -15.115
  966   1HG2  THR 126          HG22      THR 126   1.630  -3.726 -14.499
  967   2HG2  THR 126          HG21      THR 126   0.489  -4.288 -15.720
  968   3HG2  THR 126          HG23      THR 126   0.406  -4.924 -14.077
  969    H    LYS 127           HN       LYS 127   3.211  -2.676 -15.840
  970    HA   LYS 127           HA       LYS 127   5.787  -2.944 -14.341
  971   1HB   LYS 127           HB2      LYS 127   4.998  -0.838 -16.375
  972   2HB   LYS 127           HB1      LYS 127   6.407  -0.709 -15.322
  973   1HG   LYS 127           HG2      LYS 127   7.173  -2.944 -16.237
  974   2HG   LYS 127           HG1      LYS 127   5.880  -2.818 -17.429
  975   1HD   LYS 127           HD2      LYS 127   7.845  -0.564 -17.060
  976   2HD   LYS 127           HD1      LYS 127   8.244  -1.946 -18.083
  977   1HE   LYS 127           HE2      LYS 127   7.256  -0.425 -19.589
  978   2HE   LYS 127           HE1      LYS 127   5.933  -1.521 -19.190
  979   1HZ   LYS 127           HZ2      LYS 127   6.348   0.872 -17.541
  980   2HZ   LYS 127           HZ1      LYS 127   5.607   1.044 -19.060
  981   3HZ   LYS 127           HZ3      LYS 127   4.911   0.035 -17.888
  982    H    MET 128           HN       MET 128   6.174  -0.869 -12.999
  983    HA   MET 128           HA       MET 128   3.660  -0.273 -11.550
  984   1HB   MET 128           HB2      MET 128   5.804  -0.984 -10.372
  985   2HB   MET 128           HB1      MET 128   6.468   0.588 -10.816
  986   1HG   MET 128           HG2      MET 128   5.559   0.814  -8.600
  987   2HG   MET 128           HG1      MET 128   4.457   1.645  -9.698
  988   1HE   MET 128           HE2      MET 128   3.154   1.633  -7.619
  989   2HE   MET 128           HE1      MET 128   1.872   1.367  -8.798
  990   3HE   MET 128           HE3      MET 128   1.896   0.445  -7.289
  991    H    ILE 129           HN       ILE 129   3.008   1.912 -11.118
  992    HA   ILE 129           HA       ILE 129   3.439   3.736 -13.329
  993    HB   ILE 129           HB       ILE 129   2.036   5.295 -11.956
  994   1HG1  ILE 129          HG12      ILE 129   1.943   2.994  -9.984
  995   2HG1  ILE 129          HG11      ILE 129   2.946   4.426  -9.754
  996   1HG2  ILE 129          HG23      ILE 129   1.214   3.244 -13.400
  997   2HG2  ILE 129          HG22      ILE 129   0.744   2.588 -11.831
  998   3HG2  ILE 129          HG21      ILE 129   0.070   4.121 -12.384
  999   1HD1  ILE 129          HD13      ILE 129   0.870   5.830  -9.978
 1000   2HD1  ILE 129          HD12      ILE 129  -0.073   4.341  -9.995
 1001   3HD1  ILE 129          HD11      ILE 129   0.865   4.775  -8.565
 1002    HA   PRO 130           HA       PRO 130   6.769   6.196 -11.701
 1003   1HB   PRO 130           HB2      PRO 130   5.976   8.697 -12.681
 1004   2HB   PRO 130           HB1      PRO 130   6.895   7.477 -13.572
 1005   1HG   PRO 130           HG2      PRO 130   4.213   8.360 -14.039
 1006   2HG   PRO 130           HG1      PRO 130   5.144   7.157 -14.941
 1007   1HD   PRO 130           HD2      PRO 130   3.029   6.744 -12.966
 1008   2HD   PRO 130           HD1      PRO 130   3.733   5.589 -14.110
 1009    H    LEU 131           HN       LEU 131   6.375   6.175  -9.432
 1010    HA   LEU 131           HA       LEU 131   4.437   8.013  -8.236
 1011   1HB   LEU 131           HB2      LEU 131   6.571   6.212  -7.059
 1012   2HB   LEU 131           HB1      LEU 131   5.499   7.213  -6.080
 1013    HG   LEU 131           HG       LEU 131   4.451   5.254  -8.129
 1014   1HD1  LEU 131          HD12      LEU 131   5.249   4.840  -5.254
 1015   2HD1  LEU 131          HD11      LEU 131   3.950   3.887  -5.970
 1016   3HD1  LEU 131          HD13      LEU 131   5.576   3.812  -6.648
 1017   1HD2  LEU 131          HD22      LEU 131   3.249   6.657  -5.721
 1018   2HD2  LEU 131          HD21      LEU 131   2.888   6.989  -7.415
 1019   3HD2  LEU 131          HD23      LEU 131   2.409   5.451  -6.697
 1020    H    ASN 132           HN       ASN 132   4.929   9.934  -7.134
 1021    HA   ASN 132           HA       ASN 132   7.439  11.238  -7.938
 1022   1HB   ASN 132           HB2      ASN 132   5.097  12.329  -7.866
 1023   2HB   ASN 132           HB1      ASN 132   5.336  12.413  -6.120
 1024   1HD2  ASN 132          HD22      ASN 132   6.975  15.497  -6.653
 1025   2HD2  ASN 132          HD21      ASN 132   5.683  14.684  -5.912
 1026    H    TRP 133           HN       TRP 133   8.941   9.962  -6.678
 1027    HA   TRP 133           HA       TRP 133   8.718   9.740  -3.800
 1028   1HB   TRP 133           HB2      TRP 133  11.160   9.473  -5.582
 1029   2HB   TRP 133           HB1      TRP 133  11.041   8.931  -3.907
 1030    HD1  TRP 133           HD1      TRP 133   9.764   8.140  -7.418
 1031    HE1  TRP 133           HE1      TRP 133   8.767   5.762  -7.423
 1032    HE3  TRP 133           HE3      TRP 133   9.955   7.093  -2.423
 1033    HZ2  TRP 133           HZ2      TRP 133   8.135   3.690  -5.555
 1034    HZ3  TRP 133           HZ3      TRP 133   9.151   4.913  -1.564
 1035    HH2  TRP 133           HH2      TRP 133   8.242   3.211  -3.122
 1036    H    ASP 134           HN       ASP 134   9.443  12.364  -5.791
 1037    HA   ASP 134           HA       ASP 134  11.532  13.674  -4.346
 1038   1HB   ASP 134           HB2      ASP 134   9.430  14.480  -6.290
 1039   2HB   ASP 134           HB1      ASP 134  10.108  15.768  -5.294
 1040    H    ASP 135           HN       ASP 135   8.061  13.441  -3.803
 1041    HA   ASP 135           HA       ASP 135   8.258  15.334  -1.517
 1042   1HB   ASP 135           HB2      ASP 135   5.761  15.089  -1.459
 1043   2HB   ASP 135           HB1      ASP 135   6.364  15.705  -2.997
 1044    H    PHE 136           HN       PHE 136   9.495  12.667  -1.439
 1045    HA   PHE 136           HA       PHE 136   8.051  11.634   0.952
 1046   1HB   PHE 136           HB2      PHE 136   8.823  10.109  -1.522
 1047   2HB   PHE 136           HB1      PHE 136   8.804   9.289   0.039
 1048    HD1  PHE 136           HD1      PHE 136   6.685   9.304   1.419
 1049    HD2  PHE 136           HD2      PHE 136   6.800  10.645  -2.660
 1050    HE1  PHE 136           HE1      PHE 136   4.218   9.091   1.279
 1051    HE2  PHE 136           HE2      PHE 136   4.334  10.432  -2.800
 1052    HZ   PHE 136           HZ       PHE 136   3.043   9.655  -0.831
 1053    H    THR 137           HN       THR 137   9.541  10.056   2.170
 1054    HA   THR 137           HA       THR 137  12.425  10.504   1.708
 1055    HB   THR 137           HB       THR 137  11.291  11.130   4.432
 1056    HG1  THR 137           HG1      THR 137  11.003  13.176   3.851
 1057   1HG2  THR 137          HG21      THR 137  13.705  10.649   4.206
 1058   2HG2  THR 137          HG23      THR 137  13.840  11.925   2.996
 1059   3HG2  THR 137          HG22      THR 137  13.425  12.329   4.662
 1060    H    LYS 138           HN       LYS 138  13.706   8.889   2.694
 1061    HA   LYS 138           HA       LYS 138  12.228   6.470   3.490
 1062   1HB   LYS 138           HB2      LYS 138  14.296   6.556   1.942
 1063   2HB   LYS 138           HB1      LYS 138  15.231   6.773   3.421
 1064   1HG   LYS 138           HG2      LYS 138  14.042   4.695   4.317
 1065   2HG   LYS 138           HG1      LYS 138  13.477   4.428   2.667
 1066   1HD   LYS 138           HD2      LYS 138  16.403   4.841   3.299
 1067   2HD   LYS 138           HD1      LYS 138  15.656   3.243   3.342
 1068   1HE   LYS 138           HE2      LYS 138  16.448   3.367   1.139
 1069   2HE   LYS 138           HE1      LYS 138  14.765   3.866   0.967
 1070   1HZ   LYS 138           HZ3      LYS 138  16.491   6.051   1.614
 1071   2HZ   LYS 138           HZ2      LYS 138  16.950   5.285   0.168
 1072   3HZ   LYS 138           HZ1      LYS 138  15.375   5.895   0.346
 1073    H    VAL 139           HN       VAL 139  11.683   6.202   5.591
 1074    HA   VAL 139           HA       VAL 139  13.272   7.569   7.693
 1075    HB   VAL 139           HB       VAL 139  11.380   6.868   9.183
 1076   1HG1  VAL 139          HG12      VAL 139  10.819   8.431   6.656
 1077   2HG1  VAL 139          HG11      VAL 139   9.645   8.313   7.967
 1078   3HG1  VAL 139          HG13      VAL 139  11.217   9.058   8.255
 1079   1HG2  VAL 139          HG23      VAL 139  10.336   5.759   6.561
 1080   2HG2  VAL 139          HG22      VAL 139  10.639   4.865   8.052
 1081   3HG2  VAL 139          HG21      VAL 139   9.318   6.031   7.975
 1082    H    SER 140           HN       SER 140  12.306   4.344   6.614
 1083    HA   SER 140           HA       SER 140  14.517   3.192   8.201
 1084   1HB   SER 140           HB2      SER 140  12.373   3.155   9.603
 1085   2HB   SER 140           HB1      SER 140  11.738   2.015   8.419
 1086    HG   SER 140           HG       SER 140  14.198   1.702   9.805
 1087    H    SER 141           HN       SER 141  14.624   0.726   7.663
 1088    HA   SER 141           HA       SER 141  13.416  -0.148   5.170
 1089   1HB   SER 141           HB2      SER 141  15.118   1.423   4.291
 1090   2HB   SER 141           HB1      SER 141  16.370   0.546   5.165
 1091    HG   SER 141           HG       SER 141  15.648   0.044   2.783
 1092    H    ARG 142           HN       ARG 142  13.230  -2.313   5.428
 1093    HA   ARG 142           HA       ARG 142  15.103  -3.688   7.290
 1094   1HB   ARG 142           HB2      ARG 142  12.540  -3.814   7.533
 1095   2HB   ARG 142           HB1      ARG 142  12.579  -4.855   6.109
 1096   1HG   ARG 142           HG2      ARG 142  12.705  -6.375   7.910
 1097   2HG   ARG 142           HG1      ARG 142  14.383  -6.199   7.397
 1098   1HD   ARG 142           HD2      ARG 142  14.453  -5.969   9.758
 1099   2HD   ARG 142           HD1      ARG 142  14.540  -4.316   9.145
 1100    HE   ARG 142           HE       ARG 142  11.797  -5.030   9.593
 1101   1HH1  ARG 142          HH21      ARG 142  14.743  -4.261  11.263
 1102   2HH1  ARG 142          HH22      ARG 142  13.929  -3.624  12.653
 1103   1HH2  ARG 142          HH11      ARG 142  10.751  -4.201  11.401
 1104   2HH2  ARG 142          HH12      ARG 142  11.680  -3.591  12.729
 1105    H    THR 143           HN       THR 143  16.860  -4.393   6.139
 1106    HA   THR 143           HA       THR 143  16.545  -5.406   3.390
 1107    HB   THR 143           HB       THR 143  19.070  -5.489   5.048
 1108    HG1  THR 143           HG1      THR 143  18.737  -3.404   5.176
 1109   1HG2  THR 143          HG23      THR 143  18.413  -5.349   2.099
 1110   2HG2  THR 143          HG22      THR 143  20.036  -5.069   2.731
 1111   3HG2  THR 143          HG21      THR 143  19.260  -6.636   2.956
 1112    H    VAL 144           HN       VAL 144  17.102  -7.579   2.784
 1113    HA   VAL 144           HA       VAL 144  17.582  -9.570   4.890
 1114    HB   VAL 144           HB       VAL 144  15.131  -9.291   4.977
 1115   1HG1  VAL 144          HG13      VAL 144  14.898  -8.498   2.609
 1116   2HG1  VAL 144          HG12      VAL 144  15.156 -10.157   2.072
 1117   3HG1  VAL 144          HG11      VAL 144  13.740  -9.755   3.043
 1118   1HG2  VAL 144          HG23      VAL 144  16.344 -11.589   5.119
 1119   2HG2  VAL 144          HG22      VAL 144  14.594 -11.585   4.904
 1120   3HG2  VAL 144          HG21      VAL 144  15.651 -11.884   3.524
 1121    H    GLU 145           HN       GLU 145  18.787 -11.223   4.052
 1122    HA   GLU 145           HA       GLU 145  19.003 -11.379   1.071
 1123   1HB   GLU 145           HB2      GLU 145  21.061 -10.692   2.424
 1124   2HB   GLU 145           HB1      GLU 145  21.067 -12.335   3.069
 1125   1HG   GLU 145           HG2      GLU 145  21.271 -13.262   0.823
 1126   2HG   GLU 145           HG1      GLU 145  21.140 -11.650   0.115
 1127    H    ASP 146           HN       ASP 146  18.190 -13.213   0.199
 1128    HA   ASP 146           HA       ASP 146  17.410 -15.450   1.933
 1129   1HB   ASP 146           HB2      ASP 146  16.297 -14.423  -0.311
 1130   2HB   ASP 146           HB1      ASP 146  17.256 -15.720  -1.025
 1131    H    THR 147           HN       THR 147  17.869 -17.711   0.574
 1132    HA   THR 147           HA       THR 147  20.641 -18.264   1.017
 1133    HB   THR 147           HB       THR 147  20.127 -20.419  -0.199
 1134    HG1  THR 147           HG1      THR 147  18.451 -19.219  -1.480
 1135   1HG2  THR 147          HG23      THR 147  19.685 -19.981   2.266
 1136   2HG2  THR 147          HG22      THR 147  18.006 -19.674   1.823
 1137   3HG2  THR 147          HG21      THR 147  18.716 -21.264   1.541
 1138    H    ASN 148           HN       ASN 148  18.790 -17.582  -1.939
 1139    HA   ASN 148           HA       ASN 148  21.255 -17.753  -3.569
 1140   1HB   ASN 148           HB2      ASN 148  18.643 -18.376  -4.125
 1141   2HB   ASN 148           HB1      ASN 148  18.766 -16.763  -4.827
 1142   1HD2  ASN 148          HD22      ASN 148  20.214 -18.218  -7.693
 1143   2HD2  ASN 148          HD21      ASN 148  19.000 -17.220  -7.050
 1144    HA   PRO 149           HA       PRO 149  21.939 -13.353  -3.530
 1145   1HB   PRO 149           HB2      PRO 149  23.193 -13.169  -6.039
 1146   2HB   PRO 149           HB1      PRO 149  23.984 -13.516  -4.497
 1147   1HG   PRO 149           HG2      PRO 149  23.616 -15.270  -6.722
 1148   2HG   PRO 149           HG1      PRO 149  24.406 -15.612  -5.178
 1149   1HD   PRO 149           HD2      PRO 149  21.752 -16.405  -6.098
 1150   2HD   PRO 149           HD1      PRO 149  22.679 -16.997  -4.710
 1151    H    ALA 150           HN       ALA 150  20.255 -14.846  -6.198
 1152    HA   ALA 150           HA       ALA 150  19.399 -12.293  -7.370
 1153   1HB   ALA 150           HB2      ALA 150  19.742 -14.358  -8.750
 1154   2HB   ALA 150           HB1      ALA 150  18.373 -15.095  -7.917
 1155   3HB   ALA 150           HB3      ALA 150  18.129 -13.669  -8.927
 1156    H    LEU 151           HN       LEU 151  18.273 -14.539  -4.969
 1157    HA   LEU 151           HA       LEU 151  15.517 -13.484  -5.018
 1158   1HB   LEU 151           HB2      LEU 151  16.940 -15.559  -3.341
 1159   2HB   LEU 151           HB1      LEU 151  15.300 -15.021  -2.975
 1160    HG   LEU 151           HG       LEU 151  16.029 -15.944  -5.749
 1161   1HD1  LEU 151          HD13      LEU 151  16.666 -17.713  -4.075
 1162   2HD1  LEU 151          HD12      LEU 151  14.994 -17.712  -3.514
 1163   3HD1  LEU 151          HD11      LEU 151  15.369 -18.203  -5.165
 1164   1HD2  LEU 151          HD22      LEU 151  13.504 -15.670  -4.106
 1165   2HD2  LEU 151          HD21      LEU 151  13.903 -14.871  -5.625
 1166   3HD2  LEU 151          HD23      LEU 151  13.547 -16.598  -5.604
 1167    H    THR 152           HN       THR 152  18.041 -11.880  -4.251
 1168    HA   THR 152           HA       THR 152  17.590 -11.239  -1.424
 1169    HB   THR 152           HB       THR 152  19.253  -9.687  -3.421
 1170    HG1  THR 152           HG1      THR 152  19.543 -12.202  -2.572
 1171   1HG2  THR 152          HG22      THR 152  19.163  -9.943  -0.416
 1172   2HG2  THR 152          HG21      THR 152  20.588  -9.323  -1.250
 1173   3HG2  THR 152          HG23      THR 152  19.046  -8.479  -1.393
 1174    H    HIS 153           HN       HIS 153  16.600  -9.345  -0.651
 1175    HA   HIS 153           HA       HIS 153  15.616  -7.305  -2.508
 1176   1HB   HIS 153           HB2      HIS 153  13.221  -7.642  -1.831
 1177   2HB   HIS 153           HB1      HIS 153  13.864  -8.958  -2.812
 1178    HD1  HIS 153           HD1      HIS 153  14.865 -11.047  -1.300
 1179    HD2  HIS 153           HD2      HIS 153  12.114  -8.516   0.544
 1180    HE1  HIS 153           HE1      HIS 153  13.977 -12.300   0.714
 1181    H    THR 154           HN       THR 154  14.500  -5.538  -1.299
 1182    HA   THR 154           HA       THR 154  15.094  -5.553   1.625
 1183    HB   THR 154           HB       THR 154  15.702  -3.220  -0.212
 1184    HG1  THR 154           HG1      THR 154  17.033  -5.455   0.065
 1185   1HG2  THR 154          HG22      THR 154  15.186  -3.086   2.396
 1186   2HG2  THR 154          HG21      THR 154  16.865  -3.612   2.510
 1187   3HG2  THR 154          HG23      THR 154  16.465  -2.116   1.666
 1188    H    TYR 155           HN       TYR 155  13.503  -4.574   2.842
 1189    HA   TYR 155           HA       TYR 155  11.077  -3.692   1.406
 1190   1HB   TYR 155           HB2      TYR 155  11.653  -4.171   4.344
 1191   2HB   TYR 155           HB1      TYR 155  10.089  -3.648   3.719
 1192    HD1  TYR 155           HD1      TYR 155   8.918  -5.109   1.985
 1193    HD2  TYR 155           HD2      TYR 155  12.290  -6.452   4.283
 1194    HE1  TYR 155           HE1      TYR 155   8.341  -7.463   1.455
 1195    HE2  TYR 155           HE2      TYR 155  11.713  -8.806   3.753
 1196    HH   TYR 155           HH       TYR 155  10.179 -10.164   2.857
 1197    H    GLU 156           HN       GLU 156  11.472  -1.608   0.658
 1198    HA   GLU 156           HA       GLU 156  12.734   0.409   2.363
 1199   1HB   GLU 156           HB2      GLU 156  11.537   0.386  -0.397
 1200   2HB   GLU 156           HB1      GLU 156  11.885   1.920   0.400
 1201   1HG   GLU 156           HG2      GLU 156  13.850   1.386  -0.845
 1202   2HG   GLU 156           HG1      GLU 156  14.232   1.002   0.834
 1203    H    VAL 157           HN       VAL 157  11.682   1.880   3.641
 1204    HA   VAL 157           HA       VAL 157   8.695   1.965   3.470
 1205    HB   VAL 157           HB       VAL 157  10.368   2.224   5.987
 1206   1HG1  VAL 157          HG13      VAL 157   7.411   2.194   5.382
 1207   2HG1  VAL 157          HG12      VAL 157   8.024   1.771   6.981
 1208   3HG1  VAL 157          HG11      VAL 157   8.327   3.376   6.316
 1209   1HG2  VAL 157          HG22      VAL 157   8.993  -0.113   4.679
 1210   2HG2  VAL 157          HG21      VAL 157  10.578  -0.049   5.449
 1211   3HG2  VAL 157          HG23      VAL 157   9.118  -0.040   6.437
 1212    H    TRP 158           HN       TRP 158   8.486   3.908   2.371
 1213    HA   TRP 158           HA       TRP 158  10.016   6.262   3.345
 1214   1HB   TRP 158           HB2      TRP 158   8.226   5.896   0.923
 1215   2HB   TRP 158           HB1      TRP 158   9.092   7.380   1.318
 1216    HD1  TRP 158           HD1      TRP 158   9.985   3.631   0.888
 1217    HE1  TRP 158           HE1      TRP 158  12.254   3.489  -0.329
 1218    HE3  TRP 158           HE3      TRP 158  11.040   8.605   0.402
 1219    HZ2  TRP 158           HZ2      TRP 158  14.252   5.252  -1.371
 1220    HZ3  TRP 158           HZ3      TRP 158  13.129   9.344  -0.706
 1221    HH2  TRP 158           HH2      TRP 158  14.735   7.676  -1.593
 1222    H    GLN 159           HN       GLN 159   8.747   8.327   3.598
 1223    HA   GLN 159           HA       GLN 159   5.916   7.895   4.403
 1224   1HB   GLN 159           HB2      GLN 159   8.143   8.973   6.138
 1225   2HB   GLN 159           HB1      GLN 159   6.452   9.366   6.451
 1226   1HG   GLN 159           HG2      GLN 159   7.306   6.502   6.081
 1227   2HG   GLN 159           HG1      GLN 159   7.481   7.293   7.648
 1228   1HE2  GLN 159          HE22      GLN 159   3.929   5.810   6.772
 1229   2HE2  GLN 159          HE21      GLN 159   5.404   5.292   6.112
 1230    H    LYS 160           HN       LYS 160   4.626   9.751   4.153
 1231    HA   LYS 160           HA       LYS 160   5.534  11.714   2.256
 1232   1HB   LYS 160           HB2      LYS 160   3.117  10.910   2.745
 1233   2HB   LYS 160           HB1      LYS 160   3.144  12.084   4.061
 1234   1HG   LYS 160           HG2      LYS 160   3.815  13.841   2.395
 1235   2HG   LYS 160           HG1      LYS 160   3.575  12.650   1.116
 1236   1HD   LYS 160           HD2      LYS 160   1.516  13.812   1.210
 1237   2HD   LYS 160           HD1      LYS 160   1.216  12.329   2.117
 1238   1HE   LYS 160           HE2      LYS 160   1.825  13.611   4.217
 1239   2HE   LYS 160           HE1      LYS 160   1.819  15.078   3.237
 1240   1HZ   LYS 160           HZ1      LYS 160  -0.492  13.245   3.226
 1241   2HZ   LYS 160           HZ3      LYS 160  -0.320  14.411   4.446
 1242   3HZ   LYS 160           HZ2      LYS 160  -0.436  14.894   2.821
 1243    H    LYS 161           HN       LYS 161   6.931  13.325   2.744
 1244    HA   LYS 161           HA       LYS 161   6.456  14.986   5.133
 1245   1HB   LYS 161           HB2      LYS 161   8.045  13.040   5.740
 1246   2HB   LYS 161           HB1      LYS 161   9.221  13.852   4.707
 1247   1HG   LYS 161           HG2      LYS 161   9.644  14.702   6.884
 1248   2HG   LYS 161           HG1      LYS 161   8.716  15.968   6.078
 1249   1HD   LYS 161           HD2      LYS 161   6.756  15.468   7.262
 1250   2HD   LYS 161           HD1      LYS 161   7.299  13.838   7.661
 1251   1HE   LYS 161           HE2      LYS 161   9.105  14.874   9.084
 1252   2HE   LYS 161           HE1      LYS 161   8.346  16.441   8.806
 1253   1HZ   LYS 161           HZ3      LYS 161   6.243  15.026   9.570
 1254   2HZ   LYS 161           HZ2      LYS 161   7.453  14.206  10.436
 1255   3HZ   LYS 161           HZ1      LYS 161   7.228  15.875  10.660
 1256    H    ALA 162           HN       ALA 162   7.486  17.058   4.954
 1257    HA   ALA 162           HA       ALA 162   7.921  17.921   2.207
 1258   1HB   ALA 162           HB3      ALA 162   8.275  19.405   4.830
 1259   2HB   ALA 162           HB2      ALA 162   8.296  20.147   3.231
 1260   3HB   ALA 162           HB1      ALA 162   6.818  19.398   3.837
 1261   1H9   TMQ 170           H91      TMQ 170   0.016  -9.839  -6.461
 1262   2H9   TMQ 170           H92      TMQ 170  -0.914 -10.569  -5.145
 1263    HN1  TMQ 170           H1N      TMQ 170   0.753 -11.932  -6.994
 1264   1H17  TMQ 170           HM1      TMQ 170  -0.539  -7.091  -4.294
 1265   2H17  TMQ 170           HM2      TMQ 170  -1.214  -8.156  -3.052
 1266   3H17  TMQ 170           HM3      TMQ 170  -1.212  -8.656  -4.743
 1267   1H21  TMQ 170          HW11      TMQ 170  -2.330 -12.324  -2.235
 1268   2H21  TMQ 170          HW12      TMQ 170  -0.728 -12.252  -1.485
 1269   3H21  TMQ 170          HW13      TMQ 170  -2.099 -12.915  -0.582
 1270   1H22  TMQ 170           HI1      TMQ 170   1.273 -17.258  -1.312
 1271   2H22  TMQ 170           HI2      TMQ 170   1.379 -15.492  -1.392
 1272   3H22  TMQ 170           HI3      TMQ 170   2.197 -16.484  -2.610
 1273   1H23  TMQ 170          HW21      TMQ 170   1.272 -16.359  -7.052
 1274   2H23  TMQ 170          HW22      TMQ 170   2.544 -17.521  -6.643
 1275   3H23  TMQ 170          HW23      TMQ 170   2.899 -15.786  -6.655
 1276   1HN2  TMQ 170          HN21      TMQ 170   5.561  -7.518  -0.144
 1277   2HN2  TMQ 170          HN22      TMQ 170   4.550  -6.225   0.410
 1278   1HN5  TMQ 170          HN41      TMQ 170  -0.349  -6.479  -2.418
 1279   2HN5  TMQ 170          HN42      TMQ 170   0.407  -5.531  -1.213
 1280    HN   TMQ 170           H1       TMQ 170   4.798  -8.947  -1.758
 1281    H7   TMQ 170           H7       TMQ 170   2.547 -11.406  -5.039
 1282    H8   TMQ 170           H8       TMQ 170   4.212 -10.570  -3.443
 1283    H12  TMQ 170           HP2      TMQ 170  -1.033 -12.048  -3.840
 1284    H16  TMQ 170           HP6      TMQ 170   1.730 -14.085  -6.463
   
  No H/Q in entry =        1284
  Start of MODEL    5
    1   1H    THR   1           HT1      THR   1  -3.070   5.869   5.356
    2   2H    THR   1           HT3      THR   1  -3.672   7.022   4.267
    3   3H    THR   1           HT2      THR   1  -4.741   5.973   5.068
    4    HA   THR   1           HA       THR   1  -4.340   4.247   3.699
    5    HB   THR   1           HB       THR   1  -3.188   6.349   1.866
    6    HG1  THR   1           HG1      THR   1  -5.117   6.950   3.275
    7   1HG2  THR   1          HG23      THR   1  -3.478   4.045   1.020
    8   2HG2  THR   1          HG22      THR   1  -5.181   4.098   1.474
    9   3HG2  THR   1          HG21      THR   1  -4.571   5.167   0.210
   10    H    ALA   2           HN       ALA   2  -2.821   2.776   2.819
   11    HA   ALA   2           HA       ALA   2   0.049   3.557   2.951
   12   1HB   ALA   2           HB3      ALA   2  -1.163   1.106   4.267
   13   2HB   ALA   2           HB2      ALA   2   0.566   1.422   4.121
   14   3HB   ALA   2           HB1      ALA   2  -0.445   2.485   5.100
   15    H    PHE   3           HN       PHE   3   1.173   2.770   1.223
   16    HA   PHE   3           HA       PHE   3  -0.262   0.949  -0.635
   17   1HB   PHE   3           HB2      PHE   3   2.045   2.864  -0.913
   18   2HB   PHE   3           HB1      PHE   3   1.805   1.588  -2.107
   19    HD1  PHE   3           HD1      PHE   3  -0.470   3.893  -0.193
   20    HD2  PHE   3           HD2      PHE   3   0.725   2.341  -4.016
   21    HE1  PHE   3           HE1      PHE   3  -2.235   5.244  -1.294
   22    HE2  PHE   3           HE2      PHE   3  -1.039   3.693  -5.116
   23    HZ   PHE   3           HZ       PHE   3  -2.518   5.144  -3.755
   24    H    LEU   4           HN       LEU   4   1.044  -0.805  -1.665
   25    HA   LEU   4           HA       LEU   4   3.514  -1.714  -0.484
   26   1HB   LEU   4           HB2      LEU   4   1.922  -2.198   1.392
   27   2HB   LEU   4           HB1      LEU   4   1.022  -3.256   0.304
   28    HG   LEU   4           HG       LEU   4   3.363  -4.377  -0.097
   29   1HD1  LEU   4          HD12      LEU   4   3.751  -2.699   2.358
   30   2HD1  LEU   4          HD11      LEU   4   4.531  -4.278   2.273
   31   3HD1  LEU   4          HD13      LEU   4   4.887  -3.052   1.057
   32   1HD2  LEU   4          HD22      LEU   4   1.601  -4.662   2.342
   33   2HD2  LEU   4          HD21      LEU   4   1.625  -5.660   0.888
   34   3HD2  LEU   4          HD23      LEU   4   2.952  -5.757   2.046
   35    H    TRP   5           HN       TRP   5   4.319  -2.389  -2.432
   36    HA   TRP   5           HA       TRP   5   2.840  -4.546  -3.838
   37   1HB   TRP   5           HB2      TRP   5   3.234  -3.483  -6.025
   38   2HB   TRP   5           HB1      TRP   5   2.253  -2.443  -4.996
   39    HD1  TRP   5           HD1      TRP   5   5.294  -2.429  -7.062
   40    HE1  TRP   5           HE1      TRP   5   6.668  -0.285  -6.669
   41    HE3  TRP   5           HE3      TRP   5   2.995  -0.661  -2.854
   42    HZ2  TRP   5           HZ2      TRP   5   6.781   1.889  -4.819
   43    HZ3  TRP   5           HZ3      TRP   5   3.761   1.445  -1.799
   44    HH2  TRP   5           HH2      TRP   5   5.647   2.723  -2.775
   45    H    ALA   6           HN       ALA   6   4.210  -6.002  -4.952
   46    HA   ALA   6           HA       ALA   6   7.068  -5.825  -4.154
   47   1HB   ALA   6           HB1      ALA   6   5.392  -8.100  -5.255
   48   2HB   ALA   6           HB3      ALA   6   7.120  -8.225  -4.926
   49   3HB   ALA   6           HB2      ALA   6   5.991  -7.925  -3.605
   50    H    GLN   7           HN       GLN   7   8.395  -4.902  -5.636
   51    HA   GLN   7           HA       GLN   7   7.997  -5.602  -8.509
   52   1HB   GLN   7           HB2      GLN   7   8.596  -3.234  -9.092
   53   2HB   GLN   7           HB1      GLN   7   7.052  -3.376  -8.251
   54   1HG   GLN   7           HG2      GLN   7   7.917  -2.527  -6.245
   55   2HG   GLN   7           HG1      GLN   7   9.580  -2.916  -6.687
   56   1HE2  GLN   7          HE22      GLN   7  10.142   0.195  -8.240
   57   2HE2  GLN   7          HE21      GLN   7  10.793  -1.277  -7.700
   58    H    ASP   8           HN       ASP   8   9.957  -5.576  -9.747
   59    HA   ASP   8           HA       ASP   8  12.402  -5.816  -8.062
   60   1HB   ASP   8           HB2      ASP   8  13.349  -6.954 -10.114
   61   2HB   ASP   8           HB1      ASP   8  11.978  -7.791  -9.385
   62    H    ARG   9           HN       ARG   9  14.467  -5.085  -9.265
   63    HA   ARG   9           HA       ARG   9  14.323  -2.285  -9.771
   64   1HB   ARG   9           HB2      ARG   9  16.669  -2.554 -10.615
   65   2HB   ARG   9           HB1      ARG   9  16.403  -3.313  -9.044
   66   1HG   ARG   9           HG2      ARG   9  16.019  -5.491 -10.208
   67   2HG   ARG   9           HG1      ARG   9  16.430  -4.709 -11.735
   68   1HD   ARG   9           HD2      ARG   9  18.276  -4.750  -9.334
   69   2HD   ARG   9           HD1      ARG   9  18.355  -5.929 -10.643
   70    HE   ARG   9           HE       ARG   9  19.273  -3.164 -10.771
   71   1HH1  ARG   9          HH11      ARG   9  18.056  -5.879 -12.565
   72   2HH1  ARG   9          HH12      ARG   9  18.767  -5.362 -14.058
   73   1HH2  ARG   9          HH21      ARG   9  20.190  -2.505 -12.714
   74   2HH2  ARG   9          HH22      ARG   9  19.969  -3.461 -14.140
   75    H    ASP  10           HN       ASP  10  13.677  -4.969 -11.827
   76    HA   ASP  10           HA       ASP  10  14.262  -3.621 -14.346
   77   1HB   ASP  10           HB2      ASP  10  12.795  -6.148 -13.590
   78   2HB   ASP  10           HB1      ASP  10  12.787  -5.548 -15.250
   79    H    GLY  11           HN       GLY  11  12.210  -2.610 -12.168
   80   1HA   GLY  11           HA2      GLY  11  10.243  -1.334 -12.232
   81   2HA   GLY  11           HA1      GLY  11  10.495  -1.212 -13.973
   82    H    LEU  12           HN       LEU  12  10.067  -4.220 -12.157
   83    HA   LEU  12           HA       LEU  12   7.558  -4.685 -13.721
   84   1HB   LEU  12           HB2      LEU  12   9.729  -6.205 -13.903
   85   2HB   LEU  12           HB1      LEU  12   9.072  -6.923 -12.431
   86    HG   LEU  12           HG       LEU  12   6.835  -7.042 -13.735
   87   1HD1  LEU  12          HD12      LEU  12   7.689  -5.571 -15.593
   88   2HD1  LEU  12          HD11      LEU  12   8.772  -6.881 -16.062
   89   3HD1  LEU  12          HD13      LEU  12   7.025  -7.107 -16.149
   90   1HD2  LEU  12          HD22      LEU  12   8.571  -8.914 -13.168
   91   2HD2  LEU  12          HD21      LEU  12   7.345  -9.241 -14.393
   92   3HD2  LEU  12          HD23      LEU  12   8.986  -8.815 -14.879
   93    H    ILE  13           HN       ILE  13   5.936  -6.082 -12.558
   94    HA   ILE  13           HA       ILE  13   6.080  -5.836  -9.593
   95    HB   ILE  13           HB       ILE  13   3.690  -5.074  -9.590
   96   1HG1  ILE  13          HG12      ILE  13   4.176  -4.581 -12.544
   97   2HG1  ILE  13          HG11      ILE  13   3.227  -5.932 -11.920
   98   1HG2  ILE  13          HG22      ILE  13   5.824  -3.399 -10.924
   99   2HG2  ILE  13          HG21      ILE  13   4.248  -2.734 -10.497
  100   3HG2  ILE  13          HG23      ILE  13   5.308  -3.366  -9.238
  101   1HD1  ILE  13          HD11      ILE  13   1.833  -4.192 -10.668
  102   2HD1  ILE  13          HD13      ILE  13   2.641  -2.977 -11.658
  103   3HD1  ILE  13          HD12      ILE  13   1.645  -4.216 -12.421
  104    H    GLY  14           HN       GLY  14   4.747  -7.365 -12.459
  105   1HA   GLY  14           HA2      GLY  14   4.472  -9.904 -11.098
  106   2HA   GLY  14           HA1      GLY  14   2.897  -9.164 -11.394
  107    H    LYS  15           HN       LYS  15   2.664 -11.160 -12.794
  108    HA   LYS  15           HA       LYS  15   2.970 -10.466 -15.565
  109   1HB   LYS  15           HB2      LYS  15   5.344 -11.135 -14.944
  110   2HB   LYS  15           HB1      LYS  15   4.727 -12.763 -14.665
  111   1HG   LYS  15           HG2      LYS  15   3.710 -12.532 -17.054
  112   2HG   LYS  15           HG1      LYS  15   4.877 -11.223 -17.247
  113   1HD   LYS  15           HD2      LYS  15   6.712 -12.751 -16.664
  114   2HD   LYS  15           HD1      LYS  15   5.558 -14.063 -16.429
  115   1HE   LYS  15           HE2      LYS  15   4.812 -13.539 -18.866
  116   2HE   LYS  15           HE1      LYS  15   6.356 -12.696 -18.991
  117   1HZ   LYS  15           HZ1      LYS  15   6.322 -15.405 -17.874
  118   2HZ   LYS  15           HZ3      LYS  15   6.161 -15.226 -19.553
  119   3HZ   LYS  15           HZ2      LYS  15   7.536 -14.616 -18.762
  120    H    ASP  16           HN       ASP  16   1.203 -11.392 -16.453
  121    HA   ASP  16           HA       ASP  16  -0.565 -12.883 -16.830
  122   1HB   ASP  16           HB2      ASP  16   1.556 -14.812 -15.847
  123   2HB   ASP  16           HB1      ASP  16   0.001 -15.322 -16.505
  124    H    GLY  17           HN       GLY  17  -0.440 -11.510 -14.269
  125   1HA   GLY  17           HA2      GLY  17  -1.993 -11.565 -12.452
  126   2HA   GLY  17           HA1      GLY  17  -2.265 -13.279 -12.767
  127    H    HIS  18           HN       HIS  18  -0.078 -14.599 -12.455
  128    HA   HIS  18           HA       HIS  18   0.676 -14.230  -9.666
  129   1HB   HIS  18           HB2      HIS  18   2.142 -16.222 -10.093
  130   2HB   HIS  18           HB1      HIS  18   0.456 -16.491 -10.534
  131    HD1  HIS  18           HD1      HIS  18   3.810 -15.683 -12.113
  132    HD2  HIS  18           HD2      HIS  18   0.039 -17.055 -13.243
  133    HE1  HIS  18           HE1      HIS  18   3.998 -16.377 -14.541
  134    H    LEU  19           HN       LEU  19   3.130 -14.369  -9.129
  135    HA   LEU  19           HA       LEU  19   4.437 -12.117 -10.504
  136   1HB   LEU  19           HB2      LEU  19   5.197 -13.765  -8.076
  137   2HB   LEU  19           HB1      LEU  19   6.180 -12.441  -8.705
  138    HG   LEU  19           HG       LEU  19   3.271 -11.959  -8.156
  139   1HD1  LEU  19          HD13      LEU  19   5.494 -12.115  -6.105
  140   2HD1  LEU  19          HD12      LEU  19   4.001 -11.218  -5.832
  141   3HD1  LEU  19          HD11      LEU  19   3.947 -12.963  -6.084
  142   1HD2  LEU  19          HD23      LEU  19   5.071 -10.369  -9.249
  143   2HD2  LEU  19          HD22      LEU  19   3.929  -9.719  -8.073
  144   3HD2  LEU  19          HD21      LEU  19   5.574 -10.117  -7.577
  145    HA   PRO  20           HA       PRO  20   7.214 -14.628 -12.911
  146   1HB   PRO  20           HB2      PRO  20   9.349 -12.825 -13.038
  147   2HB   PRO  20           HB1      PRO  20   7.941 -12.839 -14.108
  148   1HG   PRO  20           HG2      PRO  20   8.648 -10.889 -12.128
  149   2HG   PRO  20           HG1      PRO  20   7.273 -10.880 -13.240
  150   1HD   PRO  20           HD2      PRO  20   7.323 -11.530 -10.396
  151   2HD   PRO  20           HD1      PRO  20   5.933 -11.228 -11.450
  152    H    TRP  21           HN       TRP  21   8.329 -13.270  -9.876
  153    HA   TRP  21           HA       TRP  21  10.522 -15.299  -9.778
  154   1HB   TRP  21           HB2      TRP  21  11.408 -13.900  -7.894
  155   2HB   TRP  21           HB1      TRP  21  11.327 -13.031  -9.426
  156    HD1  TRP  21           HD1      TRP  21   9.514 -13.344  -6.062
  157    HE1  TRP  21           HE1      TRP  21   8.102 -11.219  -5.689
  158    HE3  TRP  21           HE3      TRP  21  10.168 -11.045 -10.575
  159    HZ2  TRP  21           HZ2      TRP  21   7.350  -8.857  -7.116
  160    HZ3  TRP  21           HZ3      TRP  21   9.093  -8.861 -11.041
  161    HH2  TRP  21           HH2      TRP  21   7.686  -7.765  -9.319
  162    H    HIS  22           HN       HIS  22  10.842 -16.331  -7.609
  163    HA   HIS  22           HA       HIS  22   8.209 -16.773  -6.255
  164   1HB   HIS  22           HB2      HIS  22   9.293 -18.717  -7.543
  165   2HB   HIS  22           HB1      HIS  22  10.521 -18.722  -6.277
  166    HD1  HIS  22           HD1      HIS  22   6.698 -18.528  -6.273
  167    HD2  HIS  22           HD2      HIS  22   9.797 -20.540  -4.343
  168    HE1  HIS  22           HE1      HIS  22   5.609 -20.063  -4.578
  169    H    LEU  23           HN       LEU  23   8.574 -15.110  -4.693
  170    HA   LEU  23           HA       LEU  23  10.902 -15.544  -2.871
  171   1HB   LEU  23           HB2      LEU  23  10.483 -13.262  -4.001
  172   2HB   LEU  23           HB1      LEU  23   9.113 -13.109  -2.901
  173    HG   LEU  23           HG       LEU  23  10.669 -13.511  -0.984
  174   1HD1  LEU  23          HD12      LEU  23  12.639 -13.601  -3.259
  175   2HD1  LEU  23          HD11      LEU  23  13.154 -13.067  -1.659
  176   3HD1  LEU  23          HD13      LEU  23  12.494 -14.688  -1.878
  177   1HD2  LEU  23          HD23      LEU  23  10.149 -11.193  -2.281
  178   2HD2  LEU  23          HD22      LEU  23  11.169 -11.274  -0.846
  179   3HD2  LEU  23          HD21      LEU  23  11.905 -11.234  -2.448
  180    HA   PRO  24           HA       PRO  24   7.254 -17.552  -0.709
  181   1HB   PRO  24           HB2      PRO  24   9.357 -18.624   1.000
  182   2HB   PRO  24           HB1      PRO  24   8.201 -19.489  -0.021
  183   1HG   PRO  24           HG2      PRO  24  10.978 -18.997  -0.510
  184   2HG   PRO  24           HG1      PRO  24   9.827 -19.894  -1.510
  185   1HD   PRO  24           HD2      PRO  24  10.996 -17.420  -2.141
  186   2HD   PRO  24           HD1      PRO  24   9.622 -18.171  -2.964
  187    H    ASP  25           HN       ASP  25  10.123 -15.903   0.586
  188    HA   ASP  25           HA       ASP  25   9.105 -15.393   3.208
  189   1HB   ASP  25           HB2      ASP  25  11.503 -15.035   2.166
  190   2HB   ASP  25           HB1      ASP  25  10.889 -13.418   1.820
  191    H    ASP  26           HN       ASP  26   8.988 -13.440   0.222
  192    HA   ASP  26           HA       ASP  26   7.594 -11.213   1.349
  193   1HB   ASP  26           HB2      ASP  26   8.727 -11.207  -0.881
  194   2HB   ASP  26           HB1      ASP  26   7.444 -12.246  -1.500
  195    H    LEU  27           HN       LEU  27   6.452 -14.240  -0.112
  196    HA   LEU  27           HA       LEU  27   3.664 -13.586  -0.136
  197   1HB   LEU  27           HB2      LEU  27   5.074 -16.262   0.089
  198   2HB   LEU  27           HB1      LEU  27   3.340 -16.076  -0.180
  199    HG   LEU  27           HG       LEU  27   5.475 -14.895  -1.979
  200   1HD1  LEU  27          HD11      LEU  27   4.086 -17.538  -1.944
  201   2HD1  LEU  27          HD13      LEU  27   4.319 -16.762  -3.510
  202   3HD1  LEU  27          HD12      LEU  27   5.712 -17.131  -2.494
  203   1HD2  LEU  27          HD22      LEU  27   2.462 -15.024  -2.019
  204   2HD2  LEU  27          HD21      LEU  27   3.508 -13.625  -2.260
  205   3HD2  LEU  27          HD23      LEU  27   3.374 -14.853  -3.519
  206    H    HIS  28           HN       HIS  28   5.835 -14.523   2.414
  207    HA   HIS  28           HA       HIS  28   3.685 -15.289   4.264
  208   1HB   HIS  28           HB2      HIS  28   6.677 -14.982   4.498
  209   2HB   HIS  28           HB1      HIS  28   5.672 -15.207   5.930
  210    HD1  HIS  28           HD1      HIS  28   3.714 -17.290   5.228
  211    HD2  HIS  28           HD2      HIS  28   7.619 -17.469   3.780
  212    HE1  HIS  28           HE1      HIS  28   4.137 -19.708   4.605
  213    H    TYR  29           HN       TYR  29   5.546 -12.439   3.454
  214    HA   TYR  29           HA       TYR  29   4.828 -10.956   5.860
  215   1HB   TYR  29           HB2      TYR  29   6.850 -10.526   4.338
  216   2HB   TYR  29           HB1      TYR  29   5.711  -9.771   3.222
  217    HD1  TYR  29           HD1      TYR  29   6.256  -9.762   6.942
  218    HD2  TYR  29           HD2      TYR  29   5.642  -7.456   3.371
  219    HE1  TYR  29           HE1      TYR  29   6.326  -7.673   8.278
  220    HE2  TYR  29           HE2      TYR  29   5.713  -5.367   4.707
  221    HH   TYR  29           HH       TYR  29   6.975  -5.068   7.581
  222    H    PHE  30           HN       PHE  30   3.402 -11.522   2.726
  223    HA   PHE  30           HA       PHE  30   1.614  -9.269   2.683
  224   1HB   PHE  30           HB2      PHE  30   2.166 -10.747   0.712
  225   2HB   PHE  30           HB1      PHE  30   1.155 -11.995   1.440
  226    HD1  PHE  30           HD2      PHE  30   1.060  -8.386   0.431
  227    HD2  PHE  30           HD1      PHE  30  -1.142 -12.032   0.985
  228    HE1  PHE  30           HE2      PHE  30  -0.957  -7.313  -0.531
  229    HE2  PHE  30           HE1      PHE  30  -3.159 -10.959   0.023
  230    HZ   PHE  30           HZ       PHE  30  -3.068  -8.600  -0.736
  231    H    ARG  31           HN       ARG  31   1.231 -12.629   3.819
  232    HA   ARG  31           HA       ARG  31  -1.497 -12.352   4.657
  233   1HB   ARG  31           HB2      ARG  31  -0.157 -14.517   4.352
  234   2HB   ARG  31           HB1      ARG  31   0.537 -14.185   5.940
  235   1HG   ARG  31           HG2      ARG  31  -1.529 -14.412   7.033
  236   2HG   ARG  31           HG1      ARG  31  -2.448 -14.154   5.549
  237   1HD   ARG  31           HD2      ARG  31  -2.616 -16.482   5.912
  238   2HD   ARG  31           HD1      ARG  31  -1.328 -16.335   4.716
  239    HE   ARG  31           HE       ARG  31  -0.393 -16.350   7.496
  240   1HH1  ARG  31          HH21      ARG  31  -1.172 -18.204   4.663
  241   2HH1  ARG  31          HH22      ARG  31  -0.172 -19.543   5.119
  242   1HH2  ARG  31          HH11      ARG  31   0.900 -18.093   8.077
  243   2HH2  ARG  31          HH12      ARG  31   0.994 -19.480   7.044
  244    H    ALA  32           HN       ALA  32   1.563 -11.526   6.159
  245    HA   ALA  32           HA       ALA  32   0.418 -11.110   8.815
  246   1HB   ALA  32           HB2      ALA  32   2.880 -11.652   8.231
  247   2HB   ALA  32           HB1      ALA  32   3.020  -9.942   7.825
  248   3HB   ALA  32           HB3      ALA  32   2.589 -10.427   9.465
  249    H    GLN  33           HN       GLN  33   0.972  -9.191   5.937
  250    HA   GLN  33           HA       GLN  33   0.166  -6.720   7.392
  251   1HB   GLN  33           HB2      GLN  33   1.306  -7.130   4.611
  252   2HB   GLN  33           HB1      GLN  33   0.854  -5.564   5.283
  253   1HG   GLN  33           HG2      GLN  33   2.783  -7.396   6.710
  254   2HG   GLN  33           HG1      GLN  33   3.330  -6.248   5.487
  255   1HE2  GLN  33          HE22      GLN  33   2.776  -4.890   9.173
  256   2HE2  GLN  33          HE21      GLN  33   3.019  -6.521   8.768
  257    H    THR  34           HN       THR  34  -1.739  -8.860   6.795
  258    HA   THR  34           HA       THR  34  -3.631  -7.270   5.129
  259    HB   THR  34           HB       THR  34  -4.464  -9.525   4.226
  260    HG1  THR  34           HG1      THR  34  -1.898 -10.487   4.602
  261   1HG2  THR  34          HG21      THR  34  -1.789  -8.327   3.502
  262   2HG2  THR  34          HG23      THR  34  -2.514  -9.627   2.558
  263   3HG2  THR  34          HG22      THR  34  -3.345  -8.078   2.710
  264    H    VAL  35           HN       VAL  35  -3.093  -9.730   7.601
  265    HA   VAL  35           HA       VAL  35  -5.925  -9.919   8.306
  266    HB   VAL  35           HB       VAL  35  -5.055 -11.241  10.252
  267   1HG1  VAL  35          HG12      VAL  35  -4.032 -11.923   7.482
  268   2HG1  VAL  35          HG11      VAL  35  -4.041 -13.061   8.830
  269   3HG1  VAL  35          HG13      VAL  35  -5.561 -12.423   8.204
  270   1HG2  VAL  35          HG21      VAL  35  -2.398 -10.495   8.991
  271   2HG2  VAL  35          HG23      VAL  35  -2.943 -10.107  10.623
  272   3HG2  VAL  35          HG22      VAL  35  -2.593 -11.779  10.185
  273    H    GLY  36           HN       GLY  36  -6.986  -8.600   9.709
  274   1HA   GLY  36           HA2      GLY  36  -7.137  -7.312  11.766
  275   2HA   GLY  36           HA1      GLY  36  -5.404  -7.000  11.660
  276    H    LYS  37           HN       LYS  37  -5.593  -6.369   8.761
  277    HA   LYS  37           HA       LYS  37  -6.810  -3.650   9.028
  278   1HB   LYS  37           HB2      LYS  37  -4.359  -4.665   7.614
  279   2HB   LYS  37           HB1      LYS  37  -5.167  -3.212   7.026
  280   1HG   LYS  37           HG2      LYS  37  -3.692  -2.273   8.550
  281   2HG   LYS  37           HG1      LYS  37  -5.096  -2.532   9.586
  282   1HD   LYS  37           HD2      LYS  37  -3.278  -3.434  10.814
  283   2HD   LYS  37           HD1      LYS  37  -4.073  -4.839  10.101
  284   1HE   LYS  37           HE2      LYS  37  -1.784  -5.195   9.639
  285   2HE   LYS  37           HE1      LYS  37  -2.417  -4.526   8.136
  286   1HZ   LYS  37           HZ2      LYS  37  -1.520  -2.563  10.059
  287   2HZ   LYS  37           HZ1      LYS  37  -0.288  -3.558   9.442
  288   3HZ   LYS  37           HZ3      LYS  37  -1.251  -2.646   8.384
  289    H    ILE  38           HN       ILE  38  -7.611  -2.745   6.904
  290    HA   ILE  38           HA       ILE  38  -9.315  -4.729   5.587
  291    HB   ILE  38           HB       ILE  38  -8.968  -1.785   4.946
  292   1HG1  ILE  38          HG12      ILE  38 -11.051  -3.087   6.723
  293   2HG1  ILE  38          HG11      ILE  38  -9.601  -2.298   7.348
  294   1HG2  ILE  38          HG22      ILE  38 -10.946  -3.923   4.193
  295   2HG2  ILE  38          HG21      ILE  38 -11.448  -2.233   4.242
  296   3HG2  ILE  38          HG23      ILE  38 -10.151  -2.737   3.159
  297   1HD1  ILE  38          HD11      ILE  38 -11.398  -0.835   5.429
  298   2HD1  ILE  38          HD13      ILE  38 -11.810  -0.909   7.143
  299   3HD1  ILE  38          HD12      ILE  38 -10.289  -0.177   6.633
  300    H    MET  39           HN       MET  39  -8.681  -5.855   3.824
  301    HA   MET  39           HA       MET  39  -6.283  -4.986   2.329
  302   1HB   MET  39           HB2      MET  39  -6.676  -7.390   3.077
  303   2HB   MET  39           HB1      MET  39  -7.955  -7.467   1.865
  304   1HG   MET  39           HG2      MET  39  -6.252  -6.733   0.148
  305   2HG   MET  39           HG1      MET  39  -5.012  -6.931   1.386
  306   1HE   MET  39           HE1      MET  39  -7.838  -8.166  -0.437
  307   2HE   MET  39           HE3      MET  39  -7.381  -9.758  -1.057
  308   3HE   MET  39           HE2      MET  39  -8.236  -9.619   0.477
  309    H    VAL  40           HN       VAL  40  -6.735  -3.456   0.803
  310    HA   VAL  40           HA       VAL  40  -9.266  -3.650  -0.741
  311    HB   VAL  40           HB       VAL  40  -7.142  -1.485  -0.809
  312   1HG1  VAL  40          HG11      VAL  40  -9.947  -1.752  -1.898
  313   2HG1  VAL  40          HG13      VAL  40  -9.191  -0.177  -1.655
  314   3HG1  VAL  40          HG12      VAL  40  -8.472  -1.338  -2.771
  315   1HG2  VAL  40          HG23      VAL  40  -9.745  -1.631   0.748
  316   2HG2  VAL  40          HG22      VAL  40  -8.128  -1.713   1.446
  317   3HG2  VAL  40          HG21      VAL  40  -8.677  -0.230   0.668
  318    H    VAL  41           HN       VAL  41  -9.248  -4.578  -2.722
  319    HA   VAL  41           HA       VAL  41  -6.761  -4.462  -4.352
  320    HB   VAL  41           HB       VAL  41  -7.083  -6.874  -4.957
  321   1HG1  VAL  41          HG12      VAL  41  -6.638  -6.236  -2.025
  322   2HG1  VAL  41          HG11      VAL  41  -6.200  -7.760  -2.796
  323   3HG1  VAL  41          HG13      VAL  41  -5.408  -6.263  -3.289
  324   1HG2  VAL  41          HG22      VAL  41  -9.481  -6.995  -4.305
  325   2HG2  VAL  41          HG21      VAL  41  -8.524  -8.251  -3.522
  326   3HG2  VAL  41          HG23      VAL  41  -9.014  -6.821  -2.614
  327    H    GLY  42           HN       GLY  42  -7.248  -5.126  -6.663
  328   1HA   GLY  42           HA2      GLY  42  -9.824  -3.929  -7.471
  329   2HA   GLY  42           HA1      GLY  42  -8.483  -4.327  -8.547
  330    H    ARG  43           HN       ARG  43 -10.424  -5.239  -9.799
  331    HA   ARG  43           HA       ARG  43 -11.603  -7.717  -8.810
  332   1HB   ARG  43           HB2      ARG  43 -12.520  -7.873 -11.140
  333   2HB   ARG  43           HB1      ARG  43 -12.885  -6.338 -10.351
  334   1HG   ARG  43           HG2      ARG  43 -10.955  -5.296 -11.497
  335   2HG   ARG  43           HG1      ARG  43 -10.620  -6.827 -12.308
  336   1HD   ARG  43           HD2      ARG  43 -12.640  -6.737 -13.552
  337   2HD   ARG  43           HD1      ARG  43 -13.314  -5.477 -12.518
  338    HE   ARG  43           HE       ARG  43 -10.982  -4.383 -13.643
  339   1HH1  ARG  43          HH11      ARG  43 -14.009  -5.692 -14.738
  340   2HH1  ARG  43          HH12      ARG  43 -14.058  -4.703 -16.159
  341   1HH2  ARG  43          HH21      ARG  43 -11.057  -3.106 -15.490
  342   2HH2  ARG  43          HH22      ARG  43 -12.395  -3.246 -16.582
  343    H    ARG  44           HN       ARG  44  -8.935  -6.818 -10.938
  344    HA   ARG  44           HA       ARG  44  -8.439  -9.467 -11.967
  345   1HB   ARG  44           HB2      ARG  44  -6.563  -7.101 -11.652
  346   2HB   ARG  44           HB1      ARG  44  -6.228  -8.542 -12.612
  347   1HG   ARG  44           HG2      ARG  44  -8.751  -6.984 -13.099
  348   2HG   ARG  44           HG1      ARG  44  -7.230  -6.423 -13.792
  349   1HD   ARG  44           HD2      ARG  44  -8.092  -9.292 -14.109
  350   2HD   ARG  44           HD1      ARG  44  -8.693  -8.046 -15.202
  351    HE   ARG  44           HE       ARG  44  -5.862  -7.795 -15.052
  352   1HH1  ARG  44          HH11      ARG  44  -8.306  -9.982 -16.200
  353   2HH1  ARG  44          HH12      ARG  44  -7.312 -10.616 -17.469
  354   1HH2  ARG  44          HH21      ARG  44  -4.582  -8.625 -16.702
  355   2HH2  ARG  44          HH22      ARG  44  -5.213  -9.851 -17.751
  356    H    THR  45           HN       THR  45  -7.044  -7.607  -9.261
  357    HA   THR  45           HA       THR  45  -5.251  -9.722  -8.435
  358    HB   THR  45           HB       THR  45  -6.342  -7.483  -6.711
  359    HG1  THR  45           HG1      THR  45  -3.956  -6.956  -7.751
  360   1HG2  THR  45          HG22      THR  45  -4.889  -9.488  -5.841
  361   2HG2  THR  45          HG21      THR  45  -3.569  -8.631  -6.639
  362   3HG2  THR  45          HG23      THR  45  -4.480  -7.843  -5.351
  363    H    TYR  46           HN       TYR  46  -8.607  -8.979  -7.835
  364    HA   TYR  46           HA       TYR  46  -8.972 -10.493  -5.431
  365   1HB   TYR  46           HB2      TYR  46 -10.621  -8.860  -6.470
  366   2HB   TYR  46           HB1      TYR  46 -11.022 -10.127  -7.629
  367    HD1  TYR  46           HD1      TYR  46 -10.516  -9.796  -3.919
  368    HD2  TYR  46           HD2      TYR  46 -12.860 -11.452  -7.115
  369    HE1  TYR  46           HE1      TYR  46 -12.043 -10.831  -2.262
  370    HE2  TYR  46           HE2      TYR  46 -14.388 -12.487  -5.457
  371    HH   TYR  46           HH       TYR  46 -14.844 -12.780  -3.312
  372    H    GLU  47           HN       GLU  47  -9.078 -11.387  -8.863
  373    HA   GLU  47           HA       GLU  47  -9.752 -14.180  -8.205
  374   1HB   GLU  47           HB2      GLU  47  -9.191 -12.745 -10.813
  375   2HB   GLU  47           HB1      GLU  47  -9.522 -14.475 -10.713
  376   1HG   GLU  47           HG2      GLU  47 -11.697 -14.023  -9.673
  377   2HG   GLU  47           HG1      GLU  47 -11.367 -12.291  -9.702
  378    H    SER  48           HN       SER  48  -6.938 -12.245  -8.740
  379    HA   SER  48           HA       SER  48  -5.125 -14.240  -9.692
  380   1HB   SER  48           HB2      SER  48  -4.773 -11.685  -8.130
  381   2HB   SER  48           HB1      SER  48  -3.396 -12.727  -8.482
  382    HG   SER  48           HG       SER  48  -3.625 -12.336 -10.593
  383    H    PHE  49           HN       PHE  49  -6.478 -13.613  -6.538
  384    HA   PHE  49           HA       PHE  49  -4.518 -15.010  -4.965
  385   1HB   PHE  49           HB2      PHE  49  -7.478 -14.567  -4.458
  386   2HB   PHE  49           HB1      PHE  49  -6.317 -15.128  -3.255
  387    HD1  PHE  49           HD1      PHE  49  -4.010 -13.584  -3.382
  388    HD2  PHE  49           HD2      PHE  49  -8.020 -12.317  -4.258
  389    HE1  PHE  49           HE1      PHE  49  -3.374 -11.237  -2.898
  390    HE2  PHE  49           HE2      PHE  49  -7.384  -9.969  -3.775
  391    HZ   PHE  49           HZ       PHE  49  -5.060  -9.429  -3.094
  392    HA   PRO  50           HA       PRO  50  -5.585 -19.255  -5.773
  393   1HB   PRO  50           HB2      PRO  50  -4.935 -20.313  -3.266
  394   2HB   PRO  50           HB1      PRO  50  -3.802 -20.025  -4.594
  395   1HG   PRO  50           HG2      PRO  50  -3.961 -18.672  -2.073
  396   2HG   PRO  50           HG1      PRO  50  -2.803 -18.417  -3.386
  397   1HD   PRO  50           HD2      PRO  50  -5.129 -16.811  -2.655
  398   2HD   PRO  50           HD1      PRO  50  -3.794 -16.413  -3.747
  399    H    LYS  51           HN       LYS  51  -6.364 -18.927  -2.302
  400    HA   LYS  51           HA       LYS  51  -9.057 -20.064  -2.891
  401   1HB   LYS  51           HB2      LYS  51  -7.494 -21.179  -1.205
  402   2HB   LYS  51           HB1      LYS  51  -7.757 -19.772  -0.175
  403   1HG   LYS  51           HG2      LYS  51 -10.149 -20.189  -0.123
  404   2HG   LYS  51           HG1      LYS  51  -9.982 -21.501  -1.290
  405   1HD   LYS  51           HD2      LYS  51  -8.519 -22.707   0.338
  406   2HD   LYS  51           HD1      LYS  51  -8.836 -21.431   1.516
  407   1HE   LYS  51           HE2      LYS  51 -10.987 -23.111   0.193
  408   2HE   LYS  51           HE1      LYS  51 -10.334 -23.415   1.803
  409   1HZ   LYS  51           HZ3      LYS  51 -10.967 -21.033   2.297
  410   2HZ   LYS  51           HZ2      LYS  51 -11.880 -21.074   0.865
  411   3HZ   LYS  51           HZ1      LYS  51 -12.245 -22.135   2.140
  412    H    ARG  52           HN       ARG  52 -10.126 -18.135  -3.503
  413    HA   ARG  52           HA       ARG  52 -10.160 -15.910  -1.529
  414   1HB   ARG  52           HB2      ARG  52 -11.373 -14.679  -3.341
  415   2HB   ARG  52           HB1      ARG  52  -9.777 -15.238  -3.839
  416   1HG   ARG  52           HG2      ARG  52 -11.003 -17.341  -4.717
  417   2HG   ARG  52           HG1      ARG  52 -12.473 -16.377  -4.568
  418   1HD   ARG  52           HD2      ARG  52 -10.140 -15.131  -5.954
  419   2HD   ARG  52           HD1      ARG  52 -11.032 -16.384  -6.819
  420    HE   ARG  52           HE       ARG  52 -12.066 -13.726  -6.065
  421   1HH1  ARG  52          HH11      ARG  52 -12.705 -16.946  -7.204
  422   2HH1  ARG  52          HH12      ARG  52 -14.235 -16.524  -7.899
  423   1HH2  ARG  52          HH21      ARG  52 -14.052 -13.192  -6.970
  424   2HH2  ARG  52          HH22      ARG  52 -14.993 -14.409  -7.766
  425    HA   PRO  53           HA       PRO  53 -11.563 -14.094  -1.352
  426   1HB   PRO  53           HB2      PRO  53 -13.053 -13.297   0.884
  427   2HB   PRO  53           HB1      PRO  53 -13.431 -12.925  -0.804
  428   1HG   PRO  53           HG2      PRO  53 -14.865 -14.628   0.992
  429   2HG   PRO  53           HG1      PRO  53 -15.245 -14.242  -0.693
  430   1HD   PRO  53           HD2      PRO  53 -14.039 -16.667   0.414
  431   2HD   PRO  53           HD1      PRO  53 -14.739 -16.395  -1.191
  432    H    LEU  54           HN       LEU  54 -10.029 -13.260   0.166
  433    HA   LEU  54           HA       LEU  54  -8.798 -15.219   1.879
  434   1HB   LEU  54           HB2      LEU  54  -8.369 -12.222   1.719
  435   2HB   LEU  54           HB1      LEU  54  -7.302 -13.361   2.541
  436    HG   LEU  54           HG       LEU  54  -8.013 -13.567  -0.397
  437   1HD1  LEU  54          HD11      LEU  54  -5.870 -12.046   1.044
  438   2HD1  LEU  54          HD13      LEU  54  -5.469 -12.814  -0.492
  439   3HD1  LEU  54          HD12      LEU  54  -6.759 -11.614  -0.415
  440   1HD2  LEU  54          HD22      LEU  54  -6.006 -14.913   1.427
  441   2HD2  LEU  54          HD21      LEU  54  -7.280 -15.673   0.476
  442   3HD2  LEU  54          HD23      LEU  54  -5.877 -14.972  -0.331
  443    HA   PRO  55           HA       PRO  55 -11.448 -14.301   5.435
  444   1HB   PRO  55           HB2      PRO  55 -10.291 -16.273   7.045
  445   2HB   PRO  55           HB1      PRO  55 -11.684 -16.495   5.977
  446   1HG   PRO  55           HG2      PRO  55  -9.038 -17.578   5.707
  447   2HG   PRO  55           HG1      PRO  55 -10.457 -17.863   4.689
  448   1HD   PRO  55           HD2      PRO  55  -8.147 -16.168   4.168
  449   2HD   PRO  55           HD1      PRO  55  -9.439 -16.666   3.064
  450    H    GLU  56           HN       GLU  56 -10.894 -14.080   7.927
  451    HA   GLU  56           HA       GLU  56  -9.719 -12.897   9.573
  452   1HB   GLU  56           HB2      GLU  56  -7.266 -13.643   7.953
  453   2HB   GLU  56           HB1      GLU  56  -7.312 -13.186   9.657
  454   1HG   GLU  56           HG2      GLU  56  -8.830 -15.567   8.573
  455   2HG   GLU  56           HG1      GLU  56  -7.182 -15.691   9.190
  456    H    ARG  57           HN       ARG  57 -10.635 -11.566   7.066
  457    HA   ARG  57           HA       ARG  57  -9.549  -8.968   7.539
  458   1HB   ARG  57           HB2      ARG  57  -8.317  -8.666   5.389
  459   2HB   ARG  57           HB1      ARG  57  -7.530  -9.823   6.462
  460   1HG   ARG  57           HG2      ARG  57  -8.989 -11.588   5.170
  461   2HG   ARG  57           HG1      ARG  57  -9.065 -10.335   3.932
  462   1HD   ARG  57           HD2      ARG  57  -7.142 -11.490   3.294
  463   2HD   ARG  57           HD1      ARG  57  -6.463 -10.213   4.303
  464    HE   ARG  57           HE       ARG  57  -6.894 -12.233   6.112
  465   1HH1  ARG  57          HH21      ARG  57  -5.346 -12.077   3.006
  466   2HH1  ARG  57          HH22      ARG  57  -4.220 -13.341   3.370
  467   1HH2  ARG  57          HH11      ARG  57  -5.426 -13.872   6.574
  468   2HH2  ARG  57          HH12      ARG  57  -4.267 -14.352   5.381
  469    H    THR  58           HN       THR  58 -10.273  -7.420   5.712
  470    HA   THR  58           HA       THR  58 -12.915  -8.378   4.704
  471    HB   THR  58           HB       THR  58 -12.000  -5.504   4.942
  472    HG1  THR  58           HG1      THR  58 -12.337  -7.175   6.904
  473   1HG2  THR  58          HG23      THR  58 -14.650  -6.913   4.610
  474   2HG2  THR  58          HG22      THR  58 -14.541  -5.237   5.147
  475   3HG2  THR  58          HG21      THR  58 -13.925  -5.696   3.560
  476    H    ASN  59           HN       ASN  59 -12.954  -8.843   2.568
  477    HA   ASN  59           HA       ASN  59 -10.840  -7.835   0.786
  478   1HB   ASN  59           HB2      ASN  59 -13.173  -9.721   0.379
  479   2HB   ASN  59           HB1      ASN  59 -12.083  -9.247  -0.924
  480   1HD2  ASN  59          HD22      ASN  59 -10.320 -11.305   2.178
  481   2HD2  ASN  59          HD21      ASN  59 -11.462 -10.099   2.532
  482    H    VAL  60           HN       VAL  60 -11.184  -5.682   0.314
  483    HA   VAL  60           HA       VAL  60 -13.914  -4.824  -0.502
  484    HB   VAL  60           HB       VAL  60 -11.432  -3.135  -0.070
  485   1HG1  VAL  60          HG12      VAL  60 -14.376  -2.514  -0.410
  486   2HG1  VAL  60          HG11      VAL  60 -13.209  -1.342   0.200
  487   3HG1  VAL  60          HG13      VAL  60 -13.042  -1.984  -1.435
  488   1HG2  VAL  60          HG23      VAL  60 -13.706  -3.878   1.794
  489   2HG2  VAL  60          HG22      VAL  60 -11.989  -4.205   2.027
  490   3HG2  VAL  60          HG21      VAL  60 -12.589  -2.548   2.101
  491    H    VAL  61           HN       VAL  61 -14.148  -5.480  -2.628
  492    HA   VAL  61           HA       VAL  61 -11.952  -5.099  -4.554
  493    HB   VAL  61           HB       VAL  61 -14.801  -6.013  -5.052
  494   1HG1  VAL  61          HG12      VAL  61 -12.235  -6.083  -6.647
  495   2HG1  VAL  61          HG11      VAL  61 -13.593  -7.145  -7.015
  496   3HG1  VAL  61          HG13      VAL  61 -13.790  -5.395  -7.117
  497   1HG2  VAL  61          HG21      VAL  61 -13.634  -7.448  -3.397
  498   2HG2  VAL  61          HG23      VAL  61 -13.890  -8.294  -4.923
  499   3HG2  VAL  61          HG22      VAL  61 -12.296  -7.648  -4.530
  500    H    LEU  62           HN       LEU  62 -11.834  -3.437  -6.020
  501    HA   LEU  62           HA       LEU  62 -14.013  -1.391  -5.907
  502   1HB   LEU  62           HB2      LEU  62 -11.683  -0.724  -5.152
  503   2HB   LEU  62           HB1      LEU  62 -11.155  -0.971  -6.816
  504    HG   LEU  62           HG       LEU  62 -13.075   0.618  -7.471
  505   1HD1  LEU  62          HD13      LEU  62 -12.990   0.904  -4.479
  506   2HD1  LEU  62          HD12      LEU  62 -13.421   2.290  -5.480
  507   3HD1  LEU  62          HD11      LEU  62 -14.391   0.818  -5.546
  508   1HD2  LEU  62          HD23      LEU  62 -10.623   1.506  -5.932
  509   2HD2  LEU  62          HD22      LEU  62 -10.810   1.371  -7.681
  510   3HD2  LEU  62          HD21      LEU  62 -11.663   2.638  -6.797
  511    H    THR  63           HN       THR  63 -15.310  -1.539  -7.666
  512    HA   THR  63           HA       THR  63 -14.035  -1.808 -10.341
  513    HB   THR  63           HB       THR  63 -14.767  -4.065  -9.799
  514    HG1  THR  63           HG1      THR  63 -15.461  -2.792 -11.861
  515   1HG2  THR  63          HG21      THR  63 -17.456  -2.789  -9.224
  516   2HG2  THR  63          HG23      THR  63 -17.124  -4.521  -9.221
  517   3HG2  THR  63          HG22      THR  63 -16.364  -3.476  -8.021
  518    H    HIS  64           HN       HIS  64 -15.162  -0.702 -11.979
  519    HA   HIS  64           HA       HIS  64 -17.259   1.162 -10.996
  520   1HB   HIS  64           HB2      HIS  64 -15.431   1.157 -13.401
  521   2HB   HIS  64           HB1      HIS  64 -16.807   2.255 -13.285
  522    HD1  HIS  64           HD1      HIS  64 -16.472   4.348 -11.939
  523    HD2  HIS  64           HD2      HIS  64 -13.534   1.500 -11.142
  524    HE1  HIS  64           HE1      HIS  64 -14.785   5.467 -10.420
  525    H    GLN  65           HN       GLN  65 -16.746  -1.506 -13.191
  526    HA   GLN  65           HA       GLN  65 -19.140  -1.132 -14.768
  527   1HB   GLN  65           HB2      GLN  65 -17.070  -2.613 -15.278
  528   2HB   GLN  65           HB1      GLN  65 -17.849  -3.807 -14.241
  529   1HG   GLN  65           HG2      GLN  65 -18.719  -4.393 -16.319
  530   2HG   GLN  65           HG1      GLN  65 -19.960  -3.284 -15.736
  531   1HE2  GLN  65          HE22      GLN  65 -19.256  -0.790 -18.159
  532   2HE2  GLN  65          HE21      GLN  65 -20.109  -1.172 -16.742
  533    H    GLU  66           HN       GLU  66 -21.213  -1.830 -14.360
  534    HA   GLU  66           HA       GLU  66 -21.787  -2.812 -11.635
  535   1HB   GLU  66           HB2      GLU  66 -23.636  -2.008 -13.904
  536   2HB   GLU  66           HB1      GLU  66 -24.154  -2.420 -12.269
  537   1HG   GLU  66           HG2      GLU  66 -23.204  -0.497 -11.339
  538   2HG   GLU  66           HG1      GLU  66 -22.078  -0.286 -12.680
  539    H    ASP  67           HN       ASP  67 -20.493  -4.567 -13.663
  540    HA   ASP  67           HA       ASP  67 -22.628  -6.641 -13.955
  541   1HB   ASP  67           HB2      ASP  67 -21.365  -5.757 -16.025
  542   2HB   ASP  67           HB1      ASP  67 -19.975  -6.643 -15.398
  543    H    TYR  68           HN       TYR  68 -19.452  -5.929 -12.659
  544    HA   TYR  68           HA       TYR  68 -18.682  -8.621 -12.012
  545   1HB   TYR  68           HB2      TYR  68 -17.239  -6.471 -12.008
  546   2HB   TYR  68           HB1      TYR  68 -17.893  -6.201 -10.392
  547    HD1  TYR  68           HD1      TYR  68 -16.076  -8.696 -12.490
  548    HD2  TYR  68           HD2      TYR  68 -17.042  -7.371  -8.520
  549    HE1  TYR  68           HE1      TYR  68 -14.439 -10.308 -11.555
  550    HE2  TYR  68           HE2      TYR  68 -15.405  -8.982  -7.584
  551    HH   TYR  68           HH       TYR  68 -14.301 -11.520  -9.017
  552    H    GLN  69           HN       GLN  69 -19.097  -9.847 -10.177
  553    HA   GLN  69           HA       GLN  69 -20.735  -8.630  -8.011
  554   1HB   GLN  69           HB2      GLN  69 -21.474 -11.018  -9.705
  555   2HB   GLN  69           HB1      GLN  69 -22.121 -10.811  -8.078
  556   1HG   GLN  69           HG2      GLN  69 -22.266  -8.522 -10.013
  557   2HG   GLN  69           HG1      GLN  69 -23.438  -9.834 -10.141
  558   1HE2  GLN  69          HE22      GLN  69 -24.344  -7.062  -7.561
  559   2HE2  GLN  69          HE21      GLN  69 -23.538  -6.881  -9.044
  560    H    ALA  70           HN       ALA  70 -19.268  -8.903  -6.370
  561    HA   ALA  70           HA       ALA  70 -17.834 -11.495  -6.134
  562   1HB   ALA  70           HB3      ALA  70 -16.767  -9.107  -5.879
  563   2HB   ALA  70           HB2      ALA  70 -17.457  -9.177  -4.257
  564   3HB   ALA  70           HB1      ALA  70 -16.287 -10.393  -4.771
  565    H    GLN  71           HN       GLN  71 -18.561 -13.012  -4.730
  566    HA   GLN  71           HA       GLN  71 -20.759 -12.307  -2.877
  567   1HB   GLN  71           HB2      GLN  71 -19.537 -14.975  -3.647
  568   2HB   GLN  71           HB1      GLN  71 -20.902 -14.780  -2.546
  569   1HG   GLN  71           HG2      GLN  71 -20.991 -13.552  -5.292
  570   2HG   GLN  71           HG1      GLN  71 -21.384 -15.257  -5.069
  571   1HE2  GLN  71          HE22      GLN  71 -23.894 -12.405  -3.505
  572   2HE2  GLN  71          HE21      GLN  71 -22.303 -11.981  -3.918
  573    H    GLY  72           HN       GLY  72 -20.464 -12.125  -0.699
  574   1HA   GLY  72           HA2      GLY  72 -19.430 -12.259   1.410
  575   2HA   GLY  72           HA1      GLY  72 -18.372 -13.507   0.747
  576    H    ALA  73           HN       ALA  73 -18.787 -10.185  -0.437
  577    HA   ALA  73           HA       ALA  73 -16.205  -9.340   0.675
  578   1HB   ALA  73           HB2      ALA  73 -15.759 -10.685  -1.486
  579   2HB   ALA  73           HB1      ALA  73 -16.494  -9.323  -2.330
  580   3HB   ALA  73           HB3      ALA  73 -15.035  -9.081  -1.369
  581    H    VAL  74           HN       VAL  74 -16.079  -7.096   0.776
  582    HA   VAL  74           HA       VAL  74 -18.527  -5.607   0.328
  583    HB   VAL  74           HB       VAL  74 -15.755  -4.538   0.941
  584   1HG1  VAL  74          HG12      VAL  74 -17.461  -2.879   0.192
  585   2HG1  VAL  74          HG11      VAL  74 -18.516  -3.412   1.501
  586   3HG1  VAL  74          HG13      VAL  74 -16.976  -2.635   1.870
  587   1HG2  VAL  74          HG23      VAL  74 -17.973  -5.441   2.808
  588   2HG2  VAL  74          HG22      VAL  74 -16.425  -6.252   2.580
  589   3HG2  VAL  74          HG21      VAL  74 -16.481  -4.649   3.310
  590    H    VAL  75           HN       VAL  75 -19.000  -5.582  -1.887
  591    HA   VAL  75           HA       VAL  75 -16.966  -4.805  -3.850
  592    HB   VAL  75           HB       VAL  75 -19.967  -5.068  -4.210
  593   1HG1  VAL  75          HG13      VAL  75 -18.652  -3.842  -5.979
  594   2HG1  VAL  75          HG12      VAL  75 -17.707  -5.313  -6.216
  595   3HG1  VAL  75          HG11      VAL  75 -19.438  -5.312  -6.559
  596   1HG2  VAL  75          HG21      VAL  75 -17.736  -7.106  -4.476
  597   2HG2  VAL  75          HG23      VAL  75 -19.088  -7.164  -3.346
  598   3HG2  VAL  75          HG22      VAL  75 -19.375  -7.353  -5.076
  599    H    VAL  76           HN       VAL  76 -16.324  -2.687  -3.456
  600    HA   VAL  76           HA       VAL  76 -18.392  -0.595  -3.103
  601    HB   VAL  76           HB       VAL  76 -16.409   0.907  -2.785
  602   1HG1  VAL  76          HG13      VAL  76 -17.484  -0.272  -0.879
  603   2HG1  VAL  76          HG12      VAL  76 -16.374  -1.623  -1.110
  604   3HG1  VAL  76          HG11      VAL  76 -15.754  -0.046  -0.622
  605   1HG2  VAL  76          HG23      VAL  76 -14.953  -0.650  -4.261
  606   2HG2  VAL  76          HG22      VAL  76 -14.200   0.057  -2.832
  607   3HG2  VAL  76          HG21      VAL  76 -14.751  -1.618  -2.799
  608    H    HIS  77           HN       HIS  77 -18.144   1.423  -4.460
  609    HA   HIS  77           HA       HIS  77 -17.025   0.901  -7.167
  610   1HB   HIS  77           HB2      HIS  77 -19.864   1.805  -6.595
  611   2HB   HIS  77           HB1      HIS  77 -19.119   1.787  -8.194
  612    HD1  HIS  77           HD1      HIS  77 -19.061  -0.420  -9.425
  613    HD2  HIS  77           HD2      HIS  77 -20.148  -0.872  -5.426
  614    HE1  HIS  77           HE1      HIS  77 -19.772  -2.835  -9.145
  615    H    ASP  78           HN       ASP  78 -16.247   2.625  -4.888
  616    HA   ASP  78           HA       ASP  78 -15.759   5.062  -6.369
  617   1HB   ASP  78           HB2      ASP  78 -18.209   5.218  -5.466
  618   2HB   ASP  78           HB1      ASP  78 -17.434   5.494  -3.905
  619    H    VAL  79           HN       VAL  79 -14.058   6.207  -5.427
  620    HA   VAL  79           HA       VAL  79 -12.487   4.856  -3.430
  621    HB   VAL  79           HB       VAL  79 -12.257   7.740  -4.341
  622   1HG1  VAL  79          HG12      VAL  79 -10.960   6.953  -2.294
  623   2HG1  VAL  79          HG11      VAL  79 -10.110   5.840  -3.367
  624   3HG1  VAL  79          HG13      VAL  79  -9.976   7.581  -3.616
  625   1HG2  VAL  79          HG23      VAL  79 -12.294   6.169  -6.257
  626   2HG2  VAL  79          HG22      VAL  79 -10.690   6.869  -6.036
  627   3HG2  VAL  79          HG21      VAL  79 -11.015   5.221  -5.497
  628    H    ALA  80           HN       ALA  80 -14.766   7.555  -3.321
  629    HA   ALA  80           HA       ALA  80 -14.181   8.343  -0.607
  630   1HB   ALA  80           HB3      ALA  80 -16.508   8.786  -2.475
  631   2HB   ALA  80           HB2      ALA  80 -16.575   9.330  -0.798
  632   3HB   ALA  80           HB1      ALA  80 -15.335   9.962  -1.881
  633    H    ALA  81           HN       ALA  81 -16.278   5.924  -2.061
  634    HA   ALA  81           HA       ALA  81 -17.857   5.368   0.280
  635   1HB   ALA  81           HB2      ALA  81 -17.144   3.610  -2.087
  636   2HB   ALA  81           HB1      ALA  81 -18.369   3.218  -0.880
  637   3HB   ALA  81           HB3      ALA  81 -18.582   4.619  -1.931
  638    H    VAL  82           HN       VAL  82 -14.757   4.157  -0.916
  639    HA   VAL  82           HA       VAL  82 -14.491   2.027   1.010
  640    HB   VAL  82           HB       VAL  82 -12.282   3.568  -0.386
  641   1HG1  VAL  82          HG13      VAL  82 -12.463   0.859   0.949
  642   2HG1  VAL  82          HG12      VAL  82 -11.166   1.277  -0.170
  643   3HG1  VAL  82          HG11      VAL  82 -11.362   2.182   1.331
  644   1HG2  VAL  82          HG21      VAL  82 -14.164   1.414  -1.303
  645   2HG2  VAL  82          HG23      VAL  82 -13.556   2.814  -2.188
  646   3HG2  VAL  82          HG22      VAL  82 -12.508   1.423  -1.914
  647    H    PHE  83           HN       PHE  83 -13.533   5.442   0.983
  648    HA   PHE  83           HA       PHE  83 -12.051   5.343   3.458
  649   1HB   PHE  83           HB2      PHE  83 -13.293   7.558   1.833
  650   2HB   PHE  83           HB1      PHE  83 -12.567   7.888   3.406
  651    HD1  PHE  83           HD1      PHE  83 -10.203   6.509   3.703
  652    HD2  PHE  83           HD2      PHE  83 -11.892   7.925   0.016
  653    HE1  PHE  83           HE1      PHE  83  -7.949   6.502   2.668
  654    HE2  PHE  83           HE2      PHE  83  -9.638   7.916  -1.020
  655    HZ   PHE  83           HZ       PHE  83  -7.668   7.205   0.306
  656    H    ALA  84           HN       ALA  84 -15.443   5.789   2.644
  657    HA   ALA  84           HA       ALA  84 -16.308   6.768   5.206
  658   1HB   ALA  84           HB1      ALA  84 -17.636   6.830   3.045
  659   2HB   ALA  84           HB3      ALA  84 -17.937   5.107   3.268
  660   3HB   ALA  84           HB2      ALA  84 -18.536   6.268   4.452
  661    H    TYR  85           HN       TYR  85 -15.874   3.521   3.863
  662    HA   TYR  85           HA       TYR  85 -17.081   2.123   6.082
  663   1HB   TYR  85           HB2      TYR  85 -16.599   1.199   3.743
  664   2HB   TYR  85           HB1      TYR  85 -14.923   1.032   4.266
  665    HD1  TYR  85           HD1      TYR  85 -18.395   0.220   5.442
  666    HD2  TYR  85           HD2      TYR  85 -14.268  -0.959   5.290
  667    HE1  TYR  85           HE1      TYR  85 -18.962  -1.906   6.584
  668    HE2  TYR  85           HE2      TYR  85 -14.834  -3.086   6.432
  669    HH   TYR  85           HH       TYR  85 -18.004  -4.203   6.768
  670    H    ALA  86           HN       ALA  86 -13.852   3.351   5.413
  671    HA   ALA  86           HA       ALA  86 -12.566   1.941   7.603
  672   1HB   ALA  86           HB3      ALA  86 -11.748   4.372   5.987
  673   2HB   ALA  86           HB2      ALA  86 -10.717   3.605   7.196
  674   3HB   ALA  86           HB1      ALA  86 -11.202   2.711   5.756
  675    H    LYS  87           HN       LYS  87 -14.332   4.938   7.257
  676    HA   LYS  87           HA       LYS  87 -13.410   6.257   9.627
  677   1HB   LYS  87           HB2      LYS  87 -14.897   7.145   7.668
  678   2HB   LYS  87           HB1      LYS  87 -16.237   6.509   8.624
  679   1HG   LYS  87           HG2      LYS  87 -15.506   7.854  10.557
  680   2HG   LYS  87           HG1      LYS  87 -14.161   8.489   9.609
  681   1HD   LYS  87           HD2      LYS  87 -15.981   9.232   7.915
  682   2HD   LYS  87           HD1      LYS  87 -17.112   8.985   9.246
  683   1HE   LYS  87           HE2      LYS  87 -16.189  10.698  10.527
  684   2HE   LYS  87           HE1      LYS  87 -14.625  10.598   9.718
  685   1HZ   LYS  87           HZ3      LYS  87 -16.638  11.234   7.845
  686   2HZ   LYS  87           HZ2      LYS  87 -16.715  12.325   9.145
  687   3HZ   LYS  87           HZ1      LYS  87 -15.267  12.133   8.279
  688    H    GLN  88           HN       GLN  88 -16.142   4.041   9.049
  689    HA   GLN  88           HA       GLN  88 -17.139   4.100  11.742
  690   1HB   GLN  88           HB2      GLN  88 -17.385   2.064   9.515
  691   2HB   GLN  88           HB1      GLN  88 -18.200   1.883  11.068
  692   1HG   GLN  88           HG2      GLN  88 -19.428   3.935  10.746
  693   2HG   GLN  88           HG1      GLN  88 -18.489   4.328   9.305
  694   1HE2  GLN  88          HE22      GLN  88 -20.122   1.703   7.347
  695   2HE2  GLN  88          HE21      GLN  88 -18.563   2.313   7.625
  696    H    HIS  89           HN       HIS  89 -14.586   2.282  10.159
  697    HA   HIS  89           HA       HIS  89 -14.036   0.910  12.763
  698   1HB   HIS  89           HB2      HIS  89 -13.621  -0.016   9.913
  699   2HB   HIS  89           HB1      HIS  89 -12.816  -0.787  11.281
  700    HD1  HIS  89           HD1      HIS  89 -14.074  -2.790  12.039
  701    HD2  HIS  89           HD2      HIS  89 -16.648   0.196  10.683
  702    HE1  HIS  89           HE1      HIS  89 -16.425  -3.687  12.326
  703    HA   PRO  90           HA       PRO  90 -10.411   3.660  12.047
  704   1HB   PRO  90           HB2      PRO  90 -10.215   4.288  14.769
  705   2HB   PRO  90           HB1      PRO  90 -11.008   5.271  13.532
  706   1HG   PRO  90           HG2      PRO  90 -12.215   3.854  15.706
  707   2HG   PRO  90           HG1      PRO  90 -13.001   4.859  14.481
  708   1HD   PRO  90           HD2      PRO  90 -12.878   1.944  14.666
  709   2HD   PRO  90           HD1      PRO  90 -13.919   2.958  13.654
  710    H    ASP  91           HN       ASP  91 -11.044   0.986  14.178
  711    HA   ASP  91           HA       ASP  91  -8.397   0.645  15.248
  712   1HB   ASP  91           HB2      ASP  91 -10.554  -0.469  16.054
  713   2HB   ASP  91           HB1      ASP  91 -10.372  -1.578  14.694
  714    H    GLN  92           HN       GLN  92  -9.879  -0.176  12.191
  715    HA   GLN  92           HA       GLN  92  -7.561  -1.858  11.416
  716   1HB   GLN  92           HB2      GLN  92 -10.121  -1.172   9.938
  717   2HB   GLN  92           HB1      GLN  92  -8.877  -2.275   9.350
  718   1HG   GLN  92           HG2      GLN  92  -9.202  -3.696  11.351
  719   2HG   GLN  92           HG1      GLN  92 -10.471  -2.606  11.909
  720   1HE2  GLN  92          HE22      GLN  92 -11.238  -4.866   8.548
  721   2HE2  GLN  92          HE21      GLN  92  -9.640  -4.390   8.872
  722    H    GLU  93           HN       GLU  93  -6.975  -1.369   8.923
  723    HA   GLU  93           HA       GLU  93  -6.719   1.574   8.537
  724   1HB   GLU  93           HB2      GLU  93  -4.436  -0.419   8.394
  725   2HB   GLU  93           HB1      GLU  93  -4.327   1.283   7.944
  726   1HG   GLU  93           HG2      GLU  93  -5.201   1.770  10.328
  727   2HG   GLU  93           HG1      GLU  93  -4.776   0.095  10.681
  728    H    LEU  94           HN       LEU  94  -5.841   2.014   6.253
  729    HA   LEU  94           HA       LEU  94  -7.143   0.096   4.376
  730   1HB   LEU  94           HB2      LEU  94  -7.709   2.666   4.551
  731   2HB   LEU  94           HB1      LEU  94  -6.246   2.851   3.582
  732    HG   LEU  94           HG       LEU  94  -8.419   0.905   2.801
  733   1HD1  LEU  94          HD13      LEU  94  -8.162   3.832   2.049
  734   2HD1  LEU  94          HD12      LEU  94  -9.246   2.685   1.263
  735   3HD1  LEU  94          HD11      LEU  94  -9.483   3.100   2.960
  736   1HD2  LEU  94          HD21      LEU  94  -6.034   2.202   1.490
  737   2HD2  LEU  94          HD23      LEU  94  -6.450   0.490   1.576
  738   3HD2  LEU  94          HD22      LEU  94  -7.357   1.566   0.513
  739    H    VAL  95           HN       VAL  95  -5.803  -1.176   3.210
  740    HA   VAL  95           HA       VAL  95  -3.040  -0.172   2.640
  741    HB   VAL  95           HB       VAL  95  -3.876  -3.060   3.044
  742   1HG1  VAL  95          HG11      VAL  95  -1.187  -1.693   2.734
  743   2HG1  VAL  95          HG13      VAL  95  -1.396  -3.386   3.180
  744   3HG1  VAL  95          HG12      VAL  95  -1.932  -2.818   1.598
  745   1HG2  VAL  95          HG23      VAL  95  -2.677  -1.006   4.906
  746   2HG2  VAL  95          HG22      VAL  95  -4.049  -2.076   5.192
  747   3HG2  VAL  95          HG21      VAL  95  -2.412  -2.731   5.156
  748    H    ILE  96           HN       ILE  96  -2.464  -0.181   0.507
  749    HA   ILE  96           HA       ILE  96  -4.426  -1.312  -1.430
  750    HB   ILE  96           HB       ILE  96  -2.144   0.610  -1.958
  751   1HG1  ILE  96          HG12      ILE  96  -3.765   1.601  -0.378
  752   2HG1  ILE  96          HG11      ILE  96  -3.872   2.379  -1.954
  753   1HG2  ILE  96          HG21      ILE  96  -3.084  -0.744  -3.875
  754   2HG2  ILE  96          HG23      ILE  96  -4.636   0.043  -3.583
  755   3HG2  ILE  96          HG22      ILE  96  -3.237   1.002  -4.066
  756   1HD1  ILE  96          HD13      ILE  96  -5.787   0.831  -2.504
  757   2HD1  ILE  96          HD12      ILE  96  -5.737   0.267  -0.834
  758   3HD1  ILE  96          HD11      ILE  96  -6.127   1.951  -1.185
  759    H    ALA  97           HN       ALA  97  -3.896  -3.221  -2.350
  760    HA   ALA  97           HA       ALA  97  -1.012  -3.999  -2.442
  761   1HB   ALA  97           HB3      ALA  97  -3.551  -5.501  -2.039
  762   2HB   ALA  97           HB2      ALA  97  -2.292  -6.312  -2.969
  763   3HB   ALA  97           HB1      ALA  97  -1.962  -5.769  -1.325
  764    H    GLY  98           HN       GLY  98  -3.864  -3.405  -4.356
  765   1HA   GLY  98           HA2      GLY  98  -2.638  -2.925  -6.782
  766   2HA   GLY  98           HA1      GLY  98  -2.852  -4.676  -6.778
  767    H    GLY  99           HN       GLY  99  -5.950  -3.458  -8.346
  768   1HA   GLY  99           HA2      GLY  99  -3.208  -4.413  -8.808
  769   2HA   GLY  99           HA1      GLY  99  -4.433  -4.129 -10.046
  770    H    ALA 100           HN       ALA 100  -2.895  -2.937 -11.322
  771    HA   ALA 100           HA       ALA 100  -1.469  -0.645 -10.326
  772   1HB   ALA 100           HB2      ALA 100  -2.236  -1.592 -13.088
  773   2HB   ALA 100           HB1      ALA 100  -1.397  -0.060 -12.844
  774   3HB   ALA 100           HB3      ALA 100  -0.638  -1.570 -12.342
  775    H    GLN 101           HN       GLN 101  -4.686  -1.101 -11.685
  776    HA   GLN 101           HA       GLN 101  -5.235   1.733 -12.021
  777   1HB   GLN 101           HB2      GLN 101  -7.096  -0.658 -11.832
  778   2HB   GLN 101           HB1      GLN 101  -7.597   0.972 -12.283
  779   1HG   GLN 101           HG2      GLN 101  -6.351   0.927 -14.291
  780   2HG   GLN 101           HG1      GLN 101  -5.379  -0.444 -13.758
  781   1HE2  GLN 101          HE22      GLN 101  -9.233  -1.180 -15.016
  782   2HE2  GLN 101          HE21      GLN 101  -8.861   0.335 -14.348
  783    H    ILE 102           HN       ILE 102  -5.497  -0.577  -9.407
  784    HA   ILE 102           HA       ILE 102  -7.261   1.056  -7.763
  785    HB   ILE 102           HB       ILE 102  -5.397  -1.173  -6.900
  786   1HG1  ILE 102          HG12      ILE 102  -6.879  -1.920  -8.731
  787   2HG1  ILE 102          HG11      ILE 102  -7.342  -2.666  -7.204
  788   1HG2  ILE 102          HG23      ILE 102  -6.314   0.202  -5.070
  789   2HG2  ILE 102          HG22      ILE 102  -7.945  -0.064  -5.684
  790   3HG2  ILE 102          HG21      ILE 102  -7.010  -1.418  -5.050
  791   1HD1  ILE 102          HD13      ILE 102  -9.101  -0.919  -6.921
  792   2HD1  ILE 102          HD12      ILE 102  -8.671  -0.266  -8.502
  793   3HD1  ILE 102          HD11      ILE 102  -9.346  -1.890  -8.373
  794    H    PHE 103           HN       PHE 103  -3.770   0.638  -8.108
  795    HA   PHE 103           HA       PHE 103  -2.974   2.072  -5.765
  796   1HB   PHE 103           HB2      PHE 103  -1.644   1.516  -8.417
  797   2HB   PHE 103           HB1      PHE 103  -0.857   2.514  -7.196
  798    HD1  PHE 103           HD2      PHE 103  -1.361   1.360  -4.670
  799    HD2  PHE 103           HD1      PHE 103  -0.819  -0.660  -8.421
  800    HE1  PHE 103           HE2      PHE 103  -0.635  -0.682  -3.465
  801    HE2  PHE 103           HE1      PHE 103  -0.094  -2.702  -7.215
  802    HZ   PHE 103           HZ       PHE 103  -0.001  -2.712  -4.737
  803    H    THR 104           HN       THR 104  -3.296   3.187  -9.154
  804    HA   THR 104           HA       THR 104  -2.785   5.947  -8.568
  805    HB   THR 104           HB       THR 104  -4.276   6.132 -10.797
  806    HG1  THR 104           HG1      THR 104  -3.529   3.420 -10.518
  807   1HG2  THR 104          HG21      THR 104  -1.766   6.488 -10.406
  808   2HG2  THR 104          HG23      THR 104  -1.564   4.807 -10.902
  809   3HG2  THR 104          HG22      THR 104  -2.247   5.982 -12.025
  810    H    ALA 105           HN       ALA 105  -5.602   3.943  -8.212
  811    HA   ALA 105           HA       ALA 105  -7.582   6.043  -8.204
  812   1HB   ALA 105           HB1      ALA 105  -7.955   3.499  -8.410
  813   2HB   ALA 105           HB3      ALA 105  -7.794   3.458  -6.654
  814   3HB   ALA 105           HB2      ALA 105  -9.089   4.396  -7.399
  815    H    PHE 106           HN       PHE 106  -5.639   4.491  -5.662
  816    HA   PHE 106           HA       PHE 106  -6.729   6.453  -3.697
  817   1HB   PHE 106           HB2      PHE 106  -5.278   3.819  -3.383
  818   2HB   PHE 106           HB1      PHE 106  -5.511   4.932  -2.034
  819    HD1  PHE 106           HD1      PHE 106  -7.178   2.678  -4.421
  820    HD2  PHE 106           HD2      PHE 106  -7.735   5.379  -1.127
  821    HE1  PHE 106           HE1      PHE 106  -9.485   1.822  -4.109
  822    HE2  PHE 106           HE2      PHE 106 -10.041   4.523  -0.815
  823    HZ   PHE 106           HZ       PHE 106 -10.916   2.744  -2.307
  824    H    LYS 107           HN       LYS 107  -4.435   6.640  -5.858
  825    HA   LYS 107           HA       LYS 107  -2.016   7.094  -4.345
  826   1HB   LYS 107           HB2      LYS 107  -2.114   6.646  -6.823
  827   2HB   LYS 107           HB1      LYS 107  -2.766   8.271  -7.036
  828   1HG   LYS 107           HG2      LYS 107  -0.688   9.047  -5.682
  829   2HG   LYS 107           HG1      LYS 107  -0.031   7.456  -6.071
  830   1HD   LYS 107           HD2      LYS 107  -1.186   9.224  -8.223
  831   2HD   LYS 107           HD1      LYS 107   0.488   9.406  -7.699
  832   1HE   LYS 107           HE2      LYS 107   0.924   7.041  -8.214
  833   2HE   LYS 107           HE1      LYS 107  -0.757   6.831  -8.707
  834   1HZ   LYS 107           HZ1      LYS 107  -0.366   8.608 -10.377
  835   2HZ   LYS 107           HZ3      LYS 107   1.283   8.567  -9.981
  836   3HZ   LYS 107           HZ2      LYS 107   0.537   7.194 -10.648
  837    H    ASP 108           HN       ASP 108  -4.840   9.007  -5.046
  838    HA   ASP 108           HA       ASP 108  -3.698  11.608  -4.586
  839   1HB   ASP 108           HB2      ASP 108  -5.978  11.033  -5.635
  840   2HB   ASP 108           HB1      ASP 108  -6.558  10.843  -3.980
  841    H    ASP 109           HN       ASP 109  -5.356   9.281  -2.453
  842    HA   ASP 109           HA       ASP 109  -4.627  10.973  -0.112
  843   1HB   ASP 109           HB2      ASP 109  -6.594   8.718  -0.519
  844   2HB   ASP 109           HB1      ASP 109  -6.122   9.247   1.097
  845    H    VAL 110           HN       VAL 110  -2.559   9.532  -1.479
  846    HA   VAL 110           HA       VAL 110  -2.013   7.105   0.084
  847    HB   VAL 110           HB       VAL 110  -1.338   7.236  -2.287
  848   1HG1  VAL 110          HG11      VAL 110  -0.839   9.773  -2.055
  849   2HG1  VAL 110          HG13      VAL 110   0.756   9.257  -1.506
  850   3HG1  VAL 110          HG12      VAL 110   0.193   8.817  -3.119
  851   1HG2  VAL 110          HG22      VAL 110   0.062   6.081  -0.343
  852   2HG2  VAL 110          HG21      VAL 110   0.676   6.125  -1.996
  853   3HG2  VAL 110          HG23      VAL 110   1.264   7.286  -0.805
  854    H    ASP 111           HN       ASP 111  -0.343   6.916   1.641
  855    HA   ASP 111           HA       ASP 111   0.851   9.490   2.586
  856   1HB   ASP 111           HB2      ASP 111  -0.365   7.278   4.266
  857   2HB   ASP 111           HB1      ASP 111   0.570   8.623   4.921
  858    H    THR 112           HN       THR 112   1.056   5.985   3.314
  859    HA   THR 112           HA       THR 112   4.007   6.244   3.461
  860    HB   THR 112           HB       THR 112   2.394   3.739   3.967
  861    HG1  THR 112           HG1      THR 112   2.000   5.940   5.201
  862   1HG2  THR 112          HG23      THR 112   5.051   4.781   4.989
  863   2HG2  THR 112          HG22      THR 112   4.300   3.264   5.487
  864   3HG2  THR 112          HG21      THR 112   4.823   3.483   3.817
  865    H    LEU 113           HN       LEU 113   5.311   4.510   2.358
  866    HA   LEU 113           HA       LEU 113   4.020   3.378  -0.068
  867   1HB   LEU 113           HB2      LEU 113   6.364   5.287  -0.035
  868   2HB   LEU 113           HB1      LEU 113   6.070   4.190  -1.385
  869    HG   LEU 113           HG       LEU 113   3.907   6.015  -0.336
  870   1HD1  LEU 113          HD11      LEU 113   6.111   6.587  -2.322
  871   2HD1  LEU 113          HD13      LEU 113   4.572   7.448  -2.371
  872   3HD1  LEU 113          HD12      LEU 113   5.603   7.564  -0.943
  873   1HD2  LEU 113          HD21      LEU 113   4.380   4.289  -2.745
  874   2HD2  LEU 113          HD23      LEU 113   2.926   4.455  -1.760
  875   3HD2  LEU 113          HD22      LEU 113   3.360   5.719  -2.911
  876    H    LEU 114           HN       LEU 114   4.355   1.292   0.796
  877    HA   LEU 114           HA       LEU 114   7.102   0.500   1.562
  878   1HB   LEU 114           HB2      LEU 114   4.463  -0.995   1.574
  879   2HB   LEU 114           HB1      LEU 114   5.998  -1.701   2.082
  880    HG   LEU 114           HG       LEU 114   4.996   0.881   3.277
  881   1HD1  LEU 114          HD12      LEU 114   3.246  -0.857   3.578
  882   2HD1  LEU 114          HD11      LEU 114   4.454  -1.929   4.288
  883   3HD1  LEU 114          HD13      LEU 114   4.015  -0.428   5.105
  884   1HD2  LEU 114          HD22      LEU 114   6.909  -1.303   4.161
  885   2HD2  LEU 114          HD21      LEU 114   7.334   0.340   3.677
  886   3HD2  LEU 114          HD23      LEU 114   6.435   0.065   5.169
  887    H    VAL 115           HN       VAL 115   8.440  -0.065  -0.080
  888    HA   VAL 115           HA       VAL 115   7.269  -1.592  -2.371
  889    HB   VAL 115           HB       VAL 115   7.957   0.683  -3.044
  890   1HG1  VAL 115          HG11      VAL 115   9.702   0.943  -1.263
  891   2HG1  VAL 115          HG13      VAL 115  10.740  -0.149  -2.179
  892   3HG1  VAL 115          HG12      VAL 115  10.267   1.404  -2.869
  893   1HG2  VAL 115          HG22      VAL 115   8.245  -1.264  -4.603
  894   2HG2  VAL 115          HG21      VAL 115   9.381   0.049  -4.912
  895   3HG2  VAL 115          HG23      VAL 115   9.917  -1.398  -4.059
  896    H    THR 116           HN       THR 116   8.320  -3.476  -2.935
  897    HA   THR 116           HA       THR 116  10.680  -4.230  -1.261
  898    HB   THR 116           HB       THR 116   8.773  -6.070  -2.737
  899    HG1  THR 116           HG1      THR 116   7.515  -5.896  -1.082
  900   1HG2  THR 116          HG21      THR 116  11.028  -6.978  -2.247
  901   2HG2  THR 116          HG23      THR 116  10.801  -6.583  -0.542
  902   3HG2  THR 116          HG22      THR 116   9.774  -7.794  -1.312
  903    H    ARG 117           HN       ARG 117  12.381  -3.539  -2.563
  904    HA   ARG 117           HA       ARG 117  12.385  -4.104  -5.446
  905   1HB   ARG 117           HB2      ARG 117  14.439  -2.891  -3.577
  906   2HB   ARG 117           HB1      ARG 117  14.708  -3.111  -5.306
  907   1HG   ARG 117           HG2      ARG 117  12.730  -1.726  -5.798
  908   2HG   ARG 117           HG1      ARG 117  12.450  -1.508  -4.071
  909   1HD   ARG 117           HD2      ARG 117  14.417  -0.223  -3.795
  910   2HD   ARG 117           HD1      ARG 117  15.087  -0.763  -5.335
  911    HE   ARG 117           HE       ARG 117  12.615   0.649  -5.769
  912   1HH1  ARG 117          HH21      ARG 117  15.960   1.099  -4.941
  913   2HH1  ARG 117          HH22      ARG 117  16.028   2.701  -5.596
  914   1HH2  ARG 117          HH11      ARG 117  12.718   2.728  -6.614
  915   2HH2  ARG 117          HH12      ARG 117  14.201   3.619  -6.538
  916    H    LEU 118           HN       LEU 118  13.385  -5.830  -6.405
  917    HA   LEU 118           HA       LEU 118  14.795  -7.752  -4.606
  918   1HB   LEU 118           HB2      LEU 118  12.994  -8.041  -6.947
  919   2HB   LEU 118           HB1      LEU 118  14.350  -9.166  -6.886
  920    HG   LEU 118           HG       LEU 118  13.700  -9.717  -4.521
  921   1HD1  LEU 118          HD11      LEU 118  12.434  -7.565  -4.173
  922   2HD1  LEU 118          HD13      LEU 118  11.166  -8.206  -5.217
  923   3HD1  LEU 118          HD12      LEU 118  11.540  -9.006  -3.690
  924   1HD2  LEU 118          HD21      LEU 118  12.962 -11.029  -6.570
  925   2HD2  LEU 118          HD23      LEU 118  11.919 -11.205  -5.159
  926   3HD2  LEU 118          HD22      LEU 118  11.436 -10.151  -6.487
  927    H    ALA 119           HN       ALA 119  16.863  -8.466  -5.153
  928    HA   ALA 119           HA       ALA 119  18.436  -6.730  -6.869
  929   1HB   ALA 119           HB1      ALA 119  19.223  -7.964  -4.754
  930   2HB   ALA 119           HB3      ALA 119  19.321  -9.403  -5.770
  931   3HB   ALA 119           HB2      ALA 119  20.316  -7.994  -6.138
  932    H    GLY 120           HN       GLY 120  17.157 -10.029  -7.125
  933   1HA   GLY 120           HA2      GLY 120  18.472 -10.633  -9.628
  934   2HA   GLY 120           HA1      GLY 120  17.103 -11.514  -8.948
  935    H    SER 121           HN       SER 121  17.794 -10.213 -11.704
  936    HA   SER 121           HA       SER 121  15.552  -8.336 -12.043
  937   1HB   SER 121           HB2      SER 121  16.317  -8.271 -14.409
  938   2HB   SER 121           HB1      SER 121  17.627  -7.933 -13.281
  939    HG   SER 121           HG       SER 121  18.574  -9.506 -14.316
  940    H    PHE 122           HN       PHE 122  13.667  -8.788 -13.236
  941    HA   PHE 122           HA       PHE 122  13.297 -11.515 -14.326
  942   1HB   PHE 122           HB2      PHE 122  11.528 -10.334 -12.161
  943   2HB   PHE 122           HB1      PHE 122  11.188 -11.820 -13.048
  944    HD1  PHE 122           HD2      PHE 122  12.710 -13.790 -12.821
  945    HD2  PHE 122           HD1      PHE 122  13.152 -10.273 -10.394
  946    HE1  PHE 122           HE2      PHE 122  14.138 -15.061 -11.240
  947    HE2  PHE 122           HE1      PHE 122  14.580 -11.544  -8.814
  948    HZ   PHE 122           HZ       PHE 122  15.073 -13.938  -9.237
  949    H    GLU 123           HN       GLU 123  12.336 -11.261 -16.273
  950    HA   GLU 123           HA       GLU 123  11.078  -8.711 -16.985
  951   1HB   GLU 123           HB2      GLU 123  10.780  -9.818 -19.218
  952   2HB   GLU 123           HB1      GLU 123  12.453  -9.823 -18.656
  953   1HG   GLU 123           HG2      GLU 123  12.168 -12.127 -17.819
  954   2HG   GLU 123           HG1      GLU 123  10.496 -12.125 -18.381
  955    H    GLY 124           HN       GLY 124   8.878  -8.655 -17.951
  956   1HA   GLY 124           HA2      GLY 124   7.037 -10.854 -17.416
  957   2HA   GLY 124           HA1      GLY 124   6.829  -9.497 -16.308
  958    H    ASP 125           HN       ASP 125   4.980  -8.511 -17.016
  959    HA   ASP 125           HA       ASP 125   5.009  -7.419 -19.781
  960   1HB   ASP 125           HB2      ASP 125   3.642  -9.587 -19.638
  961   2HB   ASP 125           HB1      ASP 125   2.520  -8.682 -18.620
  962    H    THR 126           HN       THR 126   3.675  -7.389 -16.510
  963    HA   THR 126           HA       THR 126   2.495  -4.704 -16.974
  964    HB   THR 126           HB       THR 126   2.452  -6.232 -14.371
  965    HG1  THR 126           HG1      THR 126   0.253  -6.511 -15.933
  966   1HG2  THR 126          HG21      THR 126   1.676  -3.816 -14.581
  967   2HG2  THR 126          HG23      THR 126   0.390  -4.413 -15.629
  968   3HG2  THR 126          HG22      THR 126   0.478  -4.946 -13.950
  969    H    LYS 127           HN       LYS 127   3.272  -2.857 -15.934
  970    HA   LYS 127           HA       LYS 127   5.818  -3.191 -14.394
  971   1HB   LYS 127           HB2      LYS 127   5.039  -1.103 -16.443
  972   2HB   LYS 127           HB1      LYS 127   6.393  -0.888 -15.334
  973   1HG   LYS 127           HG2      LYS 127   7.335  -3.065 -16.165
  974   2HG   LYS 127           HG1      LYS 127   6.054  -3.100 -17.377
  975   1HD   LYS 127           HD2      LYS 127   7.873  -0.709 -17.090
  976   2HD   LYS 127           HD1      LYS 127   8.325  -2.093 -18.086
  977   1HE   LYS 127           HE2      LYS 127   5.737  -0.546 -18.390
  978   2HE   LYS 127           HE1      LYS 127   7.171  -0.292 -19.385
  979   1HZ   LYS 127           HZ3      LYS 127   6.971  -2.854 -19.715
  980   2HZ   LYS 127           HZ2      LYS 127   5.344  -2.587 -19.301
  981   3HZ   LYS 127           HZ1      LYS 127   6.025  -1.796 -20.643
  982    H    MET 128           HN       MET 128   6.241  -1.062 -13.083
  983    HA   MET 128           HA       MET 128   3.766  -0.519 -11.544
  984   1HB   MET 128           HB2      MET 128   5.944  -1.179 -10.423
  985   2HB   MET 128           HB1      MET 128   6.591   0.384 -10.924
  986   1HG   MET 128           HG2      MET 128   5.758   0.644  -8.676
  987   2HG   MET 128           HG1      MET 128   4.632   1.470  -9.751
  988   1HE   MET 128           HE3      MET 128   2.921   1.703  -8.498
  989   2HE   MET 128           HE2      MET 128   1.693   0.523  -8.046
  990   3HE   MET 128           HE1      MET 128   3.064   0.812  -6.977
  991    H    ILE 129           HN       ILE 129   3.083   1.653 -11.094
  992    HA   ILE 129           HA       ILE 129   3.412   3.479 -13.327
  993    HB   ILE 129           HB       ILE 129   1.990   5.001 -11.930
  994   1HG1  ILE 129          HG12      ILE 129   1.980   2.702  -9.955
  995   2HG1  ILE 129          HG11      ILE 129   2.971   4.146  -9.746
  996   1HG2  ILE 129          HG21      ILE 129   1.172   2.982 -13.374
  997   2HG2  ILE 129          HG23      ILE 129   0.818   2.231 -11.818
  998   3HG2  ILE 129          HG22      ILE 129   0.035   3.747 -12.264
  999   1HD1  ILE 129          HD12      ILE 129   0.718   5.427 -10.127
 1000   2HD1  ILE 129          HD11      ILE 129  -0.024   3.888  -9.692
 1001   3HD1  ILE 129          HD13      ILE 129   1.040   4.707  -8.549
 1002    HA   PRO 130           HA       PRO 130   6.704   6.028 -11.761
 1003   1HB   PRO 130           HB2      PRO 130   5.840   8.499 -12.757
 1004   2HB   PRO 130           HB1      PRO 130   6.776   7.291 -13.648
 1005   1HG   PRO 130           HG2      PRO 130   4.067   8.107 -14.087
 1006   2HG   PRO 130           HG1      PRO 130   5.015   6.917 -14.990
 1007   1HD   PRO 130           HD2      PRO 130   2.936   6.471 -12.984
 1008   2HD   PRO 130           HD1      PRO 130   3.655   5.324 -14.127
 1009    H    LEU 131           HN       LEU 131   6.502   6.149  -9.511
 1010    HA   LEU 131           HA       LEU 131   4.470   7.902  -8.298
 1011   1HB   LEU 131           HB2      LEU 131   6.662   6.161  -7.139
 1012   2HB   LEU 131           HB1      LEU 131   5.600   7.163  -6.149
 1013    HG   LEU 131           HG       LEU 131   4.562   5.123  -8.129
 1014   1HD1  LEU 131          HD11      LEU 131   5.931   4.031  -6.361
 1015   2HD1  LEU 131          HD13      LEU 131   4.945   4.825  -5.134
 1016   3HD1  LEU 131          HD12      LEU 131   4.220   3.634  -6.213
 1017   1HD2  LEU 131          HD23      LEU 131   3.366   6.773  -5.893
 1018   2HD2  LEU 131          HD22      LEU 131   2.891   6.740  -7.590
 1019   3HD2  LEU 131          HD21      LEU 131   2.549   5.356  -6.552
 1020    H    ASN 132           HN       ASN 132   4.931   9.849  -7.230
 1021    HA   ASN 132           HA       ASN 132   7.304  11.275  -8.149
 1022   1HB   ASN 132           HB2      ASN 132   4.914  12.216  -7.698
 1023   2HB   ASN 132           HB1      ASN 132   5.432  12.278  -6.012
 1024   1HD2  ASN 132          HD22      ASN 132   8.163  14.625  -6.890
 1025   2HD2  ASN 132          HD21      ASN 132   8.029  13.129  -6.098
 1026    H    TRP 133           HN       TRP 133   8.955   9.922  -7.136
 1027    HA   TRP 133           HA       TRP 133   9.092   9.611  -4.261
 1028   1HB   TRP 133           HB2      TRP 133  11.252   9.382  -6.378
 1029   2HB   TRP 133           HB1      TRP 133  11.418   8.860  -4.702
 1030    HD1  TRP 133           HD1      TRP 133   9.946   7.852  -8.017
 1031    HE1  TRP 133           HE1      TRP 133   8.873   5.516  -7.809
 1032    HE3  TRP 133           HE3      TRP 133  10.143   7.236  -2.950
 1033    HZ2  TRP 133           HZ2      TRP 133   8.190   3.636  -5.765
 1034    HZ3  TRP 133           HZ3      TRP 133   9.276   5.166  -1.901
 1035    HH2  TRP 133           HH2      TRP 133   8.301   3.366  -3.300
 1036    H    ASP 134           HN       ASP 134   9.868  12.180  -6.427
 1037    HA   ASP 134           HA       ASP 134  11.900  13.450  -4.785
 1038   1HB   ASP 134           HB2      ASP 134  11.500  13.830  -7.281
 1039   2HB   ASP 134           HB1      ASP 134  10.116  14.817  -6.809
 1040    H    ASP 135           HN       ASP 135   8.887  12.803  -3.906
 1041    HA   ASP 135           HA       ASP 135   8.527  15.424  -2.507
 1042   1HB   ASP 135           HB2      ASP 135   6.515  13.593  -3.798
 1043   2HB   ASP 135           HB1      ASP 135   6.033  14.632  -2.456
 1044    H    PHE 136           HN       PHE 136   8.391  11.913  -2.334
 1045    HA   PHE 136           HA       PHE 136   7.535  11.889   0.467
 1046   1HB   PHE 136           HB2      PHE 136   8.549   9.731  -1.402
 1047   2HB   PHE 136           HB1      PHE 136   8.081   9.423   0.270
 1048    HD1  PHE 136           HD2      PHE 136   5.725   9.893   1.013
 1049    HD2  PHE 136           HD1      PHE 136   6.910  10.053  -3.113
 1050    HE1  PHE 136           HE2      PHE 136   3.347   9.766   0.325
 1051    HE2  PHE 136           HE1      PHE 136   4.531   9.927  -3.801
 1052    HZ   PHE 136           HZ       PHE 136   2.749   9.784  -2.082
 1053    H    THR 137           HN       THR 137   9.010  10.531   2.015
 1054    HA   THR 137           HA       THR 137  11.892  11.109   1.572
 1055    HB   THR 137           HB       THR 137  10.598  11.790   4.210
 1056    HG1  THR 137           HG1      THR 137   9.654  13.011   2.467
 1057   1HG2  THR 137          HG21      THR 137  13.201  12.380   2.811
 1058   2HG2  THR 137          HG23      THR 137  12.642  13.379   4.153
 1059   3HG2  THR 137          HG22      THR 137  12.944  11.659   4.401
 1060    H    LYS 138           HN       LYS 138  12.964   9.247   1.976
 1061    HA   LYS 138           HA       LYS 138  11.728   6.968   3.222
 1062   1HB   LYS 138           HB2      LYS 138  13.678   7.002   1.540
 1063   2HB   LYS 138           HB1      LYS 138  14.710   7.366   2.924
 1064   1HG   LYS 138           HG2      LYS 138  14.264   5.304   3.960
 1065   2HG   LYS 138           HG1      LYS 138  12.799   5.040   3.014
 1066   1HD   LYS 138           HD2      LYS 138  14.435   3.583   2.070
 1067   2HD   LYS 138           HD1      LYS 138  14.317   4.946   0.956
 1068   1HE   LYS 138           HE2      LYS 138  16.338   5.907   1.740
 1069   2HE   LYS 138           HE1      LYS 138  16.348   4.903   3.190
 1070   1HZ   LYS 138           HZ1      LYS 138  16.377   3.562   0.590
 1071   2HZ   LYS 138           HZ3      LYS 138  17.807   4.316   1.104
 1072   3HZ   LYS 138           HZ2      LYS 138  17.099   3.100   2.057
 1073    H    VAL 139           HN       VAL 139  12.330   5.972   5.258
 1074    HA   VAL 139           HA       VAL 139  13.683   7.771   7.211
 1075    HB   VAL 139           HB       VAL 139  11.913   7.184   8.890
 1076   1HG1  VAL 139          HG11      VAL 139  11.133   8.645   6.356
 1077   2HG1  VAL 139          HG13      VAL 139  10.124   8.641   7.803
 1078   3HG1  VAL 139          HG12      VAL 139  11.743   9.339   7.858
 1079   1HG2  VAL 139          HG21      VAL 139  10.514   6.089   6.427
 1080   2HG2  VAL 139          HG23      VAL 139  11.088   5.138   7.796
 1081   3HG2  VAL 139          HG22      VAL 139   9.771   6.289   8.013
 1082    H    SER 140           HN       SER 140  12.567   4.535   6.341
 1083    HA   SER 140           HA       SER 140  14.864   3.394   7.814
 1084   1HB   SER 140           HB2      SER 140  12.769   3.447   9.320
 1085   2HB   SER 140           HB1      SER 140  12.110   2.228   8.234
 1086    HG   SER 140           HG       SER 140  14.708   1.864   9.179
 1087    H    SER 141           HN       SER 141  15.098   1.018   7.259
 1088    HA   SER 141           HA       SER 141  13.651   0.047   4.903
 1089   1HB   SER 141           HB2      SER 141  15.395   1.624   3.977
 1090   2HB   SER 141           HB1      SER 141  16.627   0.573   4.669
 1091    HG   SER 141           HG       SER 141  14.581  -0.389   2.966
 1092    H    ARG 142           HN       ARG 142  13.397  -2.078   5.344
 1093    HA   ARG 142           HA       ARG 142  15.329  -3.433   7.135
 1094   1HB   ARG 142           HB2      ARG 142  12.780  -3.587   7.395
 1095   2HB   ARG 142           HB1      ARG 142  12.806  -4.616   5.962
 1096   1HG   ARG 142           HG2      ARG 142  14.109  -6.276   7.035
 1097   2HG   ARG 142           HG1      ARG 142  14.588  -5.180   8.333
 1098   1HD   ARG 142           HD2      ARG 142  12.133  -5.068   8.988
 1099   2HD   ARG 142           HD1      ARG 142  11.857  -6.396   7.861
 1100    HE   ARG 142           HE       ARG 142  13.076  -6.622  10.483
 1101   1HH1  ARG 142          HH21      ARG 142  13.053  -7.895   7.250
 1102   2HH1  ARG 142          HH22      ARG 142  13.624  -9.457   7.733
 1103   1HH2  ARG 142          HH11      ARG 142  13.817  -8.653  11.097
 1104   2HH2  ARG 142          HH12      ARG 142  14.053  -9.884   9.902
 1105    H    THR 143           HN       THR 143  17.080  -4.229   6.058
 1106    HA   THR 143           HA       THR 143  16.781  -5.262   3.304
 1107    HB   THR 143           HB       THR 143  19.312  -5.263   4.954
 1108    HG1  THR 143           HG1      THR 143  18.550  -3.177   5.030
 1109   1HG2  THR 143          HG23      THR 143  18.613  -5.288   2.020
 1110   2HG2  THR 143          HG22      THR 143  20.219  -4.826   2.580
 1111   3HG2  THR 143          HG21      THR 143  19.598  -6.441   2.921
 1112    H    VAL 144           HN       VAL 144  17.055  -7.435   2.755
 1113    HA   VAL 144           HA       VAL 144  17.679  -9.374   4.909
 1114    HB   VAL 144           HB       VAL 144  15.222  -9.121   4.955
 1115   1HG1  VAL 144          HG13      VAL 144  15.003  -8.385   2.573
 1116   2HG1  VAL 144          HG12      VAL 144  15.303 -10.050   2.071
 1117   3HG1  VAL 144          HG11      VAL 144  13.865  -9.658   3.012
 1118   1HG2  VAL 144          HG21      VAL 144  16.406 -11.385   5.231
 1119   2HG2  VAL 144          HG23      VAL 144  14.685 -11.438   4.855
 1120   3HG2  VAL 144          HG22      VAL 144  15.874 -11.739   3.588
 1121    H    GLU 145           HN       GLU 145  18.873 -11.069   4.123
 1122    HA   GLU 145           HA       GLU 145  19.174 -11.252   1.152
 1123   1HB   GLU 145           HB2      GLU 145  21.113 -11.877   3.397
 1124   2HB   GLU 145           HB1      GLU 145  21.406 -12.308   1.711
 1125   1HG   GLU 145           HG2      GLU 145  21.059  -9.870   1.127
 1126   2HG   GLU 145           HG1      GLU 145  21.050  -9.528   2.858
 1127    H    ASP 146           HN       ASP 146  18.260 -13.044   0.299
 1128    HA   ASP 146           HA       ASP 146  17.448 -15.277   2.014
 1129   1HB   ASP 146           HB2      ASP 146  16.347 -14.232  -0.212
 1130   2HB   ASP 146           HB1      ASP 146  17.310 -15.511  -0.951
 1131    H    THR 147           HN       THR 147  17.865 -17.536   0.617
 1132    HA   THR 147           HA       THR 147  20.616 -18.162   1.096
 1133    HB   THR 147           HB       THR 147  20.047 -20.269  -0.237
 1134    HG1  THR 147           HG1      THR 147  18.391 -19.146  -1.461
 1135   1HG2  THR 147          HG21      THR 147  19.716 -19.866   2.282
 1136   2HG2  THR 147          HG23      THR 147  18.010 -19.636   1.898
 1137   3HG2  THR 147          HG22      THR 147  18.790 -21.180   1.556
 1138    H    ASN 148           HN       ASN 148  18.827 -17.417  -1.887
 1139    HA   ASN 148           HA       ASN 148  21.314 -17.607  -3.475
 1140   1HB   ASN 148           HB2      ASN 148  18.698 -18.164  -4.082
 1141   2HB   ASN 148           HB1      ASN 148  18.868 -16.544  -4.758
 1142   1HD2  ASN 148          HD22      ASN 148  20.316 -18.004  -7.623
 1143   2HD2  ASN 148          HD21      ASN 148  19.103 -17.001  -6.986
 1144    HA   PRO 149           HA       PRO 149  22.098 -13.226  -3.356
 1145   1HB   PRO 149           HB2      PRO 149  23.379 -13.029  -5.851
 1146   2HB   PRO 149           HB1      PRO 149  24.148 -13.411  -4.306
 1147   1HG   PRO 149           HG2      PRO 149  23.775 -15.129  -6.556
 1148   2HG   PRO 149           HG1      PRO 149  24.536 -15.508  -5.005
 1149   1HD   PRO 149           HD2      PRO 149  21.879 -16.234  -5.974
 1150   2HD   PRO 149           HD1      PRO 149  22.775 -16.864  -4.582
 1151    H    ALA 150           HN       ALA 150  20.437 -14.630  -6.094
 1152    HA   ALA 150           HA       ALA 150  19.626 -12.029  -7.196
 1153   1HB   ALA 150           HB1      ALA 150  19.046 -14.906  -7.877
 1154   2HB   ALA 150           HB3      ALA 150  18.090 -13.608  -8.591
 1155   3HB   ALA 150           HB2      ALA 150  19.831 -13.674  -8.866
 1156    H    LEU 151           HN       LEU 151  18.441 -14.339  -4.891
 1157    HA   LEU 151           HA       LEU 151  15.685 -13.295  -4.973
 1158   1HB   LEU 151           HB2      LEU 151  17.102 -15.406  -3.346
 1159   2HB   LEU 151           HB1      LEU 151  15.482 -14.853  -2.917
 1160    HG   LEU 151           HG       LEU 151  16.141 -15.752  -5.721
 1161   1HD1  LEU 151          HD13      LEU 151  16.694 -17.553  -4.039
 1162   2HD1  LEU 151          HD12      LEU 151  15.012 -17.492  -3.512
 1163   3HD1  LEU 151          HD11      LEU 151  15.402 -17.983  -5.160
 1164   1HD2  LEU 151          HD22      LEU 151  13.679 -15.214  -4.081
 1165   2HD2  LEU 151          HD21      LEU 151  14.065 -14.677  -5.716
 1166   3HD2  LEU 151          HD23      LEU 151  13.594 -16.352  -5.426
 1167    H    THR 152           HN       THR 152  18.211 -11.710  -4.107
 1168    HA   THR 152           HA       THR 152  17.609 -11.082  -1.296
 1169    HB   THR 152           HB       THR 152  19.398  -9.274  -1.744
 1170    HG1  THR 152           HG1      THR 152  20.406 -10.664  -3.818
 1171   1HG2  THR 152          HG23      THR 152  19.670 -11.659  -0.750
 1172   2HG2  THR 152          HG22      THR 152  20.375 -12.063  -2.316
 1173   3HG2  THR 152          HG21      THR 152  21.115 -10.817  -1.311
 1174    H    HIS 153           HN       HIS 153  16.705  -9.109  -0.584
 1175    HA   HIS 153           HA       HIS 153  15.912  -7.053  -2.513
 1176   1HB   HIS 153           HB2      HIS 153  13.470  -7.269  -1.965
 1177   2HB   HIS 153           HB1      HIS 153  14.103  -8.628  -2.894
 1178    HD1  HIS 153           HD1      HIS 153  14.931 -10.735  -1.294
 1179    HD2  HIS 153           HD2      HIS 153  12.186  -8.062   0.349
 1180    HE1  HIS 153           HE1      HIS 153  13.878 -11.914   0.685
 1181    H    THR 154           HN       THR 154  14.546  -5.335  -1.300
 1182    HA   THR 154           HA       THR 154  15.140  -5.295   1.615
 1183    HB   THR 154           HB       THR 154  15.757  -2.948  -0.197
 1184    HG1  THR 154           HG1      THR 154  17.908  -3.568   0.039
 1185   1HG2  THR 154          HG23      THR 154  15.242  -2.843   2.401
 1186   2HG2  THR 154          HG22      THR 154  16.908  -3.410   2.526
 1187   3HG2  THR 154          HG21      THR 154  16.552  -1.891   1.705
 1188    H    TYR 155           HN       TYR 155  13.452  -4.446   2.764
 1189    HA   TYR 155           HA       TYR 155  11.106  -3.485   1.248
 1190   1HB   TYR 155           HB2      TYR 155  11.491  -4.060   4.203
 1191   2HB   TYR 155           HB1      TYR 155   9.959  -3.615   3.452
 1192    HD1  TYR 155           HD2      TYR 155   8.847  -5.136   1.849
 1193    HD2  TYR 155           HD1      TYR 155  12.447  -6.264   3.904
 1194    HE1  TYR 155           HE2      TYR 155   8.460  -7.506   1.229
 1195    HE2  TYR 155           HE1      TYR 155  12.060  -8.633   3.283
 1196    HH   TYR 155           HH       TYR 155  10.862 -10.000   1.913
 1197    H    GLU 156           HN       GLU 156  11.568  -1.367   0.631
 1198    HA   GLU 156           HA       GLU 156  12.727   0.557   2.497
 1199   1HB   GLU 156           HB2      GLU 156  11.516   0.789  -0.267
 1200   2HB   GLU 156           HB1      GLU 156  12.074   2.197   0.640
 1201   1HG   GLU 156           HG2      GLU 156  14.319   1.182   0.831
 1202   2HG   GLU 156           HG1      GLU 156  13.763  -0.213  -0.095
 1203    H    VAL 157           HN       VAL 157  11.627   2.193   3.606
 1204    HA   VAL 157           HA       VAL 157   8.640   2.114   3.469
 1205    HB   VAL 157           HB       VAL 157  10.290   2.472   5.989
 1206   1HG1  VAL 157          HG11      VAL 157   8.038   3.561   5.928
 1207   2HG1  VAL 157          HG13      VAL 157   7.322   1.986   5.588
 1208   3HG1  VAL 157          HG12      VAL 157   8.143   2.269   7.124
 1209   1HG2  VAL 157          HG22      VAL 157   9.033   0.066   4.695
 1210   2HG2  VAL 157          HG21      VAL 157  10.591   0.203   5.510
 1211   3HG2  VAL 157          HG23      VAL 157   9.102   0.167   6.454
 1212    H    TRP 158           HN       TRP 158   8.227   4.044   2.459
 1213    HA   TRP 158           HA       TRP 158   9.713   6.466   3.364
 1214   1HB   TRP 158           HB2      TRP 158   7.969   5.976   0.931
 1215   2HB   TRP 158           HB1      TRP 158   8.727   7.520   1.321
 1216    HD1  TRP 158           HD1      TRP 158   9.934   3.843   1.047
 1217    HE1  TRP 158           HE1      TRP 158  12.201   3.841  -0.180
 1218    HE3  TRP 158           HE3      TRP 158  10.520   8.856   0.269
 1219    HZ2  TRP 158           HZ2      TRP 158  14.022   5.717  -1.340
 1220    HZ3  TRP 158           HZ3      TRP 158  12.528   9.720  -0.899
 1221    HH2  TRP 158           HH2      TRP 158  14.278   8.159  -1.703
 1222    H    GLN 159           HN       GLN 159   8.324   8.490   3.516
 1223    HA   GLN 159           HA       GLN 159   5.514   7.961   4.309
 1224   1HB   GLN 159           HB2      GLN 159   7.647   9.145   6.103
 1225   2HB   GLN 159           HB1      GLN 159   5.921   9.368   6.398
 1226   1HG   GLN 159           HG2      GLN 159   5.700   6.833   6.301
 1227   2HG   GLN 159           HG1      GLN 159   7.462   6.765   6.339
 1228   1HE2  GLN 159          HE22      GLN 159   5.625   8.366   9.663
 1229   2HE2  GLN 159          HE21      GLN 159   4.977   8.693   8.129
 1230    H    LYS 160           HN       LYS 160   4.180   9.687   3.832
 1231    HA   LYS 160           HA       LYS 160   5.256  11.828   2.189
 1232   1HB   LYS 160           HB2      LYS 160   2.923  10.726   2.037
 1233   2HB   LYS 160           HB1      LYS 160   2.484  11.775   3.385
 1234   1HG   LYS 160           HG2      LYS 160   3.389  13.715   1.982
 1235   2HG   LYS 160           HG1      LYS 160   3.408  12.589   0.624
 1236   1HD   LYS 160           HD2      LYS 160   0.991  12.145   0.983
 1237   2HD   LYS 160           HD1      LYS 160   0.984  13.329   2.290
 1238   1HE   LYS 160           HE2      LYS 160   1.890  15.007   0.586
 1239   2HE   LYS 160           HE1      LYS 160   1.482  13.817  -0.651
 1240   1HZ   LYS 160           HZ1      LYS 160  -0.586  14.421   1.305
 1241   2HZ   LYS 160           HZ3      LYS 160  -0.221  15.653   0.198
 1242   3HZ   LYS 160           HZ2      LYS 160  -0.717  14.128  -0.363
 1243    H    LYS 161           HN       LYS 161   6.475  13.353   3.229
 1244    HA   LYS 161           HA       LYS 161   5.173  15.051   5.227
 1245   1HB   LYS 161           HB2      LYS 161   6.240  13.048   6.471
 1246   2HB   LYS 161           HB1      LYS 161   7.787  13.776   6.038
 1247   1HG   LYS 161           HG2      LYS 161   7.084  15.889   7.124
 1248   2HG   LYS 161           HG1      LYS 161   5.560  15.132   7.589
 1249   1HD   LYS 161           HD2      LYS 161   6.683  13.544   9.000
 1250   2HD   LYS 161           HD1      LYS 161   8.263  14.020   8.377
 1251   1HE   LYS 161           HE2      LYS 161   6.447  15.992   9.767
 1252   2HE   LYS 161           HE1      LYS 161   7.583  14.984  10.664
 1253   1HZ   LYS 161           HZ1      LYS 161   9.310  15.849   9.045
 1254   2HZ   LYS 161           HZ3      LYS 161   8.172  17.028   8.610
 1255   3HZ   LYS 161           HZ2      LYS 161   8.737  16.945  10.210
 1256    H    ALA 162           HN       ALA 162   6.369  17.041   5.555
 1257    HA   ALA 162           HA       ALA 162   8.849  17.456   4.027
 1258   1HB   ALA 162           HB1      ALA 162   7.075  17.753   2.319
 1259   2HB   ALA 162           HB3      ALA 162   6.317  18.979   3.335
 1260   3HB   ALA 162           HB2      ALA 162   7.917  19.267   2.649
 1261   1H9   TMQ 170           H91      TMQ 170   0.212 -10.354  -6.284
 1262   2H9   TMQ 170           H92      TMQ 170  -0.726 -11.123  -4.996
 1263    HN1  TMQ 170           H1N      TMQ 170   1.414 -12.351  -6.556
 1264   1H17  TMQ 170           HM1      TMQ 170  -0.992  -9.001  -4.967
 1265   2H17  TMQ 170           HM2      TMQ 170  -0.281  -7.417  -4.660
 1266   3H17  TMQ 170           HM3      TMQ 170  -1.160  -8.259  -3.377
 1267   1H21  TMQ 170          HW11      TMQ 170  -1.249 -13.680  -0.192
 1268   2H21  TMQ 170          HW12      TMQ 170  -1.423 -12.643  -1.617
 1269   3H21  TMQ 170          HW13      TMQ 170   0.139 -13.396  -1.254
 1270   1H22  TMQ 170           HI1      TMQ 170   0.465 -16.991  -2.018
 1271   2H22  TMQ 170           HI2      TMQ 170  -0.227 -18.589  -2.335
 1272   3H22  TMQ 170           HI3      TMQ 170   0.866 -17.847  -3.515
 1273   1H23  TMQ 170          HW21      TMQ 170   0.811 -16.487  -7.796
 1274   2H23  TMQ 170          HW22      TMQ 170   1.211 -18.167  -7.407
 1275   3H23  TMQ 170          HW23      TMQ 170   2.048 -16.844  -6.579
 1276   1HN2  TMQ 170          HN21      TMQ 170   4.247  -6.122   0.507
 1277   2HN2  TMQ 170          HN22      TMQ 170   5.235  -7.524   0.264
 1278   1HN5  TMQ 170          HN41      TMQ 170  -0.279  -6.550  -2.872
 1279   2HN5  TMQ 170          HN42      TMQ 170   0.381  -5.477  -1.717
 1280    HN   TMQ 170           H1       TMQ 170   4.587  -9.128  -1.230
 1281    H7   TMQ 170           H7       TMQ 170   2.608 -11.918  -4.415
 1282    H8   TMQ 170           H8       TMQ 170   4.113 -10.941  -2.744
 1283    H12  TMQ 170           HP2      TMQ 170  -0.358 -12.490  -3.401
 1284    H16  TMQ 170           HP6      TMQ 170   0.878 -14.695  -6.906
   
  No H/Q in entry =        1284
  Start of MODEL    6
    1   1H    THR   1           HT2      THR   1  -3.506   5.910   5.117
    2   2H    THR   1           HT1      THR   1  -3.030   7.077   3.977
    3   3H    THR   1           HT3      THR   1  -4.674   6.720   4.187
    4    HA   THR   1           HA       THR   1  -4.351   4.495   3.339
    5    HB   THR   1           HB       THR   1  -3.027   6.468   1.466
    6    HG1  THR   1           HG1      THR   1  -5.626   6.436   1.121
    7   1HG2  THR   1          HG21      THR   1  -3.285   4.056   0.794
    8   2HG2  THR   1          HG23      THR   1  -5.030   4.255   0.956
    9   3HG2  THR   1          HG22      THR   1  -4.144   5.187  -0.251
   10    H    ALA   2           HN       ALA   2  -2.899   2.892   2.530
   11    HA   ALA   2           HA       ALA   2   0.008   3.473   2.892
   12   1HB   ALA   2           HB1      ALA   2  -1.536   1.104   3.985
   13   2HB   ALA   2           HB3      ALA   2   0.225   1.181   3.918
   14   3HB   ALA   2           HB2      ALA   2  -0.671   2.328   4.914
   15    H    PHE   3           HN       PHE   3   1.062   2.960   1.047
   16    HA   PHE   3           HA       PHE   3  -0.247   1.163  -0.913
   17   1HB   PHE   3           HB2      PHE   3   1.996   3.164  -1.033
   18   2HB   PHE   3           HB1      PHE   3   1.846   1.937  -2.290
   19    HD1  PHE   3           HD2      PHE   3  -0.591   4.042  -0.348
   20    HD2  PHE   3           HD1      PHE   3   0.806   2.752  -4.200
   21    HE1  PHE   3           HE2      PHE   3  -2.377   5.372  -1.441
   22    HE2  PHE   3           HE1      PHE   3  -0.978   4.082  -5.292
   23    HZ   PHE   3           HZ       PHE   3  -2.569   5.392  -3.913
   24    H    LEU   4           HN       LEU   4   0.872  -0.668  -1.795
   25    HA   LEU   4           HA       LEU   4   3.449  -1.510  -0.723
   26   1HB   LEU   4           HB2      LEU   4   1.891  -2.056   1.161
   27   2HB   LEU   4           HB1      LEU   4   0.984  -3.096   0.063
   28    HG   LEU   4           HG       LEU   4   3.259  -4.249  -0.396
   29   1HD1  LEU   4          HD11      LEU   4   3.836  -2.619   2.081
   30   2HD1  LEU   4          HD13      LEU   4   4.713  -4.109   1.727
   31   3HD1  LEU   4          HD12      LEU   4   4.799  -2.748   0.609
   32   1HD2  LEU   4          HD21      LEU   4   1.703  -4.435   2.188
   33   2HD2  LEU   4          HD23      LEU   4   1.591  -5.476   0.769
   34   3HD2  LEU   4          HD22      LEU   4   3.011  -5.557   1.812
   35    H    TRP   5           HN       TRP   5   4.283  -2.221  -2.634
   36    HA   TRP   5           HA       TRP   5   2.773  -4.310  -4.108
   37   1HB   TRP   5           HB2      TRP   5   3.247  -3.223  -6.270
   38   2HB   TRP   5           HB1      TRP   5   2.269  -2.175  -5.245
   39    HD1  TRP   5           HD1      TRP   5   5.366  -2.211  -7.232
   40    HE1  TRP   5           HE1      TRP   5   6.781  -0.109  -6.768
   41    HE3  TRP   5           HE3      TRP   5   2.994  -0.446  -3.064
   42    HZ2  TRP   5           HZ2      TRP   5   6.897   2.035  -4.881
   43    HZ3  TRP   5           HZ3      TRP   5   3.781   1.625  -1.955
   44    HH2  TRP   5           HH2      TRP   5   5.726   2.867  -2.858
   45    H    ALA   6           HN       ALA   6   4.104  -5.889  -4.980
   46    HA   ALA   6           HA       ALA   6   6.962  -5.742  -4.228
   47   1HB   ALA   6           HB2      ALA   6   5.599  -7.789  -3.738
   48   2HB   ALA   6           HB1      ALA   6   5.416  -8.035  -5.474
   49   3HB   ALA   6           HB3      ALA   6   7.014  -8.124  -4.735
   50    H    GLN   7           HN       GLN   7   8.218  -4.710  -5.717
   51    HA   GLN   7           HA       GLN   7   7.876  -5.491  -8.582
   52   1HB   GLN   7           HB2      GLN   7   8.548  -3.151  -9.178
   53   2HB   GLN   7           HB1      GLN   7   6.999  -3.234  -8.338
   54   1HG   GLN   7           HG2      GLN   7   7.935  -2.474  -6.298
   55   2HG   GLN   7           HG1      GLN   7   9.583  -2.794  -6.841
   56   1HE2  GLN   7          HE22      GLN   7   9.925   0.516  -7.960
   57   2HE2  GLN   7          HE21      GLN   7  10.629  -0.840  -7.220
   58    H    ASP   8           HN       ASP   8   9.823  -5.692  -9.759
   59    HA   ASP   8           HA       ASP   8  12.244  -5.980  -8.067
   60   1HB   ASP   8           HB2      ASP   8  13.186  -7.078 -10.146
   61   2HB   ASP   8           HB1      ASP   8  11.782  -7.893  -9.459
   62    H    ARG   9           HN       ARG   9  14.357  -5.284  -9.205
   63    HA   ARG   9           HA       ARG   9  14.322  -2.466  -9.626
   64   1HB   ARG   9           HB2      ARG   9  16.673  -2.793 -10.433
   65   2HB   ARG   9           HB1      ARG   9  16.351  -3.591  -8.893
   66   1HG   ARG   9           HG2      ARG   9  16.263  -5.728  -9.875
   67   2HG   ARG   9           HG1      ARG   9  16.004  -5.074 -11.493
   68   1HD   ARG   9           HD2      ARG   9  18.543  -4.498  -9.972
   69   2HD   ARG   9           HD1      ARG   9  18.367  -5.970 -10.927
   70    HE   ARG   9           HE       ARG   9  17.712  -3.492 -12.364
   71   1HH1  ARG   9          HH21      ARG   9  20.121  -5.852 -11.526
   72   2HH1  ARG   9          HH22      ARG   9  21.128  -5.480 -12.886
   73   1HH2  ARG   9          HH11      ARG   9  19.027  -3.021 -14.124
   74   2HH2  ARG   9          HH12      ARG   9  20.510  -3.886 -14.349
   75    H    ASP  10           HN       ASP  10  13.644  -5.070 -11.779
   76    HA   ASP  10           HA       ASP  10  14.306  -3.646 -14.240
   77   1HB   ASP  10           HB2      ASP  10  12.861  -6.197 -13.568
   78   2HB   ASP  10           HB1      ASP  10  12.759  -5.530 -15.198
   79    H    GLY  11           HN       GLY  11  12.233  -2.669 -12.075
   80   1HA   GLY  11           HA2      GLY  11  10.285  -1.365 -12.133
   81   2HA   GLY  11           HA1      GLY  11  10.565  -1.199 -13.866
   82    H    LEU  12           HN       LEU  12  10.074  -4.253 -12.151
   83    HA   LEU  12           HA       LEU  12   7.615  -4.669 -13.797
   84   1HB   LEU  12           HB2      LEU  12   9.753  -6.234 -13.860
   85   2HB   LEU  12           HB1      LEU  12   9.031  -6.911 -12.400
   86    HG   LEU  12           HG       LEU  12   6.847  -7.050 -13.769
   87   1HD1  LEU  12          HD11      LEU  12   7.722  -5.581 -15.609
   88   2HD1  LEU  12          HD13      LEU  12   8.843  -6.872 -16.045
   89   3HD1  LEU  12          HD12      LEU  12   7.103  -7.130 -16.182
   90   1HD2  LEU  12          HD21      LEU  12   8.600  -8.910 -13.169
   91   2HD2  LEU  12          HD23      LEU  12   7.368  -9.249 -14.384
   92   3HD2  LEU  12          HD22      LEU  12   9.006  -8.824 -14.883
   93    H    ILE  13           HN       ILE  13   5.953  -6.111 -12.679
   94    HA   ILE  13           HA       ILE  13   5.935  -5.809  -9.723
   95    HB   ILE  13           HB       ILE  13   3.568  -4.979  -9.839
   96   1HG1  ILE  13          HG12      ILE  13   4.218  -4.495 -12.762
   97   2HG1  ILE  13          HG11      ILE  13   3.201  -5.819 -12.193
   98   1HG2  ILE  13          HG21      ILE  13   5.739  -3.316 -11.147
   99   2HG2  ILE  13          HG23      ILE  13   4.203  -2.657 -10.584
  100   3HG2  ILE  13          HG22      ILE  13   5.330  -3.372  -9.432
  101   1HD1  ILE  13          HD13      ILE  13   1.882  -3.938 -10.947
  102   2HD1  ILE  13          HD12      ILE  13   2.673  -2.859 -12.097
  103   3HD1  ILE  13          HD11      ILE  13   1.625  -4.153 -12.678
  104    H    GLY  14           HN       GLY  14   4.686  -7.299 -12.649
  105   1HA   GLY  14           HA2      GLY  14   4.161  -9.780 -11.186
  106   2HA   GLY  14           HA1      GLY  14   2.710  -9.014 -11.834
  107    H    LYS  15           HN       LYS  15   2.740 -11.174 -13.062
  108    HA   LYS  15           HA       LYS  15   3.491 -10.699 -15.788
  109   1HB   LYS  15           HB2      LYS  15   5.748 -11.219 -14.718
  110   2HB   LYS  15           HB1      LYS  15   5.139 -12.850 -14.440
  111   1HG   LYS  15           HG2      LYS  15   4.645 -13.020 -16.896
  112   2HG   LYS  15           HG1      LYS  15   5.440 -11.460 -17.116
  113   1HD   LYS  15           HD2      LYS  15   7.544 -12.319 -16.375
  114   2HD   LYS  15           HD1      LYS  15   6.804 -13.804 -15.777
  115   1HE   LYS  15           HE2      LYS  15   6.212 -14.460 -18.065
  116   2HE   LYS  15           HE1      LYS  15   6.887 -12.954 -18.687
  117   1HZ   LYS  15           HZ1      LYS  15   8.602 -14.628 -17.014
  118   2HZ   LYS  15           HZ3      LYS  15   8.291 -15.158 -18.594
  119   3HZ   LYS  15           HZ2      LYS  15   9.006 -13.639 -18.335
  120    H    ASP  16           HN       ASP  16   1.779 -11.670 -16.744
  121    HA   ASP  16           HA       ASP  16   0.147 -13.268 -17.268
  122   1HB   ASP  16           HB2      ASP  16   2.475 -14.850 -16.300
  123   2HB   ASP  16           HB1      ASP  16   0.926 -15.692 -16.369
  124    H    GLY  17           HN       GLY  17  -0.075 -11.798 -14.778
  125   1HA   GLY  17           HA2      GLY  17  -1.782 -11.851 -13.114
  126   2HA   GLY  17           HA1      GLY  17  -1.980 -13.580 -13.407
  127    H    HIS  18           HN       HIS  18   0.236 -14.808 -12.862
  128    HA   HIS  18           HA       HIS  18   0.686 -14.336 -10.012
  129   1HB   HIS  18           HB2      HIS  18   2.194 -16.333 -10.214
  130   2HB   HIS  18           HB1      HIS  18   0.559 -16.632 -10.802
  131    HD1  HIS  18           HD1      HIS  18   4.088 -16.100 -12.006
  132    HD2  HIS  18           HD2      HIS  18   0.361 -17.083 -13.592
  133    HE1  HIS  18           HE1      HIS  18   4.498 -16.835 -14.396
  134    H    LEU  19           HN       LEU  19   3.067 -14.404  -9.227
  135    HA   LEU  19           HA       LEU  19   4.468 -12.169 -10.490
  136   1HB   LEU  19           HB2      LEU  19   5.029 -13.889  -8.066
  137   2HB   LEU  19           HB1      LEU  19   6.154 -12.650  -8.622
  138    HG   LEU  19           HG       LEU  19   3.248 -12.000  -8.159
  139   1HD1  LEU  19          HD13      LEU  19   5.501 -12.046  -6.132
  140   2HD1  LEU  19          HD12      LEU  19   3.985 -11.180  -5.890
  141   3HD1  LEU  19          HD11      LEU  19   3.980 -12.936  -6.052
  142   1HD2  LEU  19          HD21      LEU  19   5.835 -10.528  -8.522
  143   2HD2  LEU  19          HD23      LEU  19   4.254 -10.200  -9.233
  144   3HD2  LEU  19          HD22      LEU  19   4.568  -9.779  -7.549
  145    HA   PRO  20           HA       PRO  20   7.353 -14.594 -12.865
  146   1HB   PRO  20           HB2      PRO  20   9.455 -12.758 -12.897
  147   2HB   PRO  20           HB1      PRO  20   8.072 -12.760 -13.999
  148   1HG   PRO  20           HG2      PRO  20   8.709 -10.862 -11.939
  149   2HG   PRO  20           HG1      PRO  20   7.377 -10.823 -13.101
  150   1HD   PRO  20           HD2      PRO  20   7.320 -11.548 -10.280
  151   2HD   PRO  20           HD1      PRO  20   5.968 -11.242 -11.383
  152    H    TRP  21           HN       TRP  21   8.345 -13.269  -9.772
  153    HA   TRP  21           HA       TRP  21  10.564 -15.265  -9.635
  154   1HB   TRP  21           HB2      TRP  21  11.377 -13.874  -7.712
  155   2HB   TRP  21           HB1      TRP  21  11.329 -12.991  -9.236
  156    HD1  TRP  21           HD1      TRP  21   9.374 -13.390  -5.955
  157    HE1  TRP  21           HE1      TRP  21   7.943 -11.276  -5.594
  158    HE3  TRP  21           HE3      TRP  21  10.246 -10.968 -10.366
  159    HZ2  TRP  21           HZ2      TRP  21   7.259  -8.875  -6.991
  160    HZ3  TRP  21           HZ3      TRP  21   9.193  -8.772 -10.825
  161    HH2  TRP  21           HH2      TRP  21   7.702  -7.723  -9.144
  162    H    HIS  22           HN       HIS  22  10.840 -16.307  -7.461
  163    HA   HIS  22           HA       HIS  22   8.177 -16.796  -6.184
  164   1HB   HIS  22           HB2      HIS  22   9.300 -18.715  -7.469
  165   2HB   HIS  22           HB1      HIS  22  10.505 -18.726  -6.181
  166    HD1  HIS  22           HD1      HIS  22   6.681 -18.547  -6.230
  167    HD2  HIS  22           HD2      HIS  22   9.761 -20.587  -4.298
  168    HE1  HIS  22           HE1      HIS  22   5.575 -20.116  -4.579
  169    H    LEU  23           HN       LEU  23   8.532 -15.110  -4.623
  170    HA   LEU  23           HA       LEU  23  10.793 -15.584  -2.730
  171   1HB   LEU  23           HB2      LEU  23  10.464 -13.297  -3.855
  172   2HB   LEU  23           HB1      LEU  23   9.033 -13.127  -2.838
  173    HG   LEU  23           HG       LEU  23  10.470 -13.546  -0.831
  174   1HD1  LEU  23          HD13      LEU  23  12.582 -13.618  -2.983
  175   2HD1  LEU  23          HD12      LEU  23  12.988 -13.153  -1.331
  176   3HD1  LEU  23          HD11      LEU  23  12.322 -14.753  -1.658
  177   1HD2  LEU  23          HD21      LEU  23  10.043 -11.224  -2.145
  178   2HD2  LEU  23          HD23      LEU  23  10.996 -11.314  -0.664
  179   3HD2  LEU  23          HD22      LEU  23  11.804 -11.281  -2.231
  180    HA   PRO  24           HA       PRO  24   7.070 -17.552  -0.672
  181   1HB   PRO  24           HB2      PRO  24   9.106 -18.625   1.116
  182   2HB   PRO  24           HB1      PRO  24   7.984 -19.490   0.059
  183   1HG   PRO  24           HG2      PRO  24  10.778 -19.009  -0.334
  184   2HG   PRO  24           HG1      PRO  24   9.663 -19.909  -1.368
  185   1HD   PRO  24           HD2      PRO  24  10.859 -17.445  -1.976
  186   2HD   PRO  24           HD1      PRO  24   9.510 -18.198  -2.840
  187    H    ASP  25           HN       ASP  25   9.898 -15.895   0.699
  188    HA   ASP  25           HA       ASP  25   8.805 -15.371   3.288
  189   1HB   ASP  25           HB2      ASP  25  11.229 -14.987   2.247
  190   2HB   ASP  25           HB1      ASP  25  10.598 -13.360   1.991
  191    H    ASP  26           HN       ASP  26   8.771 -13.436   0.288
  192    HA   ASP  26           HA       ASP  26   7.335 -11.209   1.361
  193   1HB   ASP  26           HB2      ASP  26   8.538 -11.208  -0.831
  194   2HB   ASP  26           HB1      ASP  26   7.279 -12.255  -1.487
  195    H    LEU  27           HN       LEU  27   6.258 -14.268  -0.067
  196    HA   LEU  27           HA       LEU  27   3.471 -13.627  -0.221
  197   1HB   LEU  27           HB2      LEU  27   4.860 -16.299   0.146
  198   2HB   LEU  27           HB1      LEU  27   3.150 -16.106  -0.246
  199    HG   LEU  27           HG       LEU  27   5.413 -14.986  -1.922
  200   1HD1  LEU  27          HD12      LEU  27   3.979 -17.612  -1.941
  201   2HD1  LEU  27          HD11      LEU  27   4.379 -16.873  -3.492
  202   3HD1  LEU  27          HD13      LEU  27   5.659 -17.250  -2.338
  203   1HD2  LEU  27          HD23      LEU  27   2.409 -15.112  -2.183
  204   2HD2  LEU  27          HD22      LEU  27   3.467 -13.711  -2.347
  205   3HD2  LEU  27          HD21      LEU  27   3.437 -14.946  -3.606
  206    H    HIS  28           HN       HIS  28   5.543 -14.497   2.436
  207    HA   HIS  28           HA       HIS  28   3.308 -15.202   4.214
  208   1HB   HIS  28           HB2      HIS  28   6.296 -14.946   4.569
  209   2HB   HIS  28           HB1      HIS  28   5.222 -15.153   5.953
  210    HD1  HIS  28           HD1      HIS  28   3.200 -17.150   4.852
  211    HD2  HIS  28           HD2      HIS  28   7.304 -17.508   4.214
  212    HE1  HIS  28           HE1      HIS  28   3.635 -19.590   4.333
  213    H    TYR  29           HN       TYR  29   5.295 -12.415   3.454
  214    HA   TYR  29           HA       TYR  29   4.528 -10.872   5.796
  215   1HB   TYR  29           HB2      TYR  29   6.596 -10.491   4.352
  216   2HB   TYR  29           HB1      TYR  29   5.517  -9.785   3.150
  217    HD1  TYR  29           HD1      TYR  29   5.903  -9.600   6.885
  218    HD2  TYR  29           HD2      TYR  29   5.438  -7.464   3.189
  219    HE1  TYR  29           HE1      TYR  29   5.924  -7.453   8.125
  220    HE2  TYR  29           HE2      TYR  29   5.457  -5.315   4.428
  221    HH   TYR  29           HH       TYR  29   4.889  -4.992   7.552
  222    H    PHE  30           HN       PHE  30   3.178 -11.451   2.626
  223    HA   PHE  30           HA       PHE  30   1.429  -9.173   2.509
  224   1HB   PHE  30           HB2      PHE  30   2.024 -10.723   0.586
  225   2HB   PHE  30           HB1      PHE  30   0.913 -11.897   1.292
  226    HD1  PHE  30           HD2      PHE  30   1.117  -8.381   0.048
  227    HD2  PHE  30           HD1      PHE  30  -1.410 -11.746   0.904
  228    HE1  PHE  30           HE2      PHE  30  -0.794  -7.217  -1.022
  229    HE2  PHE  30           HE1      PHE  30  -3.322 -10.583  -0.164
  230    HZ   PHE  30           HZ       PHE  30  -3.015  -8.318  -1.127
  231    H    ARG  31           HN       ARG  31   0.962 -12.509   3.684
  232    HA   ARG  31           HA       ARG  31  -1.785 -12.161   4.448
  233   1HB   ARG  31           HB2      ARG  31  -0.512 -14.363   4.175
  234   2HB   ARG  31           HB1      ARG  31   0.178 -14.046   5.768
  235   1HG   ARG  31           HG2      ARG  31  -2.096 -13.905   6.724
  236   2HG   ARG  31           HG1      ARG  31  -2.781 -14.240   5.134
  237   1HD   ARG  31           HD2      ARG  31  -2.754 -16.365   6.122
  238   2HD   ARG  31           HD1      ARG  31  -1.252 -16.360   5.198
  239    HE   ARG  31           HE       ARG  31  -0.612 -15.366   7.755
  240   1HH1  ARG  31          HH21      ARG  31  -1.866 -18.275   6.330
  241   2HH1  ARG  31          HH22      ARG  31  -1.206 -19.303   7.559
  242   1HH2  ARG  31          HH11      ARG  31   0.239 -16.708   9.343
  243   2HH2  ARG  31          HH12      ARG  31  -0.020 -18.419   9.255
  244    H    ALA  32           HN       ALA  32   1.271 -11.483   6.053
  245    HA   ALA  32           HA       ALA  32   0.084 -11.012   8.669
  246   1HB   ALA  32           HB1      ALA  32   2.501 -11.630   8.278
  247   2HB   ALA  32           HB3      ALA  32   2.746 -10.012   7.621
  248   3HB   ALA  32           HB2      ALA  32   2.275 -10.216   9.308
  249    H    GLN  33           HN       GLN  33   0.809  -9.072   5.826
  250    HA   GLN  33           HA       GLN  33   0.038  -6.586   7.257
  251   1HB   GLN  33           HB2      GLN  33   1.269  -7.168   4.564
  252   2HB   GLN  33           HB1      GLN  33   0.594  -5.582   4.933
  253   1HG   GLN  33           HG2      GLN  33   2.615  -6.937   6.729
  254   2HG   GLN  33           HG1      GLN  33   3.089  -5.869   5.408
  255   1HE2  GLN  33          HE22      GLN  33   2.040  -4.208   8.866
  256   2HE2  GLN  33          HE21      GLN  33   2.504  -5.831   8.683
  257    H    THR  34           HN       THR  34  -1.919  -8.724   6.677
  258    HA   THR  34           HA       THR  34  -3.826  -7.075   5.085
  259    HB   THR  34           HB       THR  34  -4.723  -9.316   4.193
  260    HG1  THR  34           HG1      THR  34  -2.685 -10.740   4.065
  261   1HG2  THR  34          HG22      THR  34  -2.048  -8.166   3.382
  262   2HG2  THR  34          HG21      THR  34  -2.870  -9.410   2.440
  263   3HG2  THR  34          HG23      THR  34  -3.629  -7.835   2.674
  264    H    VAL  35           HN       VAL  35  -3.292  -9.615   7.487
  265    HA   VAL  35           HA       VAL  35  -6.088  -9.793   8.268
  266    HB   VAL  35           HB       VAL  35  -5.165 -11.054  10.231
  267   1HG1  VAL  35          HG11      VAL  35  -4.255 -11.742   7.430
  268   2HG1  VAL  35          HG13      VAL  35  -4.044 -12.849   8.787
  269   3HG1  VAL  35          HG12      VAL  35  -5.664 -12.356   8.296
  270   1HG2  VAL  35          HG23      VAL  35  -2.546 -10.260   8.926
  271   2HG2  VAL  35          HG22      VAL  35  -3.076  -9.882  10.564
  272   3HG2  VAL  35          HG21      VAL  35  -2.687 -11.545  10.126
  273    H    GLY  36           HN       GLY  36  -7.159  -8.469   9.657
  274   1HA   GLY  36           HA2      GLY  36  -7.341  -7.119  11.660
  275   2HA   GLY  36           HA1      GLY  36  -5.604  -6.819  11.581
  276    H    LYS  37           HN       LYS  37  -5.789  -6.264   8.643
  277    HA   LYS  37           HA       LYS  37  -6.914  -3.503   8.867
  278   1HB   LYS  37           HB2      LYS  37  -4.624  -4.636   7.247
  279   2HB   LYS  37           HB1      LYS  37  -5.330  -3.057   6.901
  280   1HG   LYS  37           HG2      LYS  37  -3.573  -2.522   8.363
  281   2HG   LYS  37           HG1      LYS  37  -4.964  -2.604   9.444
  282   1HD   LYS  37           HD2      LYS  37  -4.360  -4.756  10.241
  283   2HD   LYS  37           HD1      LYS  37  -3.225  -5.015   8.915
  284   1HE   LYS  37           HE2      LYS  37  -2.836  -2.742  10.855
  285   2HE   LYS  37           HE1      LYS  37  -2.256  -4.364  11.234
  286   1HZ   LYS  37           HZ2      LYS  37  -1.394  -4.029   8.712
  287   2HZ   LYS  37           HZ1      LYS  37  -1.256  -2.448   9.321
  288   3HZ   LYS  37           HZ3      LYS  37  -0.457  -3.728  10.096
  289    H    ILE  38           HN       ILE  38  -7.387  -2.678   6.450
  290    HA   ILE  38           HA       ILE  38  -9.311  -4.649   5.331
  291    HB   ILE  38           HB       ILE  38  -9.013  -1.698   4.698
  292   1HG1  ILE  38          HG12      ILE  38 -11.023  -3.032   6.536
  293   2HG1  ILE  38          HG11      ILE  38  -9.561  -2.230   7.116
  294   1HG2  ILE  38          HG21      ILE  38 -10.194  -3.245   3.048
  295   2HG2  ILE  38          HG23      ILE  38 -11.396  -3.524   4.309
  296   3HG2  ILE  38          HG22      ILE  38 -11.160  -1.901   3.659
  297   1HD1  ILE  38          HD13      ILE  38 -11.422  -0.770   5.261
  298   2HD1  ILE  38          HD12      ILE  38 -11.802  -0.870   6.981
  299   3HD1  ILE  38          HD11      ILE  38 -10.299  -0.114   6.453
  300    H    MET  39           HN       MET  39  -8.750  -5.742   3.522
  301    HA   MET  39           HA       MET  39  -6.378  -4.894   1.985
  302   1HB   MET  39           HB2      MET  39  -6.758  -7.294   2.622
  303   2HB   MET  39           HB1      MET  39  -8.170  -7.304   1.565
  304   1HG   MET  39           HG2      MET  39  -6.668  -6.586  -0.325
  305   2HG   MET  39           HG1      MET  39  -5.293  -6.816   0.753
  306   1HE   MET  39           HE3      MET  39  -8.322  -8.007  -0.779
  307   2HE   MET  39           HE2      MET  39  -8.018  -9.645  -1.349
  308   3HE   MET  39           HE1      MET  39  -8.652  -9.389   0.274
  309    H    VAL  40           HN       VAL  40  -6.902  -3.199   0.639
  310    HA   VAL  40           HA       VAL  40  -9.420  -3.320  -0.927
  311    HB   VAL  40           HB       VAL  40  -7.311  -1.141  -0.853
  312   1HG1  VAL  40          HG11      VAL  40  -8.850  -1.183  -2.827
  313   2HG1  VAL  40          HG13      VAL  40 -10.218  -1.084  -1.719
  314   3HG1  VAL  40          HG12      VAL  40  -9.066   0.247  -1.819
  315   1HG2  VAL  40          HG23      VAL  40  -9.768  -1.658   0.825
  316   2HG2  VAL  40          HG22      VAL  40  -8.140  -1.249   1.363
  317   3HG2  VAL  40          HG21      VAL  40  -9.149  -0.024   0.595
  318    H    VAL  41           HN       VAL  41  -9.320  -4.371  -2.843
  319    HA   VAL  41           HA       VAL  41  -6.937  -3.944  -4.575
  320    HB   VAL  41           HB       VAL  41  -6.998  -6.375  -5.190
  321   1HG1  VAL  41          HG12      VAL  41  -5.449  -5.381  -3.442
  322   2HG1  VAL  41          HG11      VAL  41  -6.584  -5.955  -2.220
  323   3HG1  VAL  41          HG13      VAL  41  -5.756  -7.109  -3.266
  324   1HG2  VAL  41          HG23      VAL  41  -8.962  -6.434  -2.880
  325   2HG2  VAL  41          HG22      VAL  41  -9.252  -6.949  -4.542
  326   3HG2  VAL  41          HG21      VAL  41  -8.162  -7.874  -3.511
  327    H    GLY  42           HN       GLY  42  -7.435  -4.661  -6.871
  328   1HA   GLY  42           HA2      GLY  42 -10.137  -3.727  -7.585
  329   2HA   GLY  42           HA1      GLY  42  -8.817  -4.044  -8.712
  330    H    ARG  43           HN       ARG  43 -10.761  -5.130  -9.837
  331    HA   ARG  43           HA       ARG  43 -11.638  -7.694  -8.737
  332   1HB   ARG  43           HB2      ARG  43 -12.739  -7.948 -10.977
  333   2HB   ARG  43           HB1      ARG  43 -13.174  -6.450 -10.154
  334   1HG   ARG  43           HG2      ARG  43 -11.445  -5.245 -11.463
  335   2HG   ARG  43           HG1      ARG  43 -11.066  -6.742 -12.315
  336   1HD   ARG  43           HD2      ARG  43 -13.426  -6.856 -13.104
  337   2HD   ARG  43           HD1      ARG  43 -13.737  -5.306 -12.322
  338    HE   ARG  43           HE       ARG  43 -12.286  -5.706 -14.826
  339   1HH1  ARG  43          HH21      ARG  43 -12.769  -3.661 -12.060
  340   2HH1  ARG  43          HH22      ARG  43 -12.218  -2.234 -12.871
  341   1HH2  ARG  43          HH11      ARG  43 -11.573  -3.847 -15.868
  342   2HH2  ARG  43          HH12      ARG  43 -11.544  -2.340 -15.016
  343    H    ARG  44           HN       ARG  44  -9.244  -6.565 -11.066
  344    HA   ARG  44           HA       ARG  44  -8.606  -9.183 -12.123
  345   1HB   ARG  44           HB2      ARG  44  -8.078  -6.901 -13.178
  346   2HB   ARG  44           HB1      ARG  44  -6.733  -6.813 -12.039
  347   1HG   ARG  44           HG2      ARG  44  -5.707  -8.769 -12.946
  348   2HG   ARG  44           HG1      ARG  44  -7.153  -9.183 -13.869
  349   1HD   ARG  44           HD2      ARG  44  -6.836  -6.950 -15.083
  350   2HD   ARG  44           HD1      ARG  44  -5.232  -6.899 -14.349
  351    HE   ARG  44           HE       ARG  44  -6.071  -8.663 -16.525
  352   1HH1  ARG  44          HH21      ARG  44  -3.869  -8.163 -13.885
  353   2HH1  ARG  44          HH22      ARG  44  -2.650  -9.199 -14.549
  354   1HH2  ARG  44          HH11      ARG  44  -4.482 -10.004 -17.377
  355   2HH2  ARG  44          HH12      ARG  44  -2.997 -10.236 -16.517
  356    H    THR  45           HN       THR  45  -7.442  -7.241  -9.416
  357    HA   THR  45           HA       THR  45  -5.233  -9.070  -8.820
  358    HB   THR  45           HB       THR  45  -6.410  -6.946  -7.012
  359    HG1  THR  45           HG1      THR  45  -4.330  -5.970  -8.149
  360   1HG2  THR  45          HG23      THR  45  -3.675  -8.227  -7.249
  361   2HG2  THR  45          HG22      THR  45  -4.057  -6.878  -6.180
  362   3HG2  THR  45          HG21      THR  45  -4.825  -8.445  -5.930
  363    H    TYR  46           HN       TYR  46  -8.561  -8.595  -7.791
  364    HA   TYR  46           HA       TYR  46  -8.453 -10.240  -5.433
  365   1HB   TYR  46           HB2      TYR  46 -10.307  -8.596  -6.181
  366   2HB   TYR  46           HB1      TYR  46 -10.897  -9.925  -7.178
  367    HD1  TYR  46           HD1      TYR  46  -9.573  -9.487  -3.686
  368    HD2  TYR  46           HD2      TYR  46 -12.585 -11.202  -6.223
  369    HE1  TYR  46           HE1      TYR  46 -10.674 -10.488  -1.702
  370    HE2  TYR  46           HE2      TYR  46 -13.686 -12.204  -4.240
  371    HH   TYR  46           HH       TYR  46 -13.797 -12.073  -1.938
  372    H    GLU  47           HN       GLU  47  -8.796 -10.932  -8.854
  373    HA   GLU  47           HA       GLU  47  -9.467 -13.765  -8.323
  374   1HB   GLU  47           HB2      GLU  47  -9.131 -12.162 -10.871
  375   2HB   GLU  47           HB1      GLU  47  -9.444 -13.898 -10.856
  376   1HG   GLU  47           HG2      GLU  47 -11.219 -12.050  -9.285
  377   2HG   GLU  47           HG1      GLU  47 -11.466 -12.236 -11.022
  378    H    SER  48           HN       SER  48  -6.702 -11.790  -8.894
  379    HA   SER  48           HA       SER  48  -4.967 -13.671 -10.164
  380   1HB   SER  48           HB2      SER  48  -3.166 -12.243  -9.445
  381   2HB   SER  48           HB1      SER  48  -4.529 -11.198  -9.830
  382    HG   SER  48           HG       SER  48  -4.640 -12.051  -7.268
  383    H    PHE  49           HN       PHE  49  -6.120 -13.404  -6.891
  384    HA   PHE  49           HA       PHE  49  -4.056 -14.903  -5.578
  385   1HB   PHE  49           HB2      PHE  49  -7.001 -14.709  -4.873
  386   2HB   PHE  49           HB1      PHE  49  -5.709 -15.228  -3.790
  387    HD1  PHE  49           HD1      PHE  49  -3.561 -13.442  -4.036
  388    HD2  PHE  49           HD2      PHE  49  -7.748 -12.557  -4.406
  389    HE1  PHE  49           HE1      PHE  49  -3.115 -11.079  -3.433
  390    HE2  PHE  49           HE2      PHE  49  -7.302 -10.193  -3.802
  391    HZ   PHE  49           HZ       PHE  49  -4.985  -9.454  -3.316
  392    HA   PRO  50           HA       PRO  50  -5.011 -19.071  -6.804
  393   1HB   PRO  50           HB2      PRO  50  -4.241 -20.369  -4.444
  394   2HB   PRO  50           HB1      PRO  50  -3.170 -19.912  -5.774
  395   1HG   PRO  50           HG2      PRO  50  -3.260 -18.833  -3.123
  396   2HG   PRO  50           HG1      PRO  50  -2.169 -18.402  -4.448
  397   1HD   PRO  50           HD2      PRO  50  -4.511 -16.966  -3.453
  398   2HD   PRO  50           HD1      PRO  50  -3.236 -16.405  -4.547
  399    H    LYS  51           HN       LYS  51  -5.737 -18.987  -3.297
  400    HA   LYS  51           HA       LYS  51  -8.355 -20.284  -3.902
  401   1HB   LYS  51           HB2      LYS  51  -6.569 -20.219  -1.476
  402   2HB   LYS  51           HB1      LYS  51  -8.278 -20.626  -1.316
  403   1HG   LYS  51           HG2      LYS  51  -7.247 -22.721  -1.637
  404   2HG   LYS  51           HG1      LYS  51  -7.845 -22.307  -3.244
  405   1HD   LYS  51           HD2      LYS  51  -5.725 -21.833  -4.064
  406   2HD   LYS  51           HD1      LYS  51  -5.085 -21.432  -2.469
  407   1HE   LYS  51           HE2      LYS  51  -5.946 -24.238  -3.185
  408   2HE   LYS  51           HE1      LYS  51  -4.307 -23.658  -3.484
  409   1HZ   LYS  51           HZ1      LYS  51  -5.322 -23.097  -0.840
  410   2HZ   LYS  51           HZ3      LYS  51  -5.139 -24.749  -1.178
  411   3HZ   LYS  51           HZ2      LYS  51  -3.809 -23.701  -1.319
  412    H    ARG  52           HN       ARG  52 -10.180 -19.089  -3.683
  413    HA   ARG  52           HA       ARG  52 -10.033 -16.591  -2.040
  414   1HB   ARG  52           HB2      ARG  52 -11.354 -17.100  -4.712
  415   2HB   ARG  52           HB1      ARG  52 -11.825 -15.747  -3.682
  416   1HG   ARG  52           HG2      ARG  52  -9.748 -14.694  -3.889
  417   2HG   ARG  52           HG1      ARG  52  -8.922 -16.192  -4.318
  418   1HD   ARG  52           HD2      ARG  52  -9.102 -14.884  -6.332
  419   2HD   ARG  52           HD1      ARG  52 -10.264 -16.205  -6.465
  420    HE   ARG  52           HE       ARG  52 -10.931 -13.349  -6.009
  421   1HH1  ARG  52          HH11      ARG  52 -11.927 -16.660  -6.353
  422   2HH1  ARG  52          HH12      ARG  52 -13.585 -16.255  -6.643
  423   1HH2  ARG  52          HH21      ARG  52 -13.086 -12.837  -6.387
  424   2HH2  ARG  52          HH22      ARG  52 -14.237 -14.100  -6.662
  425    HA   PRO  53           HA       PRO  53 -11.689 -14.959  -1.783
  426   1HB   PRO  53           HB2      PRO  53 -12.956 -14.169   0.585
  427   2HB   PRO  53           HB1      PRO  53 -13.628 -14.036  -1.046
  428   1HG   PRO  53           HG2      PRO  53 -14.488 -15.741   1.085
  429   2HG   PRO  53           HG1      PRO  53 -15.168 -15.590  -0.541
  430   1HD   PRO  53           HD2      PRO  53 -13.431 -17.680   0.542
  431   2HD   PRO  53           HD1      PRO  53 -14.394 -17.681  -0.945
  432    H    LEU  54           HN       LEU  54 -11.048 -13.488   0.458
  433    HA   LEU  54           HA       LEU  54  -8.957 -15.177   1.770
  434   1HB   LEU  54           HB2      LEU  54  -8.933 -12.176   1.333
  435   2HB   LEU  54           HB1      LEU  54  -7.611 -13.159   1.965
  436    HG   LEU  54           HG       LEU  54  -8.827 -13.490  -0.793
  437   1HD1  LEU  54          HD13      LEU  54  -7.339 -11.368  -0.065
  438   2HD1  LEU  54          HD12      LEU  54  -6.043 -12.517  -0.388
  439   3HD1  LEU  54          HD11      LEU  54  -7.201 -12.116  -1.656
  440   1HD2  LEU  54          HD23      LEU  54  -6.550 -14.787   0.705
  441   2HD2  LEU  54          HD22      LEU  54  -7.872 -15.561  -0.168
  442   3HD2  LEU  54          HD21      LEU  54  -6.577 -14.760  -1.058
  443    HA   PRO  55           HA       PRO  55 -11.740 -14.065   5.257
  444   1HB   PRO  55           HB2      PRO  55 -10.834 -16.323   6.717
  445   2HB   PRO  55           HB1      PRO  55 -12.364 -16.156   5.847
  446   1HG   PRO  55           HG2      PRO  55 -10.155 -17.822   5.187
  447   2HG   PRO  55           HG1      PRO  55 -11.664 -17.610   4.290
  448   1HD   PRO  55           HD2      PRO  55  -9.017 -16.556   3.690
  449   2HD   PRO  55           HD1      PRO  55 -10.463 -16.590   2.670
  450    H    GLU  56           HN       GLU  56 -11.044 -14.230   7.788
  451    HA   GLU  56           HA       GLU  56  -9.627 -13.373   9.446
  452   1HB   GLU  56           HB2      GLU  56  -7.381 -14.176   7.571
  453   2HB   GLU  56           HB1      GLU  56  -7.271 -13.923   9.313
  454   1HG   GLU  56           HG2      GLU  56  -9.196 -15.762   9.345
  455   2HG   GLU  56           HG1      GLU  56  -8.467 -16.209   7.802
  456    H    ARG  57           HN       ARG  57 -10.523 -11.735   7.074
  457    HA   ARG  57           HA       ARG  57  -9.182  -9.300   7.746
  458   1HB   ARG  57           HB2      ARG  57  -8.002  -8.909   5.583
  459   2HB   ARG  57           HB1      ARG  57  -7.297 -10.238   6.503
  460   1HG   ARG  57           HG2      ARG  57  -8.996 -11.702   5.108
  461   2HG   ARG  57           HG1      ARG  57  -8.941 -10.334   3.997
  462   1HD   ARG  57           HD2      ARG  57  -7.182 -11.638   3.197
  463   2HD   ARG  57           HD1      ARG  57  -6.337 -10.557   4.304
  464    HE   ARG  57           HE       ARG  57  -7.008 -12.705   5.905
  465   1HH1  ARG  57          HH21      ARG  57  -5.395 -12.338   2.850
  466   2HH1  ARG  57          HH22      ARG  57  -4.397 -13.736   3.075
  467   1HH2  ARG  57          HH11      ARG  57  -5.708 -14.517   6.185
  468   2HH2  ARG  57          HH12      ARG  57  -4.574 -14.963   4.954
  469    H    THR  58           HN       THR  58  -9.728  -7.584   5.897
  470    HA   THR  58           HA       THR  58 -12.590  -8.030   5.236
  471    HB   THR  58           HB       THR  58 -11.086  -5.440   4.873
  472    HG1  THR  58           HG1      THR  58 -12.265  -5.290   7.140
  473   1HG2  THR  58          HG21      THR  58 -13.960  -6.181   5.483
  474   2HG2  THR  58          HG23      THR  58 -13.350  -4.527   5.414
  475   3HG2  THR  58          HG22      THR  58 -13.339  -5.533   3.965
  476    H    ASN  59           HN       ASN  59 -13.242  -8.331   3.154
  477    HA   ASN  59           HA       ASN  59 -11.174  -8.132   1.018
  478   1HB   ASN  59           HB2      ASN  59 -13.870  -9.525   0.982
  479   2HB   ASN  59           HB1      ASN  59 -12.638  -9.613  -0.277
  480   1HD2  ASN  59          HD22      ASN  59 -10.383 -11.398   2.115
  481   2HD2  ASN  59          HD21      ASN  59 -10.297  -9.937   1.253
  482    H    VAL  60           HN       VAL  60 -11.263  -6.006   0.322
  483    HA   VAL  60           HA       VAL  60 -13.948  -4.934  -0.445
  484    HB   VAL  60           HB       VAL  60 -11.371  -3.398   0.004
  485   1HG1  VAL  60          HG11      VAL  60 -14.248  -2.624  -0.512
  486   2HG1  VAL  60          HG13      VAL  60 -13.092  -1.502   0.206
  487   3HG1  VAL  60          HG12      VAL  60 -12.811  -2.140  -1.414
  488   1HG2  VAL  60          HG21      VAL  60 -13.755  -3.868   1.823
  489   2HG2  VAL  60          HG23      VAL  60 -12.096  -4.397   2.107
  490   3HG2  VAL  60          HG22      VAL  60 -12.490  -2.678   2.129
  491    H    VAL  61           HN       VAL  61 -14.249  -5.430  -2.577
  492    HA   VAL  61           HA       VAL  61 -11.942  -5.229  -4.445
  493    HB   VAL  61           HB       VAL  61 -14.742  -6.271  -4.971
  494   1HG1  VAL  61          HG11      VAL  61 -12.122  -6.402  -6.487
  495   2HG1  VAL  61          HG13      VAL  61 -13.511  -7.419  -6.870
  496   3HG1  VAL  61          HG12      VAL  61 -13.634  -5.666  -7.019
  497   1HG2  VAL  61          HG21      VAL  61 -12.202  -7.648  -4.068
  498   2HG2  VAL  61          HG23      VAL  61 -13.793  -7.707  -3.310
  499   3HG2  VAL  61          HG22      VAL  61 -13.520  -8.520  -4.851
  500    H    LEU  62           HN       LEU  62 -11.855  -3.650  -6.009
  501    HA   LEU  62           HA       LEU  62 -14.012  -1.593  -5.946
  502   1HB   LEU  62           HB2      LEU  62 -11.596  -0.945  -5.508
  503   2HB   LEU  62           HB1      LEU  62 -11.261  -1.357  -7.191
  504    HG   LEU  62           HG       LEU  62 -13.201   0.233  -7.781
  505   1HD1  LEU  62          HD12      LEU  62 -12.734   0.861  -4.866
  506   2HD1  LEU  62          HD11      LEU  62 -13.376   2.073  -5.974
  507   3HD1  LEU  62          HD13      LEU  62 -14.264   0.576  -5.693
  508   1HD2  LEU  62          HD23      LEU  62 -10.575   1.165  -6.599
  509   2HD2  LEU  62          HD22      LEU  62 -10.959   0.894  -8.299
  510   3HD2  LEU  62          HD21      LEU  62 -11.675   2.257  -7.439
  511    H    THR  63           HN       THR  63 -15.376  -1.467  -7.655
  512    HA   THR  63           HA       THR  63 -14.449  -2.159 -10.365
  513    HB   THR  63           HB       THR  63 -15.169  -4.342  -9.569
  514    HG1  THR  63           HG1      THR  63 -16.124  -3.141 -11.622
  515   1HG2  THR  63          HG23      THR  63 -17.728  -2.915  -8.795
  516   2HG2  THR  63          HG22      THR  63 -17.493  -4.662  -8.743
  517   3HG2  THR  63          HG21      THR  63 -16.547  -3.613  -7.686
  518    H    HIS  64           HN       HIS  64 -15.643  -1.073 -11.937
  519    HA   HIS  64           HA       HIS  64 -17.524   0.969 -10.933
  520   1HB   HIS  64           HB2      HIS  64 -16.285   0.470 -13.654
  521   2HB   HIS  64           HB1      HIS  64 -17.425   1.776 -13.326
  522    HD1  HIS  64           HD1      HIS  64 -16.323   3.918 -12.719
  523    HD2  HIS  64           HD2      HIS  64 -13.989   0.644 -11.618
  524    HE1  HIS  64           HE1      HIS  64 -14.202   4.859 -11.703
  525    H    GLN  65           HN       GLN  65 -17.510  -1.772 -13.204
  526    HA   GLN  65           HA       GLN  65 -20.289  -1.463 -13.958
  527   1HB   GLN  65           HB2      GLN  65 -18.405  -3.833 -14.150
  528   2HB   GLN  65           HB1      GLN  65 -20.014  -3.781 -14.873
  529   1HG   GLN  65           HG2      GLN  65 -17.968  -1.639 -15.450
  530   2HG   GLN  65           HG1      GLN  65 -18.015  -3.137 -16.380
  531   1HE2  GLN  65          HE22      GLN  65 -21.038  -0.399 -16.818
  532   2HE2  GLN  65          HE21      GLN  65 -19.979  -0.278 -15.497
  533    H    GLU  66           HN       GLU  66 -22.086  -2.237 -12.931
  534    HA   GLU  66           HA       GLU  66 -21.739  -3.479 -10.284
  535   1HB   GLU  66           HB2      GLU  66 -23.462  -1.635 -10.973
  536   2HB   GLU  66           HB1      GLU  66 -24.398  -2.990 -11.607
  537   1HG   GLU  66           HG2      GLU  66 -23.977  -4.076  -9.281
  538   2HG   GLU  66           HG1      GLU  66 -23.577  -2.439  -8.762
  539    H    ASP  67           HN       ASP  67 -21.050  -5.011 -12.727
  540    HA   ASP  67           HA       ASP  67 -23.147  -7.126 -12.714
  541   1HB   ASP  67           HB2      ASP  67 -22.129  -6.129 -14.879
  542   2HB   ASP  67           HB1      ASP  67 -20.701  -7.082 -14.481
  543    H    TYR  68           HN       TYR  68 -19.737  -6.543 -11.989
  544    HA   TYR  68           HA       TYR  68 -19.065  -9.293 -11.428
  545   1HB   TYR  68           HB2      TYR  68 -17.463  -7.324 -11.860
  546   2HB   TYR  68           HB1      TYR  68 -17.734  -6.890 -10.172
  547    HD1  TYR  68           HD1      TYR  68 -16.407  -9.490 -12.448
  548    HD2  TYR  68           HD2      TYR  68 -16.840  -8.220  -8.367
  549    HE1  TYR  68           HE1      TYR  68 -14.761 -11.204 -11.740
  550    HE2  TYR  68           HE2      TYR  68 -15.193  -9.934  -7.659
  551    HH   TYR  68           HH       TYR  68 -13.536 -11.986 -10.049
  552    H    GLN  69           HN       GLN  69 -18.931 -10.336  -9.388
  553    HA   GLN  69           HA       GLN  69 -20.035  -8.931  -7.026
  554   1HB   GLN  69           HB2      GLN  69 -21.230 -11.470  -8.182
  555   2HB   GLN  69           HB1      GLN  69 -21.644 -10.791  -6.608
  556   1HG   GLN  69           HG2      GLN  69 -22.312  -8.667  -7.767
  557   2HG   GLN  69           HG1      GLN  69 -22.049  -9.480  -9.310
  558   1HE2  GLN  69          HE22      GLN  69 -25.123 -11.203  -9.207
  559   2HE2  GLN  69          HE21      GLN  69 -23.716 -10.841 -10.083
  560    H    ALA  70           HN       ALA  70 -19.501 -10.015  -5.035
  561    HA   ALA  70           HA       ALA  70 -17.642 -12.332  -5.285
  562   1HB   ALA  70           HB1      ALA  70 -17.122  -9.699  -3.895
  563   2HB   ALA  70           HB3      ALA  70 -16.247 -11.170  -3.464
  564   3HB   ALA  70           HB2      ALA  70 -16.120 -10.515  -5.097
  565    H    GLN  71           HN       GLN  71 -17.876 -13.825  -3.639
  566    HA   GLN  71           HA       GLN  71 -20.141 -13.424  -1.799
  567   1HB   GLN  71           HB2      GLN  71 -18.323 -15.788  -2.344
  568   2HB   GLN  71           HB1      GLN  71 -19.633 -15.815  -1.162
  569   1HG   GLN  71           HG2      GLN  71 -20.123 -14.998  -4.027
  570   2HG   GLN  71           HG1      GLN  71 -20.161 -16.692  -3.535
  571   1HE2  GLN  71          HE22      GLN  71 -23.293 -14.288  -2.651
  572   2HE2  GLN  71          HE21      GLN  71 -21.970 -13.734  -3.557
  573    H    GLY  72           HN       GLY  72 -19.841 -12.610   0.207
  574   1HA   GLY  72           HA2      GLY  72 -18.852 -12.216   2.307
  575   2HA   GLY  72           HA1      GLY  72 -17.654 -13.449   1.914
  576    H    ALA  73           HN       ALA  73 -18.473 -10.359   0.318
  577    HA   ALA  73           HA       ALA  73 -15.903  -9.178   1.102
  578   1HB   ALA  73           HB2      ALA  73 -15.344 -10.654  -0.857
  579   2HB   ALA  73           HB1      ALA  73 -16.460  -9.699  -1.832
  580   3HB   ALA  73           HB3      ALA  73 -15.022  -8.943  -1.145
  581    H    VAL  74           HN       VAL  74 -16.004  -6.941   0.988
  582    HA   VAL  74           HA       VAL  74 -18.626  -5.769   0.400
  583    HB   VAL  74           HB       VAL  74 -16.051  -4.382   1.202
  584   1HG1  VAL  74          HG11      VAL  74 -18.974  -3.589   1.245
  585   2HG1  VAL  74          HG13      VAL  74 -17.719  -2.704   2.113
  586   3HG1  VAL  74          HG12      VAL  74 -17.666  -2.812   0.353
  587   1HG2  VAL  74          HG23      VAL  74 -18.221  -5.735   2.809
  588   2HG2  VAL  74          HG22      VAL  74 -16.474  -5.930   2.946
  589   3HG2  VAL  74          HG21      VAL  74 -17.242  -4.442   3.499
  590    H    VAL  75           HN       VAL  75 -18.983  -5.710  -1.808
  591    HA   VAL  75           HA       VAL  75 -16.880  -4.925  -3.682
  592    HB   VAL  75           HB       VAL  75 -19.861  -5.195  -4.168
  593   1HG1  VAL  75          HG13      VAL  75 -17.441  -5.250  -5.995
  594   2HG1  VAL  75          HG12      VAL  75 -19.083  -5.643  -6.504
  595   3HG1  VAL  75          HG11      VAL  75 -18.696  -4.013  -5.952
  596   1HG2  VAL  75          HG21      VAL  75 -17.621  -7.236  -4.343
  597   2HG2  VAL  75          HG23      VAL  75 -18.994  -7.277  -3.237
  598   3HG2  VAL  75          HG22      VAL  75 -19.251  -7.489  -4.968
  599    H    VAL  76           HN       VAL  76 -16.256  -2.802  -3.297
  600    HA   VAL  76           HA       VAL  76 -18.299  -0.702  -2.961
  601    HB   VAL  76           HB       VAL  76 -16.302   0.806  -2.783
  602   1HG1  VAL  76          HG12      VAL  76 -16.348  -1.693  -1.065
  603   2HG1  VAL  76          HG11      VAL  76 -15.440  -0.236  -0.663
  604   3HG1  VAL  76          HG13      VAL  76 -17.201  -0.181  -0.756
  605   1HG2  VAL  76          HG22      VAL  76 -14.919  -0.765  -4.297
  606   2HG2  VAL  76          HG21      VAL  76 -14.095  -0.062  -2.905
  607   3HG2  VAL  76          HG23      VAL  76 -14.660  -1.731  -2.844
  608    H    HIS  77           HN       HIS  77 -18.164   1.268  -4.380
  609    HA   HIS  77           HA       HIS  77 -17.192   0.674  -7.133
  610   1HB   HIS  77           HB2      HIS  77 -19.970   1.661  -6.411
  611   2HB   HIS  77           HB1      HIS  77 -19.326   1.576  -8.052
  612    HD1  HIS  77           HD1      HIS  77 -19.580  -0.616  -9.241
  613    HD2  HIS  77           HD2      HIS  77 -20.063  -1.023  -5.120
  614    HE1  HIS  77           HE1      HIS  77 -20.283  -3.015  -8.835
  615    H    ASP  78           HN       ASP  78 -16.255   2.438  -4.934
  616    HA   ASP  78           HA       ASP  78 -15.747   4.807  -6.492
  617   1HB   ASP  78           HB2      ASP  78 -18.164   5.130  -5.666
  618   2HB   ASP  78           HB1      ASP  78 -17.465   5.301  -4.056
  619    H    VAL  79           HN       VAL  79 -14.022   5.961  -5.598
  620    HA   VAL  79           HA       VAL  79 -12.461   4.650  -3.569
  621    HB   VAL  79           HB       VAL  79 -12.191   7.501  -4.569
  622   1HG1  VAL  79          HG11      VAL  79 -10.890   6.788  -2.513
  623   2HG1  VAL  79          HG13      VAL  79 -10.087   5.587  -3.524
  624   3HG1  VAL  79          HG12      VAL  79  -9.893   7.305  -3.872
  625   1HG2  VAL  79          HG22      VAL  79 -11.204   4.864  -5.689
  626   2HG2  VAL  79          HG21      VAL  79 -12.200   6.072  -6.501
  627   3HG2  VAL  79          HG23      VAL  79 -10.507   6.418  -6.145
  628    H    ALA  80           HN       ALA  80 -14.755   7.323  -3.519
  629    HA   ALA  80           HA       ALA  80 -14.124   8.264  -0.870
  630   1HB   ALA  80           HB1      ALA  80 -15.506   9.454  -2.684
  631   2HB   ALA  80           HB3      ALA  80 -16.846   8.429  -2.174
  632   3HB   ALA  80           HB2      ALA  80 -16.115   9.556  -1.032
  633    H    ALA  81           HN       ALA  81 -16.270   5.758  -2.130
  634    HA   ALA  81           HA       ALA  81 -17.675   5.250   0.330
  635   1HB   ALA  81           HB3      ALA  81 -17.203   3.680  -2.197
  636   2HB   ALA  81           HB2      ALA  81 -17.992   2.923  -0.813
  637   3HB   ALA  81           HB1      ALA  81 -18.714   4.342  -1.571
  638    H    VAL  82           HN       VAL  82 -14.634   4.075  -1.027
  639    HA   VAL  82           HA       VAL  82 -14.215   1.963   0.887
  640    HB   VAL  82           HB       VAL  82 -12.121   3.559  -0.620
  641   1HG1  VAL  82          HG13      VAL  82 -11.382   2.043   1.270
  642   2HG1  VAL  82          HG12      VAL  82 -12.065   0.693   0.363
  643   3HG1  VAL  82          HG11      VAL  82 -10.724   1.620  -0.311
  644   1HG2  VAL  82          HG22      VAL  82 -14.004   1.374  -1.440
  645   2HG2  VAL  82          HG21      VAL  82 -13.436   2.765  -2.364
  646   3HG2  VAL  82          HG23      VAL  82 -12.374   1.380  -2.114
  647    H    PHE  83           HN       PHE  83 -13.378   5.406   0.820
  648    HA   PHE  83           HA       PHE  83 -11.808   5.308   3.264
  649   1HB   PHE  83           HB2      PHE  83 -12.998   7.532   1.606
  650   2HB   PHE  83           HB1      PHE  83 -12.214   7.862   3.151
  651    HD1  PHE  83           HD2      PHE  83  -9.900   6.397   3.412
  652    HD2  PHE  83           HD1      PHE  83 -11.636   7.796  -0.259
  653    HE1  PHE  83           HE2      PHE  83  -7.680   6.273   2.315
  654    HE2  PHE  83           HE1      PHE  83  -9.415   7.673  -1.356
  655    HZ   PHE  83           HZ       PHE  83  -7.438   6.912  -0.069
  656    H    ALA  84           HN       ALA  84 -15.189   5.819   2.462
  657    HA   ALA  84           HA       ALA  84 -16.019   6.924   4.979
  658   1HB   ALA  84           HB3      ALA  84 -17.349   6.852   2.794
  659   2HB   ALA  84           HB2      ALA  84 -17.714   5.173   3.188
  660   3HB   ALA  84           HB1      ALA  84 -18.250   6.467   4.260
  661    H    TYR  85           HN       TYR  85 -15.722   3.595   3.782
  662    HA   TYR  85           HA       TYR  85 -16.877   2.356   6.121
  663   1HB   TYR  85           HB2      TYR  85 -16.506   1.316   3.794
  664   2HB   TYR  85           HB1      TYR  85 -14.834   1.072   4.302
  665    HD1  TYR  85           HD1      TYR  85 -14.327  -0.337   6.306
  666    HD2  TYR  85           HD2      TYR  85 -18.285  -0.038   4.664
  667    HE1  TYR  85           HE1      TYR  85 -15.000  -2.371   7.556
  668    HE2  TYR  85           HE2      TYR  85 -18.957  -2.071   5.914
  669    HH   TYR  85           HH       TYR  85 -17.258  -4.243   6.939
  670    H    ALA  86           HN       ALA  86 -13.621   3.378   5.230
  671    HA   ALA  86           HA       ALA  86 -12.283   2.044   7.422
  672   1HB   ALA  86           HB1      ALA  86 -11.520   4.330   5.596
  673   2HB   ALA  86           HB3      ALA  86 -10.456   3.767   6.886
  674   3HB   ALA  86           HB2      ALA  86 -10.912   2.674   5.578
  675    H    LYS  87           HN       LYS  87 -14.013   5.056   7.067
  676    HA   LYS  87           HA       LYS  87 -12.946   6.438   9.339
  677   1HB   LYS  87           HB2      LYS  87 -14.486   7.326   7.449
  678   2HB   LYS  87           HB1      LYS  87 -15.810   6.690   8.425
  679   1HG   LYS  87           HG2      LYS  87 -14.934   8.015  10.369
  680   2HG   LYS  87           HG1      LYS  87 -13.754   8.745   9.280
  681   1HD   LYS  87           HD2      LYS  87 -15.819   9.335   7.808
  682   2HD   LYS  87           HD1      LYS  87 -16.750   9.038   9.276
  683   1HE   LYS  87           HE2      LYS  87 -15.242  10.659  10.474
  684   2HE   LYS  87           HE1      LYS  87 -14.510  11.046   8.916
  685   1HZ   LYS  87           HZ1      LYS  87 -17.421  11.140   9.086
  686   2HZ   LYS  87           HZ3      LYS  87 -16.566  12.374   9.876
  687   3HZ   LYS  87           HZ2      LYS  87 -16.350  12.126   8.209
  688    H    GLN  88           HN       GLN  88 -15.786   4.304   8.980
  689    HA   GLN  88           HA       GLN  88 -16.607   4.450  11.725
  690   1HB   GLN  88           HB2      GLN  88 -17.032   2.295   9.633
  691   2HB   GLN  88           HB1      GLN  88 -17.840   2.328  11.200
  692   1HG   GLN  88           HG2      GLN  88 -17.953   4.711   9.358
  693   2HG   GLN  88           HG1      GLN  88 -19.082   3.368   9.170
  694   1HE2  GLN  88          HE22      GLN  88 -20.140   6.077  11.765
  695   2HE2  GLN  88          HE21      GLN  88 -19.276   6.306  10.323
  696    H    HIS  89           HN       HIS  89 -14.149   2.601  10.067
  697    HA   HIS  89           HA       HIS  89 -13.541   1.194  12.639
  698   1HB   HIS  89           HB2      HIS  89 -13.358   0.295   9.773
  699   2HB   HIS  89           HB1      HIS  89 -12.298  -0.420  10.989
  700    HD1  HIS  89           HD1      HIS  89 -13.270  -2.366  12.201
  701    HD2  HIS  89           HD2      HIS  89 -16.247   0.142  10.709
  702    HE1  HIS  89           HE1      HIS  89 -15.481  -3.469  12.757
  703    HA   PRO  90           HA       PRO  90  -9.921   3.935  11.863
  704   1HB   PRO  90           HB2      PRO  90  -9.635   4.499  14.593
  705   2HB   PRO  90           HB1      PRO  90 -10.452   5.518  13.401
  706   1HG   PRO  90           HG2      PRO  90 -11.612   4.068  15.578
  707   2HG   PRO  90           HG1      PRO  90 -12.423   5.103  14.395
  708   1HD   PRO  90           HD2      PRO  90 -12.322   2.185  14.522
  709   2HD   PRO  90           HD1      PRO  90 -13.382   3.228  13.560
  710    H    ASP  91           HN       ASP  91 -10.496   1.249  14.013
  711    HA   ASP  91           HA       ASP  91  -7.754   0.877  14.865
  712   1HB   ASP  91           HB2      ASP  91  -8.553  -1.416  15.499
  713   2HB   ASP  91           HB1      ASP  91  -9.561  -0.124  16.150
  714    H    GLN  92           HN       GLN  92  -9.576   0.020  12.020
  715    HA   GLN  92           HA       GLN  92  -7.442  -1.832  11.101
  716   1HB   GLN  92           HB2      GLN  92 -10.097  -1.080   9.837
  717   2HB   GLN  92           HB1      GLN  92  -8.983  -2.303   9.224
  718   1HG   GLN  92           HG2      GLN  92  -9.193  -3.523  11.394
  719   2HG   GLN  92           HG1      GLN  92 -10.401  -2.343  11.904
  720   1HE2  GLN  92          HE22      GLN  92 -11.385  -5.060   8.980
  721   2HE2  GLN  92          HE21      GLN  92  -9.749  -4.737   9.297
  722    H    GLU  93           HN       GLU  93  -5.933  -1.200   9.622
  723    HA   GLU  93           HA       GLU  93  -6.085   1.584   8.603
  724   1HB   GLU  93           HB2      GLU  93  -3.866  -0.447   8.844
  725   2HB   GLU  93           HB1      GLU  93  -3.679   1.000   7.852
  726   1HG   GLU  93           HG2      GLU  93  -4.675   1.264  10.673
  727   2HG   GLU  93           HG1      GLU  93  -2.948   1.057  10.378
  728    H    LEU  94           HN       LEU  94  -5.777   2.030   6.339
  729    HA   LEU  94           HA       LEU  94  -6.901  -0.071   4.597
  730   1HB   LEU  94           HB2      LEU  94  -7.517   2.477   4.622
  731   2HB   LEU  94           HB1      LEU  94  -6.056   2.658   3.649
  732    HG   LEU  94           HG       LEU  94  -7.055   0.709   2.227
  733   1HD1  LEU  94          HD12      LEU  94  -9.366   1.609   3.926
  734   2HD1  LEU  94          HD11      LEU  94  -9.656   1.055   2.278
  735   3HD1  LEU  94          HD13      LEU  94  -8.907  -0.027   3.451
  736   1HD2  LEU  94          HD22      LEU  94  -7.959   3.583   2.292
  737   2HD2  LEU  94          HD21      LEU  94  -6.852   2.799   1.165
  738   3HD2  LEU  94          HD23      LEU  94  -8.584   2.481   1.064
  739    H    VAL  95           HN       VAL  95  -5.744  -1.127   3.010
  740    HA   VAL  95           HA       VAL  95  -2.933  -0.256   2.517
  741    HB   VAL  95           HB       VAL  95  -3.788  -3.131   2.962
  742   1HG1  VAL  95          HG12      VAL  95  -1.151  -1.755   2.421
  743   2HG1  VAL  95          HG11      VAL  95  -1.237  -3.369   3.128
  744   3HG1  VAL  95          HG13      VAL  95  -1.895  -3.075   1.518
  745   1HG2  VAL  95          HG22      VAL  95  -2.280  -1.217   4.772
  746   2HG2  VAL  95          HG21      VAL  95  -3.895  -1.861   5.063
  747   3HG2  VAL  95          HG23      VAL  95  -2.501  -2.939   5.080
  748    H    ILE  96           HN       ILE  96  -2.621  -0.028   0.364
  749    HA   ILE  96           HA       ILE  96  -4.561  -1.260  -1.508
  750    HB   ILE  96           HB       ILE  96  -2.307   0.678  -2.100
  751   1HG1  ILE  96          HG12      ILE  96  -3.889   1.651  -0.469
  752   2HG1  ILE  96          HG11      ILE  96  -4.047   2.435  -2.038
  753   1HG2  ILE  96          HG22      ILE  96  -3.302  -0.682  -3.991
  754   2HG2  ILE  96          HG21      ILE  96  -4.843   0.108  -3.654
  755   3HG2  ILE  96          HG23      ILE  96  -3.457   1.065  -4.177
  756   1HD1  ILE  96          HD11      ILE  96  -5.971   0.895  -2.544
  757   2HD1  ILE  96          HD13      ILE  96  -5.861   0.294  -0.889
  758   3HD1  ILE  96          HD12      ILE  96  -6.274   1.982  -1.188
  759    H    ALA  97           HN       ALA  97  -4.048  -3.176  -2.427
  760    HA   ALA  97           HA       ALA  97  -1.184  -3.991  -2.537
  761   1HB   ALA  97           HB1      ALA  97  -3.280  -5.390  -1.582
  762   2HB   ALA  97           HB3      ALA  97  -3.354  -5.894  -3.272
  763   3HB   ALA  97           HB2      ALA  97  -1.887  -6.169  -2.332
  764    H    GLY  98           HN       GLY  98  -3.993  -3.323  -4.534
  765   1HA   GLY  98           HA2      GLY  98  -2.664  -2.648  -6.867
  766   2HA   GLY  98           HA1      GLY  98  -2.845  -4.398  -6.983
  767    H    GLY  99           HN       GLY  99  -5.905  -3.218  -8.606
  768   1HA   GLY  99           HA2      GLY  99  -3.158  -4.199  -8.972
  769   2HA   GLY  99           HA1      GLY  99  -4.333  -3.894 -10.252
  770    H    ALA 100           HN       ALA 100  -2.691  -2.735 -11.450
  771    HA   ALA 100           HA       ALA 100  -1.309  -0.446 -10.384
  772   1HB   ALA 100           HB1      ALA 100  -1.901  -1.430 -13.174
  773   2HB   ALA 100           HB3      ALA 100  -1.095   0.117 -12.908
  774   3HB   ALA 100           HB2      ALA 100  -0.351  -1.375 -12.334
  775    H    GLN 101           HN       GLN 101  -4.446  -0.902 -11.907
  776    HA   GLN 101           HA       GLN 101  -4.963   1.923 -12.338
  777   1HB   GLN 101           HB2      GLN 101  -6.871  -0.429 -12.139
  778   2HB   GLN 101           HB1      GLN 101  -7.302   1.184 -12.710
  779   1HG   GLN 101           HG2      GLN 101  -5.971   0.988 -14.646
  780   2HG   GLN 101           HG1      GLN 101  -5.034  -0.347 -13.973
  781   1HE2  GLN 101          HE22      GLN 101  -8.890  -1.282 -15.079
  782   2HE2  GLN 101          HE21      GLN 101  -8.595   0.183 -14.274
  783    H    ILE 102           HN       ILE 102  -5.367  -0.312  -9.674
  784    HA   ILE 102           HA       ILE 102  -7.192   1.361  -8.155
  785    HB   ILE 102           HB       ILE 102  -5.336  -0.811  -7.144
  786   1HG1  ILE 102          HG12      ILE 102  -6.744  -1.641  -8.997
  787   2HG1  ILE 102          HG11      ILE 102  -7.256  -2.335  -7.461
  788   1HG2  ILE 102          HG23      ILE 102  -7.700   0.666  -6.028
  789   2HG2  ILE 102          HG22      ILE 102  -7.398  -0.996  -5.523
  790   3HG2  ILE 102          HG21      ILE 102  -6.176   0.246  -5.245
  791   1HD1  ILE 102          HD11      ILE 102  -9.023  -0.558  -7.309
  792   2HD1  ILE 102          HD13      ILE 102  -8.563  -0.022  -8.925
  793   3HD1  ILE 102          HD12      ILE 102  -9.235  -1.636  -8.689
  794    H    PHE 103           HN       PHE 103  -3.678   0.945  -8.297
  795    HA   PHE 103           HA       PHE 103  -3.026   2.518  -5.998
  796   1HB   PHE 103           HB2      PHE 103  -1.519   1.864  -8.536
  797   2HB   PHE 103           HB1      PHE 103  -0.813   2.853  -7.258
  798    HD1  PHE 103           HD1      PHE 103  -1.531   1.725  -4.778
  799    HD2  PHE 103           HD2      PHE 103  -0.749  -0.331  -8.469
  800    HE1  PHE 103           HE1      PHE 103  -0.945  -0.326  -3.512
  801    HE2  PHE 103           HE2      PHE 103  -0.163  -2.380  -7.202
  802    HZ   PHE 103           HZ       PHE 103  -0.261  -2.378  -4.724
  803    H    THR 104           HN       THR 104  -3.278   3.404  -9.452
  804    HA   THR 104           HA       THR 104  -2.685   6.178  -9.098
  805    HB   THR 104           HB       THR 104  -4.255   6.241 -11.281
  806    HG1  THR 104           HG1      THR 104  -4.883   4.323 -11.790
  807   1HG2  THR 104          HG21      THR 104  -1.480   5.059 -11.033
  808   2HG2  THR 104          HG23      THR 104  -2.212   5.515 -12.572
  809   3HG2  THR 104          HG22      THR 104  -1.900   6.743 -11.344
  810    H    ALA 105           HN       ALA 105  -5.611   4.308  -8.647
  811    HA   ALA 105           HA       ALA 105  -7.448   6.538  -8.621
  812   1HB   ALA 105           HB3      ALA 105  -7.559   3.702  -7.604
  813   2HB   ALA 105           HB2      ALA 105  -8.860   4.838  -7.252
  814   3HB   ALA 105           HB1      ALA 105  -8.470   4.434  -8.924
  815    H    PHE 106           HN       PHE 106  -5.457   4.947  -6.177
  816    HA   PHE 106           HA       PHE 106  -6.523   6.806  -4.105
  817   1HB   PHE 106           HB2      PHE 106  -4.913   4.251  -3.955
  818   2HB   PHE 106           HB1      PHE 106  -5.128   5.309  -2.561
  819    HD1  PHE 106           HD2      PHE 106  -7.195   3.757  -5.289
  820    HD2  PHE 106           HD1      PHE 106  -6.927   4.877  -1.151
  821    HE1  PHE 106           HE2      PHE 106  -9.427   2.759  -4.873
  822    HE2  PHE 106           HE1      PHE 106  -9.159   3.879  -0.736
  823    HZ   PHE 106           HZ       PHE 106 -10.409   2.820  -2.597
  824    H    LYS 107           HN       LYS 107  -4.321   7.108  -6.385
  825    HA   LYS 107           HA       LYS 107  -1.868   7.684  -4.992
  826   1HB   LYS 107           HB2      LYS 107  -2.233   7.318  -7.521
  827   2HB   LYS 107           HB1      LYS 107  -2.733   9.009  -7.563
  828   1HG   LYS 107           HG2      LYS 107  -0.588   9.710  -6.636
  829   2HG   LYS 107           HG1      LYS 107  -0.085   8.028  -6.463
  830   1HD   LYS 107           HD2      LYS 107   0.025   7.702  -8.813
  831   2HD   LYS 107           HD1      LYS 107  -0.889   9.175  -9.138
  832   1HE   LYS 107           HE2      LYS 107   1.081  10.380  -7.923
  833   2HE   LYS 107           HE1      LYS 107   1.971   8.891  -8.244
  834   1HZ   LYS 107           HZ1      LYS 107   1.358   9.131 -10.602
  835   2HZ   LYS 107           HZ3      LYS 107   0.642  10.628 -10.250
  836   3HZ   LYS 107           HZ2      LYS 107   2.314  10.417 -10.037
  837    H    ASP 108           HN       ASP 108  -4.760   9.561  -5.703
  838    HA   ASP 108           HA       ASP 108  -3.576  12.103  -4.882
  839   1HB   ASP 108           HB2      ASP 108  -5.592  11.702  -6.482
  840   2HB   ASP 108           HB1      ASP 108  -6.536  11.555  -4.999
  841    H    ASP 109           HN       ASP 109  -3.808   9.604  -3.038
  842    HA   ASP 109           HA       ASP 109  -4.380  11.135  -0.612
  843   1HB   ASP 109           HB2      ASP 109  -6.251   9.013  -1.633
  844   2HB   ASP 109           HB1      ASP 109  -6.036   9.222   0.105
  845    H    VAL 110           HN       VAL 110  -2.077   9.796  -1.668
  846    HA   VAL 110           HA       VAL 110  -1.835   7.325  -0.043
  847    HB   VAL 110           HB       VAL 110  -1.008   7.274  -2.369
  848   1HG1  VAL 110          HG11      VAL 110   0.866   9.460  -1.414
  849   2HG1  VAL 110          HG13      VAL 110   1.000   8.623  -2.961
  850   3HG1  VAL 110          HG12      VAL 110  -0.408   9.630  -2.621
  851   1HG2  VAL 110          HG21      VAL 110   0.181   6.131  -0.301
  852   2HG2  VAL 110          HG23      VAL 110   0.942   6.093  -1.892
  853   3HG2  VAL 110          HG22      VAL 110   1.478   7.263  -0.685
  854    H    ASP 111           HN       ASP 111  -0.333   7.147   1.660
  855    HA   ASP 111           HA       ASP 111   0.924   9.712   2.552
  856   1HB   ASP 111           HB2      ASP 111  -0.280   7.540   4.297
  857   2HB   ASP 111           HB1      ASP 111   0.488   9.020   4.873
  858    H    THR 112           HN       THR 112   1.046   6.163   3.023
  859    HA   THR 112           HA       THR 112   3.991   6.398   3.424
  860    HB   THR 112           HB       THR 112   2.345   3.904   3.857
  861    HG1  THR 112           HG1      THR 112   2.097   6.218   5.132
  862   1HG2  THR 112          HG23      THR 112   4.827   3.760   3.838
  863   2HG2  THR 112          HG22      THR 112   4.884   4.951   5.138
  864   3HG2  THR 112          HG21      THR 112   4.148   3.373   5.420
  865    H    LEU 113           HN       LEU 113   5.344   4.738   2.330
  866    HA   LEU 113           HA       LEU 113   4.120   3.596  -0.134
  867   1HB   LEU 113           HB2      LEU 113   6.491   5.461   0.014
  868   2HB   LEU 113           HB1      LEU 113   6.253   4.366  -1.348
  869    HG   LEU 113           HG       LEU 113   4.037   6.190  -0.427
  870   1HD1  LEU 113          HD13      LEU 113   6.321   6.823  -2.316
  871   2HD1  LEU 113          HD12      LEU 113   4.823   7.750  -2.250
  872   3HD1  LEU 113          HD11      LEU 113   5.885   7.690  -0.843
  873   1HD2  LEU 113          HD21      LEU 113   4.765   4.855  -3.054
  874   2HD2  LEU 113          HD23      LEU 113   3.450   4.390  -1.974
  875   3HD2  LEU 113          HD22      LEU 113   3.388   5.933  -2.827
  876    H    LEU 114           HN       LEU 114   4.392   1.474   0.553
  877    HA   LEU 114           HA       LEU 114   7.090   0.627   1.477
  878   1HB   LEU 114           HB2      LEU 114   4.415  -0.804   1.439
  879   2HB   LEU 114           HB1      LEU 114   5.921  -1.536   1.993
  880    HG   LEU 114           HG       LEU 114   4.952   1.080   3.136
  881   1HD1  LEU 114          HD11      LEU 114   4.262  -1.722   4.076
  882   2HD1  LEU 114          HD13      LEU 114   3.943  -0.244   4.983
  883   3HD1  LEU 114          HD12      LEU 114   3.127  -0.529   3.446
  884   1HD2  LEU 114          HD21      LEU 114   6.832  -1.129   4.011
  885   2HD2  LEU 114          HD23      LEU 114   7.231   0.554   3.668
  886   3HD2  LEU 114          HD22      LEU 114   6.287   0.146   5.100
  887    H    VAL 115           HN       VAL 115   8.411   0.182  -0.232
  888    HA   VAL 115           HA       VAL 115   7.252  -1.365  -2.515
  889    HB   VAL 115           HB       VAL 115   8.067   0.876  -3.154
  890   1HG1  VAL 115          HG11      VAL 115   9.811   0.887  -1.262
  891   2HG1  VAL 115          HG13      VAL 115  10.837  -0.033  -2.365
  892   3HG1  VAL 115          HG12      VAL 115  10.302   1.589  -2.804
  893   1HG2  VAL 115          HG22      VAL 115   8.342  -1.157  -4.665
  894   2HG2  VAL 115          HG21      VAL 115   9.420   0.194  -5.013
  895   3HG2  VAL 115          HG23      VAL 115  10.024  -1.214  -4.139
  896    H    THR 116           HN       THR 116   8.197  -3.312  -3.023
  897    HA   THR 116           HA       THR 116  10.475  -4.185  -1.297
  898    HB   THR 116           HB       THR 116   8.530  -5.918  -2.849
  899    HG1  THR 116           HG1      THR 116   7.210  -5.491  -1.297
  900   1HG2  THR 116          HG21      THR 116  10.891  -6.726  -2.082
  901   2HG2  THR 116          HG23      THR 116  10.182  -6.721  -0.468
  902   3HG2  THR 116          HG22      THR 116   9.490  -7.738  -1.731
  903    H    ARG 117           HN       ARG 117  12.307  -3.726  -2.476
  904    HA   ARG 117           HA       ARG 117  12.359  -4.187  -5.387
  905   1HB   ARG 117           HB2      ARG 117  14.405  -3.145  -3.414
  906   2HB   ARG 117           HB1      ARG 117  14.758  -3.391  -5.123
  907   1HG   ARG 117           HG2      ARG 117  12.774  -1.913  -5.651
  908   2HG   ARG 117           HG1      ARG 117  12.684  -1.536  -3.930
  909   1HD   ARG 117           HD2      ARG 117  15.207  -0.933  -4.166
  910   2HD   ARG 117           HD1      ARG 117  14.862  -0.855  -5.893
  911    HE   ARG 117           HE       ARG 117  12.881   0.685  -4.593
  912   1HH1  ARG 117          HH11      ARG 117  16.326   0.672  -5.041
  913   2HH1  ARG 117          HH12      ARG 117  16.466   2.395  -4.930
  914   1HH2  ARG 117          HH21      ARG 117  13.075   2.919  -4.451
  915   2HH2  ARG 117          HH22      ARG 117  14.635   3.660  -4.598
  916    H    LEU 118           HN       LEU 118  13.555  -5.815  -6.398
  917    HA   LEU 118           HA       LEU 118  14.703  -7.903  -4.586
  918   1HB   LEU 118           HB2      LEU 118  12.806  -8.073  -6.845
  919   2HB   LEU 118           HB1      LEU 118  14.126  -9.242  -6.919
  920    HG   LEU 118           HG       LEU 118  13.592  -9.778  -4.472
  921   1HD1  LEU 118          HD11      LEU 118  11.101  -8.223  -5.236
  922   2HD1  LEU 118          HD13      LEU 118  11.242  -9.245  -3.805
  923   3HD1  LEU 118          HD12      LEU 118  12.249  -7.805  -3.964
  924   1HD2  LEU 118          HD21      LEU 118  12.913 -11.117  -6.552
  925   2HD2  LEU 118          HD23      LEU 118  11.946 -11.391  -5.102
  926   3HD2  LEU 118          HD22      LEU 118  11.327 -10.361  -6.392
  927    H    ALA 119           HN       ALA 119  16.793  -8.495  -5.004
  928    HA   ALA 119           HA       ALA 119  18.393  -6.951  -6.831
  929   1HB   ALA 119           HB3      ALA 119  19.121  -8.188  -4.675
  930   2HB   ALA 119           HB2      ALA 119  19.218  -9.622  -5.696
  931   3HB   ALA 119           HB1      ALA 119  20.228  -8.219  -6.048
  932    H    GLY 120           HN       GLY 120  16.884 -10.141  -7.014
  933   1HA   GLY 120           HA2      GLY 120  18.201 -10.925  -9.474
  934   2HA   GLY 120           HA1      GLY 120  16.768 -11.688  -8.784
  935    H    SER 121           HN       SER 121  17.763 -10.151 -11.473
  936    HA   SER 121           HA       SER 121  15.543  -8.312 -11.913
  937   1HB   SER 121           HB2      SER 121  16.413  -8.488 -14.343
  938   2HB   SER 121           HB1      SER 121  17.497  -7.793 -13.140
  939    HG   SER 121           HG       SER 121  17.455 -10.542 -13.844
  940    H    PHE 122           HN       PHE 122  13.673  -8.701 -13.126
  941    HA   PHE 122           HA       PHE 122  13.269 -11.377 -14.321
  942   1HB   PHE 122           HB2      PHE 122  11.511 -10.250 -12.122
  943   2HB   PHE 122           HB1      PHE 122  11.121 -11.672 -13.089
  944    HD1  PHE 122           HD2      PHE 122  12.813 -13.615 -13.099
  945    HD2  PHE 122           HD1      PHE 122  12.875 -10.438 -10.208
  946    HE1  PHE 122           HE2      PHE 122  14.181 -15.022 -11.582
  947    HE2  PHE 122           HE1      PHE 122  14.243 -11.845  -8.691
  948    HZ   PHE 122           HZ       PHE 122  14.896 -14.138  -9.378
  949    H    GLU 123           HN       GLU 123  12.486 -10.924 -16.312
  950    HA   GLU 123           HA       GLU 123  11.100  -8.379 -16.829
  951   1HB   GLU 123           HB2      GLU 123  11.947 -10.680 -18.608
  952   2HB   GLU 123           HB1      GLU 123  11.063  -9.275 -19.205
  953   1HG   GLU 123           HG2      GLU 123  12.860  -7.799 -18.332
  954   2HG   GLU 123           HG1      GLU 123  13.759  -9.228 -17.818
  955    H    GLY 124           HN       GLY 124   8.927  -8.208 -17.483
  956   1HA   GLY 124           HA2      GLY 124   7.286 -10.683 -17.534
  957   2HA   GLY 124           HA1      GLY 124   6.859  -9.439 -16.357
  958    H    ASP 125           HN       ASP 125   5.100  -8.367 -17.108
  959    HA   ASP 125           HA       ASP 125   5.211  -7.258 -19.866
  960   1HB   ASP 125           HB2      ASP 125   3.037  -8.988 -18.696
  961   2HB   ASP 125           HB1      ASP 125   2.669  -7.808 -19.955
  962    H    THR 126           HN       THR 126   3.738  -7.231 -16.646
  963    HA   THR 126           HA       THR 126   2.640  -4.519 -17.135
  964    HB   THR 126           HB       THR 126   2.452  -6.020 -14.530
  965    HG1  THR 126           HG1      THR 126   0.409  -6.787 -15.543
  966   1HG2  THR 126          HG21      THR 126   1.665  -3.618 -14.855
  967   2HG2  THR 126          HG23      THR 126   0.441  -4.263 -15.948
  968   3HG2  THR 126          HG22      THR 126   0.450  -4.744 -14.251
  969    H    LYS 127           HN       LYS 127   3.424  -2.693 -16.077
  970    HA   LYS 127           HA       LYS 127   5.887  -3.086 -14.420
  971   1HB   LYS 127           HB2      LYS 127   5.246  -0.813 -16.327
  972   2HB   LYS 127           HB1      LYS 127   6.698  -0.937 -15.333
  973   1HG   LYS 127           HG2      LYS 127   7.348  -2.997 -16.480
  974   2HG   LYS 127           HG1      LYS 127   5.863  -2.959 -17.432
  975   1HD   LYS 127           HD2      LYS 127   6.559  -0.765 -18.379
  976   2HD   LYS 127           HD1      LYS 127   8.077  -0.889 -17.489
  977   1HE   LYS 127           HE2      LYS 127   7.105  -2.923 -19.517
  978   2HE   LYS 127           HE1      LYS 127   8.288  -1.659 -19.854
  979   1HZ   LYS 127           HZ3      LYS 127   9.576  -2.602 -17.920
  980   2HZ   LYS 127           HZ2      LYS 127   8.536  -3.944 -17.989
  981   3HZ   LYS 127           HZ1      LYS 127   9.523  -3.561 -19.318
  982    H    MET 128           HN       MET 128   6.294  -0.997 -13.059
  983    HA   MET 128           HA       MET 128   3.769  -0.412 -11.628
  984   1HB   MET 128           HB2      MET 128   5.902  -1.132 -10.439
  985   2HB   MET 128           HB1      MET 128   6.571   0.442 -10.866
  986   1HG   MET 128           HG2      MET 128   5.643   0.632  -8.647
  987   2HG   MET 128           HG1      MET 128   4.572   1.502  -9.745
  988   1HE   MET 128           HE3      MET 128   3.312   1.438  -7.614
  989   2HE   MET 128           HE2      MET 128   1.990   1.264  -8.765
  990   3HE   MET 128           HE1      MET 128   2.020   0.267  -7.313
  991    H    ILE 129           HN       ILE 129   3.147   1.783 -11.140
  992    HA   ILE 129           HA       ILE 129   3.570   3.625 -13.344
  993    HB   ILE 129           HB       ILE 129   2.170   5.172 -11.952
  994   1HG1  ILE 129          HG12      ILE 129   2.066   2.849 -10.007
  995   2HG1  ILE 129          HG11      ILE 129   3.082   4.271  -9.761
  996   1HG2  ILE 129          HG21      ILE 129   1.323   3.184 -13.433
  997   2HG2  ILE 129          HG23      ILE 129   0.903   2.446 -11.887
  998   3HG2  ILE 129          HG22      ILE 129   0.188   3.990 -12.350
  999   1HD1  ILE 129          HD13      ILE 129   0.956   5.664 -10.053
 1000   2HD1  ILE 129          HD12      ILE 129   0.064   4.150  -9.908
 1001   3HD1  ILE 129          HD11      ILE 129   1.063   4.717  -8.570
 1002    HA   PRO 130           HA       PRO 130   6.912   6.048 -11.684
 1003   1HB   PRO 130           HB2      PRO 130   6.155   8.553 -12.678
 1004   2HB   PRO 130           HB1      PRO 130   7.066   7.319 -13.560
 1005   1HG   PRO 130           HG2      PRO 130   4.397   8.232 -14.046
 1006   2HG   PRO 130           HG1      PRO 130   5.322   7.019 -14.942
 1007   1HD   PRO 130           HD2      PRO 130   3.189   6.626 -12.983
 1008   2HD   PRO 130           HD1      PRO 130   3.892   5.465 -14.121
 1009    H    LEU 131           HN       LEU 131   6.574   6.091  -9.426
 1010    HA   LEU 131           HA       LEU 131   4.618   7.956  -8.264
 1011   1HB   LEU 131           HB2      LEU 131   6.704   6.177  -6.962
 1012   2HB   LEU 131           HB1      LEU 131   5.466   7.089  -6.098
 1013    HG   LEU 131           HG       LEU 131   4.762   5.120  -8.278
 1014   1HD1  LEU 131          HD12      LEU 131   5.060   4.620  -5.302
 1015   2HD1  LEU 131          HD11      LEU 131   4.293   3.505  -6.433
 1016   3HD1  LEU 131          HD13      LEU 131   6.011   3.876  -6.588
 1017   1HD2  LEU 131          HD23      LEU 131   3.071   6.803  -7.563
 1018   2HD2  LEU 131          HD22      LEU 131   2.580   5.159  -7.156
 1019   3HD2  LEU 131          HD21      LEU 131   3.223   6.223  -5.905
 1020    H    ASN 132           HN       ASN 132   5.109   9.940  -7.384
 1021    HA   ASN 132           HA       ASN 132   7.708  11.110  -8.023
 1022   1HB   ASN 132           HB2      ASN 132   5.400  12.282  -8.054
 1023   2HB   ASN 132           HB1      ASN 132   5.586  12.395  -6.303
 1024   1HD2  ASN 132          HD22      ASN 132   7.431  15.360  -6.751
 1025   2HD2  ASN 132          HD21      ASN 132   6.141  14.576  -5.973
 1026    H    TRP 133           HN       TRP 133   9.137   9.844  -6.693
 1027    HA   TRP 133           HA       TRP 133   8.804   9.588  -3.841
 1028   1HB   TRP 133           HB2      TRP 133  11.296   9.405  -5.564
 1029   2HB   TRP 133           HB1      TRP 133  11.206   8.922  -3.869
 1030    HD1  TRP 133           HD1      TRP 133  10.204   7.846  -7.357
 1031    HE1  TRP 133           HE1      TRP 133   9.229   5.461  -7.263
 1032    HE3  TRP 133           HE3      TRP 133   9.875   7.223  -2.299
 1033    HZ2  TRP 133           HZ2      TRP 133   8.417   3.543  -5.302
 1034    HZ3  TRP 133           HZ3      TRP 133   8.997   5.111  -1.346
 1035    HH2  TRP 133           HH2      TRP 133   8.269   3.271  -2.840
 1036    H    ASP 134           HN       ASP 134   9.821  12.191  -5.845
 1037    HA   ASP 134           HA       ASP 134  11.628  13.541  -4.091
 1038   1HB   ASP 134           HB2      ASP 134  11.101  14.086  -6.541
 1039   2HB   ASP 134           HB1      ASP 134   9.666  14.916  -5.937
 1040    H    ASP 135           HN       ASP 135   8.152  13.218  -4.082
 1041    HA   ASP 135           HA       ASP 135   7.875  15.335  -2.018
 1042   1HB   ASP 135           HB2      ASP 135   5.971  13.803  -3.761
 1043   2HB   ASP 135           HB1      ASP 135   5.376  14.513  -2.260
 1044    H    PHE 136           HN       PHE 136   9.274  12.762  -1.508
 1045    HA   PHE 136           HA       PHE 136   7.674  11.953   0.863
 1046   1HB   PHE 136           HB2      PHE 136   8.657  10.131  -1.332
 1047   2HB   PHE 136           HB1      PHE 136   8.407   9.528   0.306
 1048    HD1  PHE 136           HD2      PHE 136   6.131   9.768   1.379
 1049    HD2  PHE 136           HD1      PHE 136   6.819  10.557  -2.787
 1050    HE1  PHE 136           HE2      PHE 136   3.696   9.591   0.944
 1051    HE2  PHE 136           HE1      PHE 136   4.384  10.380  -3.222
 1052    HZ   PHE 136           HZ       PHE 136   2.823   9.898  -1.357
 1053    H    THR 137           HN       THR 137   9.144  10.372   2.226
 1054    HA   THR 137           HA       THR 137  12.028  10.946   1.936
 1055    HB   THR 137           HB       THR 137  10.657  11.609   4.546
 1056    HG1  THR 137           HG1      THR 137  10.183  13.510   3.801
 1057   1HG2  THR 137          HG21      THR 137  13.371  12.080   3.317
 1058   2HG2  THR 137          HG23      THR 137  12.801  13.033   4.687
 1059   3HG2  THR 137          HG22      THR 137  12.981  11.285   4.844
 1060    H    LYS 138           HN       LYS 138  13.227   9.240   2.695
 1061    HA   LYS 138           HA       LYS 138  11.872   6.829   3.541
 1062   1HB   LYS 138           HB2      LYS 138  14.111   7.066   2.251
 1063   2HB   LYS 138           HB1      LYS 138  14.834   7.315   3.839
 1064   1HG   LYS 138           HG2      LYS 138  13.792   5.165   4.594
 1065   2HG   LYS 138           HG1      LYS 138  13.237   4.901   2.940
 1066   1HD   LYS 138           HD2      LYS 138  16.145   5.430   3.548
 1067   2HD   LYS 138           HD1      LYS 138  15.473   3.802   3.633
 1068   1HE   LYS 138           HE2      LYS 138  14.688   4.007   1.298
 1069   2HE   LYS 138           HE1      LYS 138  15.377   5.628   1.213
 1070   1HZ   LYS 138           HZ1      LYS 138  17.249   3.684   2.160
 1071   2HZ   LYS 138           HZ3      LYS 138  16.667   3.308   0.612
 1072   3HZ   LYS 138           HZ2      LYS 138  17.404   4.812   0.899
 1073    H    VAL 139           HN       VAL 139  12.254   5.717   5.603
 1074    HA   VAL 139           HA       VAL 139  13.131   7.458   7.848
 1075    HB   VAL 139           HB       VAL 139  11.105   6.763   9.154
 1076   1HG1  VAL 139          HG11      VAL 139  11.353   8.927   7.748
 1077   2HG1  VAL 139          HG13      VAL 139  10.249   8.148   6.615
 1078   3HG1  VAL 139          HG12      VAL 139   9.732   8.469   8.270
 1079   1HG2  VAL 139          HG21      VAL 139  10.182   5.781   6.433
 1080   2HG2  VAL 139          HG23      VAL 139  10.546   4.760   7.825
 1081   3HG2  VAL 139          HG22      VAL 139   9.178   5.871   7.880
 1082    H    SER 140           HN       SER 140  12.334   4.264   6.598
 1083    HA   SER 140           HA       SER 140  14.383   3.066   8.320
 1084   1HB   SER 140           HB2      SER 140  12.854   1.410   9.327
 1085   2HB   SER 140           HB1      SER 140  12.411   3.047   9.804
 1086    HG   SER 140           HG       SER 140  10.537   2.174   9.135
 1087    H    SER 141           HN       SER 141  14.906   0.882   7.626
 1088    HA   SER 141           HA       SER 141  13.538  -0.137   5.210
 1089   1HB   SER 141           HB2      SER 141  15.726  -0.314   3.993
 1090   2HB   SER 141           HB1      SER 141  15.196   1.348   4.237
 1091    HG   SER 141           HG       SER 141  16.966  -0.052   5.962
 1092    H    ARG 142           HN       ARG 142  13.305  -2.285   5.537
 1093    HA   ARG 142           HA       ARG 142  15.149  -3.653   7.428
 1094   1HB   ARG 142           HB2      ARG 142  12.568  -3.750   7.604
 1095   2HB   ARG 142           HB1      ARG 142  12.652  -4.845   6.224
 1096   1HG   ARG 142           HG2      ARG 142  14.120  -6.353   7.461
 1097   2HG   ARG 142           HG1      ARG 142  14.160  -5.235   8.826
 1098   1HD   ARG 142           HD2      ARG 142  11.891  -5.620   9.360
 1099   2HD   ARG 142           HD1      ARG 142  11.551  -6.333   7.783
 1100    HE   ARG 142           HE       ARG 142  12.376  -8.395   8.589
 1101   1HH1  ARG 142          HH21      ARG 142  13.284  -5.777  10.684
 1102   2HH1  ARG 142          HH22      ARG 142  13.914  -6.823  11.913
 1103   1HH2  ARG 142          HH11      ARG 142  13.196  -9.741  10.191
 1104   2HH2  ARG 142          HH12      ARG 142  13.864  -9.056  11.634
 1105    H    THR 143           HN       THR 143  16.919  -4.390   6.320
 1106    HA   THR 143           HA       THR 143  16.663  -5.413   3.574
 1107    HB   THR 143           HB       THR 143  19.136  -5.617   5.287
 1108    HG1  THR 143           HG1      THR 143  19.578  -3.518   4.850
 1109   1HG2  THR 143          HG21      THR 143  18.813  -6.566   2.876
 1110   2HG2  THR 143          HG23      THR 143  18.947  -4.879   2.378
 1111   3HG2  THR 143          HG22      THR 143  20.276  -5.652   3.242
 1112    H    VAL 144           HN       VAL 144  16.842  -7.585   2.984
 1113    HA   VAL 144           HA       VAL 144  17.303  -9.600   5.108
 1114    HB   VAL 144           HB       VAL 144  14.862  -9.224   5.093
 1115   1HG1  VAL 144          HG13      VAL 144  14.806  -8.447   2.685
 1116   2HG1  VAL 144          HG12      VAL 144  14.927 -10.141   2.208
 1117   3HG1  VAL 144          HG11      VAL 144  13.528  -9.579   3.123
 1118   1HG2  VAL 144          HG21      VAL 144  15.847 -11.531   5.420
 1119   2HG2  VAL 144          HG23      VAL 144  14.187 -11.528   4.822
 1120   3HG2  VAL 144          HG22      VAL 144  15.524 -11.841   3.715
 1121    H    GLU 145           HN       GLU 145  18.552 -11.228   4.319
 1122    HA   GLU 145           HA       GLU 145  18.916 -11.383   1.359
 1123   1HB   GLU 145           HB2      GLU 145  20.886 -10.944   2.988
 1124   2HB   GLU 145           HB1      GLU 145  20.729 -12.649   3.412
 1125   1HG   GLU 145           HG2      GLU 145  21.240 -13.364   1.217
 1126   2HG   GLU 145           HG1      GLU 145  20.936 -11.765   0.536
 1127    H    ASP 146           HN       ASP 146  17.954 -13.085   0.380
 1128    HA   ASP 146           HA       ASP 146  16.859 -15.296   1.955
 1129   1HB   ASP 146           HB2      ASP 146  15.885 -14.175  -0.207
 1130   2HB   ASP 146           HB1      ASP 146  16.981 -15.269  -1.051
 1131    H    THR 147           HN       THR 147  17.242 -17.487   0.287
 1132    HA   THR 147           HA       THR 147  19.918 -18.315   1.044
 1133    HB   THR 147           HB       THR 147  19.247 -20.367  -0.398
 1134    HG1  THR 147           HG1      THR 147  17.568 -19.899  -1.570
 1135   1HG2  THR 147          HG21      THR 147  17.593 -19.497   1.988
 1136   2HG2  THR 147          HG23      THR 147  17.694 -21.150   1.383
 1137   3HG2  THR 147          HG22      THR 147  19.129 -20.363   2.041
 1138    H    ASN 148           HN       ASN 148  18.340 -17.421  -2.012
 1139    HA   ASN 148           HA       ASN 148  20.952 -17.708  -3.409
 1140   1HB   ASN 148           HB2      ASN 148  18.730 -18.694  -4.306
 1141   2HB   ASN 148           HB1      ASN 148  18.320 -17.028  -4.719
 1142   1HD2  ASN 148          HD22      ASN 148  20.848 -19.070  -7.090
 1143   2HD2  ASN 148          HD21      ASN 148  19.990 -19.804  -5.823
 1144    HA   PRO 149           HA       PRO 149  21.854 -13.348  -3.187
 1145   1HB   PRO 149           HB2      PRO 149  22.789 -13.312  -5.933
 1146   2HB   PRO 149           HB1      PRO 149  23.730 -13.199  -4.440
 1147   1HG   PRO 149           HG2      PRO 149  23.448 -15.441  -6.208
 1148   2HG   PRO 149           HG1      PRO 149  24.455 -15.296  -4.762
 1149   1HD   PRO 149           HD2      PRO 149  22.173 -16.904  -5.039
 1150   2HD   PRO 149           HD1      PRO 149  23.001 -16.508  -3.526
 1151    H    ALA 150           HN       ALA 150  20.423 -14.531  -6.243
 1152    HA   ALA 150           HA       ALA 150  19.287 -12.019  -7.029
 1153   1HB   ALA 150           HB1      ALA 150  18.368 -14.834  -7.688
 1154   2HB   ALA 150           HB3      ALA 150  17.882 -13.371  -8.545
 1155   3HB   ALA 150           HB2      ALA 150  19.562 -13.906  -8.595
 1156    H    LEU 151           HN       LEU 151  18.239 -14.509  -4.803
 1157    HA   LEU 151           HA       LEU 151  15.489 -13.527  -4.638
 1158   1HB   LEU 151           HB2      LEU 151  17.110 -15.544  -3.084
 1159   2HB   LEU 151           HB1      LEU 151  15.498 -15.060  -2.555
 1160    HG   LEU 151           HG       LEU 151  16.089 -16.058  -5.351
 1161   1HD1  LEU 151          HD11      LEU 151  16.526 -17.719  -3.420
 1162   2HD1  LEU 151          HD13      LEU 151  14.784 -17.661  -3.151
 1163   3HD1  LEU 151          HD12      LEU 151  15.420 -18.233  -4.693
 1164   1HD2  LEU 151          HD23      LEU 151  13.583 -15.520  -3.740
 1165   2HD2  LEU 151          HD22      LEU 151  14.059 -14.793  -5.275
 1166   3HD2  LEU 151          HD21      LEU 151  13.570 -16.487  -5.216
 1167    H    THR 152           HN       THR 152  17.990 -11.813  -3.972
 1168    HA   THR 152           HA       THR 152  17.516 -11.157  -1.135
 1169    HB   THR 152           HB       THR 152  19.308  -9.776  -3.157
 1170    HG1  THR 152           HG1      THR 152  20.888 -11.115  -2.428
 1171   1HG2  THR 152          HG23      THR 152  18.997  -9.649  -0.160
 1172   2HG2  THR 152          HG22      THR 152  20.503  -9.179  -0.947
 1173   3HG2  THR 152          HG21      THR 152  19.009  -8.320  -1.319
 1174    H    HIS 153           HN       HIS 153  16.423  -9.331  -0.427
 1175    HA   HIS 153           HA       HIS 153  15.595  -7.254  -2.339
 1176   1HB   HIS 153           HB2      HIS 153  13.168  -7.546  -1.761
 1177   2HB   HIS 153           HB1      HIS 153  13.829  -8.881  -2.703
 1178    HD1  HIS 153           HD1      HIS 153  14.655 -11.011  -1.192
 1179    HD2  HIS 153           HD2      HIS 153  12.024  -8.344   0.635
 1180    HE1  HIS 153           HE1      HIS 153  13.685 -12.221   0.809
 1181    H    THR 154           HN       THR 154  14.476  -5.453  -1.189
 1182    HA   THR 154           HA       THR 154  14.952  -5.462   1.757
 1183    HB   THR 154           HB       THR 154  15.641  -3.136  -0.058
 1184    HG1  THR 154           HG1      THR 154  16.926  -5.272  -0.059
 1185   1HG2  THR 154          HG22      THR 154  15.782  -3.713   2.873
 1186   2HG2  THR 154          HG21      THR 154  17.043  -2.707   2.159
 1187   3HG2  THR 154          HG23      THR 154  15.353  -2.216   2.045
 1188    H    TYR 155           HN       TYR 155  13.301  -4.521   2.901
 1189    HA   TYR 155           HA       TYR 155  10.968  -3.554   1.363
 1190   1HB   TYR 155           HB2      TYR 155  11.349  -4.126   4.317
 1191   2HB   TYR 155           HB1      TYR 155   9.827  -3.616   3.586
 1192    HD1  TYR 155           HD2      TYR 155   8.648  -5.085   1.974
 1193    HD2  TYR 155           HD1      TYR 155  12.199  -6.368   4.022
 1194    HE1  TYR 155           HE2      TYR 155   8.157  -7.435   1.352
 1195    HE2  TYR 155           HE1      TYR 155  11.708  -8.718   3.401
 1196    HH   TYR 155           HH       TYR 155   8.843  -9.812   2.472
 1197    H    GLU 156           HN       GLU 156  11.591  -1.464   0.705
 1198    HA   GLU 156           HA       GLU 156  12.708   0.462   2.586
 1199   1HB   GLU 156           HB2      GLU 156  11.627   0.666  -0.231
 1200   2HB   GLU 156           HB1      GLU 156  12.161   2.085   0.672
 1201   1HG   GLU 156           HG2      GLU 156  14.360   0.877   1.060
 1202   2HG   GLU 156           HG1      GLU 156  13.812  -0.330  -0.105
 1203    H    VAL 157           HN       VAL 157  11.603   2.001   3.761
 1204    HA   VAL 157           HA       VAL 157   8.630   2.084   3.434
 1205    HB   VAL 157           HB       VAL 157  10.161   2.339   6.040
 1206   1HG1  VAL 157          HG12      VAL 157   7.206   2.081   5.399
 1207   2HG1  VAL 157          HG11      VAL 157   7.893   2.095   7.024
 1208   3HG1  VAL 157          HG13      VAL 157   8.014   3.527   6.003
 1209   1HG2  VAL 157          HG21      VAL 157   8.914   0.005   4.625
 1210   2HG2  VAL 157          HG23      VAL 157  10.396   0.068   5.581
 1211   3HG2  VAL 157          HG22      VAL 157   8.827   0.076   6.385
 1212    H    TRP 158           HN       TRP 158   8.084   4.074   2.704
 1213    HA   TRP 158           HA       TRP 158   9.714   6.412   3.617
 1214   1HB   TRP 158           HB2      TRP 158   8.059   6.039   1.102
 1215   2HB   TRP 158           HB1      TRP 158   8.853   7.545   1.560
 1216    HD1  TRP 158           HD1      TRP 158   9.909   3.832   1.176
 1217    HE1  TRP 158           HE1      TRP 158  12.237   3.778   0.070
 1218    HE3  TRP 158           HE3      TRP 158  10.780   8.842   0.711
 1219    HZ2  TRP 158           HZ2      TRP 158  14.208   5.618  -0.886
 1220    HZ3  TRP 158           HZ3      TRP 158  12.888   9.664  -0.299
 1221    HH2  TRP 158           HH2      TRP 158  14.602   8.060  -1.097
 1222    H    GLN 159           HN       GLN 159   8.344   8.494   3.659
 1223    HA   GLN 159           HA       GLN 159   5.500   8.047   4.340
 1224   1HB   GLN 159           HB2      GLN 159   7.588   9.045   6.289
 1225   2HB   GLN 159           HB1      GLN 159   5.868   9.373   6.500
 1226   1HG   GLN 159           HG2      GLN 159   5.542   6.825   6.227
 1227   2HG   GLN 159           HG1      GLN 159   7.279   6.707   6.511
 1228   1HE2  GLN 159          HE22      GLN 159   6.679   6.739   9.977
 1229   2HE2  GLN 159          HE21      GLN 159   7.460   6.008   8.661
 1230    H    LYS 160           HN       LYS 160   4.259   9.877   3.946
 1231    HA   LYS 160           HA       LYS 160   5.460  11.991   2.370
 1232   1HB   LYS 160           HB2      LYS 160   3.077  11.096   2.156
 1233   2HB   LYS 160           HB1      LYS 160   2.699  12.020   3.610
 1234   1HG   LYS 160           HG2      LYS 160   3.224  14.092   2.550
 1235   2HG   LYS 160           HG1      LYS 160   3.992  13.280   1.184
 1236   1HD   LYS 160           HD2      LYS 160   1.666  12.187   0.805
 1237   2HD   LYS 160           HD1      LYS 160   1.058  13.474   1.847
 1238   1HE   LYS 160           HE2      LYS 160   2.820  14.057  -0.536
 1239   2HE   LYS 160           HE1      LYS 160   1.066  13.948  -0.679
 1240   1HZ   LYS 160           HZ2      LYS 160   2.518  15.752   1.181
 1241   2HZ   LYS 160           HZ1      LYS 160   1.824  16.225  -0.297
 1242   3HZ   LYS 160           HZ3      LYS 160   0.835  15.676   0.967
 1243    H    LYS 161           HN       LYS 161   6.603  13.629   3.262
 1244    HA   LYS 161           HA       LYS 161   5.509  15.159   5.500
 1245   1HB   LYS 161           HB2      LYS 161   6.771  13.159   6.518
 1246   2HB   LYS 161           HB1      LYS 161   8.238  13.924   5.904
 1247   1HG   LYS 161           HG2      LYS 161   7.571  16.020   7.127
 1248   2HG   LYS 161           HG1      LYS 161   6.248  15.110   7.858
 1249   1HD   LYS 161           HD2      LYS 161   8.104  13.419   8.555
 1250   2HD   LYS 161           HD1      LYS 161   9.214  14.753   8.239
 1251   1HE   LYS 161           HE2      LYS 161   8.198  16.130   9.893
 1252   2HE   LYS 161           HE1      LYS 161   6.788  15.077  10.012
 1253   1HZ   LYS 161           HZ1      LYS 161   9.483  14.053  10.628
 1254   2HZ   LYS 161           HZ3      LYS 161   8.604  14.911  11.796
 1255   3HZ   LYS 161           HZ2      LYS 161   7.974  13.472  11.149
 1256    H    ALA 162           HN       ALA 162   5.685  17.062   4.359
 1257    HA   ALA 162           HA       ALA 162   7.967  17.695   2.682
 1258   1HB   ALA 162           HB3      ALA 162   5.596  18.621   2.446
 1259   2HB   ALA 162           HB2      ALA 162   5.968  19.664   3.819
 1260   3HB   ALA 162           HB1      ALA 162   6.898  19.806   2.327
 1261   1H9   TMQ 170           H91      TMQ 170   0.044 -10.546  -6.333
 1262   2H9   TMQ 170           H92      TMQ 170  -0.821 -11.365  -5.024
 1263    HN1  TMQ 170           H1N      TMQ 170   1.305 -12.484  -6.667
 1264   1H17  TMQ 170           HM1      TMQ 170  -0.183  -7.523  -5.092
 1265   2H17  TMQ 170           HM2      TMQ 170  -1.183  -8.175  -3.787
 1266   3H17  TMQ 170           HM3      TMQ 170  -0.984  -9.081  -5.286
 1267   1H21  TMQ 170          HW11      TMQ 170  -2.195 -13.291  -2.288
 1268   2H21  TMQ 170          HW12      TMQ 170  -0.749 -12.913  -1.339
 1269   3H21  TMQ 170          HW13      TMQ 170  -2.093 -13.789  -0.592
 1270   1H22  TMQ 170           HI1      TMQ 170   0.689 -16.852  -1.765
 1271   2H22  TMQ 170           HI2      TMQ 170   0.273 -18.561  -1.972
 1272   3H22  TMQ 170           HI3      TMQ 170   1.387 -17.777  -3.104
 1273   1H23  TMQ 170          HW21      TMQ 170   0.887 -16.704  -7.819
 1274   2H23  TMQ 170          HW22      TMQ 170   1.475 -18.319  -7.390
 1275   3H23  TMQ 170          HW23      TMQ 170   2.228 -16.884  -6.677
 1276   1HN2  TMQ 170          HN21      TMQ 170   5.053  -7.493   0.131
 1277   2HN2  TMQ 170          HN22      TMQ 170   4.153  -6.014   0.180
 1278   1HN5  TMQ 170          HN41      TMQ 170  -0.211  -6.485  -3.397
 1279   2HN5  TMQ 170          HN42      TMQ 170   0.461  -5.347  -2.314
 1280    HN   TMQ 170           H1       TMQ 170   4.373  -9.192  -1.238
 1281    H7   TMQ 170           H7       TMQ 170   2.369 -12.154  -4.250
 1282    H8   TMQ 170           H8       TMQ 170   3.851 -11.114  -2.596
 1283    H12  TMQ 170           HP2      TMQ 170  -0.230 -12.681  -3.393
 1284    H16  TMQ 170           HP6      TMQ 170   0.910 -14.863  -6.944
   
  No H/Q in entry =        1284
  Start of MODEL    7
    1   1H    THR   1           HT3      THR   1  -2.643   5.982   4.710
    2   2H    THR   1           HT2      THR   1  -2.993   6.728   3.225
    3   3H    THR   1           HT1      THR   1  -4.255   6.253   4.259
    4    HA   THR   1           HA       THR   1  -4.045   4.038   3.767
    5    HB   THR   1           HB       THR   1  -3.001   5.321   1.230
    6    HG1  THR   1           HG1      THR   1  -4.737   6.516   2.065
    7   1HG2  THR   1          HG21      THR   1  -3.190   2.853   1.248
    8   2HG2  THR   1          HG23      THR   1  -4.880   2.995   1.730
    9   3HG2  THR   1          HG22      THR   1  -4.362   3.584   0.151
   10    H    ALA   2           HN       ALA   2  -2.700   2.214   3.102
   11    HA   ALA   2           HA       ALA   2   0.222   2.780   3.416
   12   1HB   ALA   2           HB1      ALA   2  -1.466   0.430   4.299
   13   2HB   ALA   2           HB3      ALA   2   0.294   0.348   4.218
   14   3HB   ALA   2           HB2      ALA   2  -0.487   1.500   5.302
   15    H    PHE   3           HN       PHE   3   0.865   2.855   1.268
   16    HA   PHE   3           HA       PHE   3  -0.146   0.987  -0.724
   17   1HB   PHE   3           HB2      PHE   3   1.943   3.140  -0.661
   18   2HB   PHE   3           HB1      PHE   3   1.952   1.978  -1.986
   19    HD1  PHE   3           HD1      PHE   3  -0.778   3.696  -0.056
   20    HD2  PHE   3           HD2      PHE   3   0.966   2.867  -3.893
   21    HE1  PHE   3           HE1      PHE   3  -2.623   4.930  -1.162
   22    HE2  PHE   3           HE2      PHE   3  -0.879   4.100  -4.998
   23    HZ   PHE   3           HZ       PHE   3  -2.674   5.132  -3.633
   24    H    LEU   4           HN       LEU   4   0.679  -0.993  -1.221
   25    HA   LEU   4           HA       LEU   4   3.453  -1.678  -0.440
   26   1HB   LEU   4           HB2      LEU   4   1.990  -2.298   1.496
   27   2HB   LEU   4           HB1      LEU   4   1.070  -3.348   0.420
   28    HG   LEU   4           HG       LEU   4   3.349  -4.435  -0.147
   29   1HD1  LEU   4          HD11      LEU   4   3.996  -2.810   2.317
   30   2HD1  LEU   4          HD13      LEU   4   4.896  -4.272   1.907
   31   3HD1  LEU   4          HD12      LEU   4   4.891  -2.899   0.800
   32   1HD2  LEU   4          HD23      LEU   4   1.876  -4.682   2.475
   33   2HD2  LEU   4          HD22      LEU   4   1.811  -5.749   1.071
   34   3HD2  LEU   4          HD21      LEU   4   3.242  -5.733   2.102
   35    H    TRP   5           HN       TRP   5   4.264  -2.411  -2.348
   36    HA   TRP   5           HA       TRP   5   2.735  -4.489  -3.811
   37   1HB   TRP   5           HB2      TRP   5   3.100  -3.377  -5.972
   38   2HB   TRP   5           HB1      TRP   5   2.167  -2.338  -4.899
   39    HD1  TRP   5           HD1      TRP   5   5.161  -2.347  -7.032
   40    HE1  TRP   5           HE1      TRP   5   6.592  -0.242  -6.622
   41    HE3  TRP   5           HE3      TRP   5   2.997  -0.622  -2.735
   42    HZ2  TRP   5           HZ2      TRP   5   6.794   1.887  -4.728
   43    HZ3  TRP   5           HZ3      TRP   5   3.833   1.442  -1.651
   44    HH2  TRP   5           HH2      TRP   5   5.725   2.699  -2.642
   45    H    ALA   6           HN       ALA   6   4.072  -5.937  -4.966
   46    HA   ALA   6           HA       ALA   6   6.946  -5.802  -4.215
   47   1HB   ALA   6           HB2      ALA   6   5.539  -7.873  -3.761
   48   2HB   ALA   6           HB1      ALA   6   5.470  -8.110  -5.507
   49   3HB   ALA   6           HB3      ALA   6   7.022  -8.160  -4.671
   50    H    GLN   7           HN       GLN   7   8.233  -4.859  -5.721
   51    HA   GLN   7           HA       GLN   7   7.763  -5.539  -8.590
   52   1HB   GLN   7           HB2      GLN   7   8.418  -3.187  -9.163
   53   2HB   GLN   7           HB1      GLN   7   6.895  -3.289  -8.280
   54   1HG   GLN   7           HG2      GLN   7   7.848  -2.501  -6.285
   55   2HG   GLN   7           HG1      GLN   7   9.485  -2.917  -6.793
   56   1HE2  GLN   7          HE22      GLN   7   9.593  -0.038  -9.097
   57   2HE2  GLN   7          HE21      GLN   7   9.894  -1.707  -9.166
   58    H    ASP   8           HN       ASP   8   9.686  -5.620  -9.859
   59    HA   ASP   8           HA       ASP   8  12.158  -5.958  -8.239
   60   1HB   ASP   8           HB2      ASP   8  13.027  -7.052 -10.350
   61   2HB   ASP   8           HB1      ASP   8  11.651  -7.871  -9.615
   62    H    ARG   9           HN       ARG   9  14.227  -5.276  -9.488
   63    HA   ARG   9           HA       ARG   9  14.186  -2.452  -9.877
   64   1HB   ARG   9           HB2      ARG   9  16.492  -2.784 -10.802
   65   2HB   ARG   9           HB1      ARG   9  16.241  -3.590  -9.253
   66   1HG   ARG   9           HG2      ARG   9  15.948  -5.725 -10.317
   67   2HG   ARG   9           HG1      ARG   9  15.890  -4.984 -11.917
   68   1HD   ARG   9           HD2      ARG   9  18.101  -5.917 -11.619
   69   2HD   ARG   9           HD1      ARG   9  18.241  -4.160 -11.537
   70    HE   ARG   9           HE       ARG   9  17.907  -4.895  -8.895
   71   1HH1  ARG   9          HH21      ARG   9  20.047  -5.861 -11.455
   72   2HH1  ARG   9          HH22      ARG   9  21.350  -6.250 -10.381
   73   1HH2  ARG   9          HH11      ARG   9  19.602  -5.403  -7.511
   74   2HH2  ARG   9          HH12      ARG   9  21.098  -5.990  -8.159
   75    H    ASP  10           HN       ASP  10  13.442  -5.051 -12.031
   76    HA   ASP  10           HA       ASP  10  13.957  -3.577 -14.496
   77   1HB   ASP  10           HB2      ASP  10  12.518  -6.148 -13.835
   78   2HB   ASP  10           HB1      ASP  10  12.494  -5.471 -15.465
   79    H    GLY  11           HN       GLY  11  11.967  -2.679 -12.226
   80   1HA   GLY  11           HA2      GLY  11   9.986  -1.423 -12.173
   81   2HA   GLY  11           HA1      GLY  11  10.179  -1.228 -13.915
   82    H    LEU  12           HN       LEU  12   9.810  -4.288 -12.162
   83    HA   LEU  12           HA       LEU  12   7.349  -4.798 -13.775
   84   1HB   LEU  12           HB2      LEU  12   9.533  -6.336 -13.692
   85   2HB   LEU  12           HB1      LEU  12   8.724  -6.976 -12.261
   86    HG   LEU  12           HG       LEU  12   6.626  -7.160 -13.744
   87   1HD1  LEU  12          HD13      LEU  12   7.743  -5.704 -15.546
   88   2HD1  LEU  12          HD12      LEU  12   8.677  -7.141 -15.965
   89   3HD1  LEU  12          HD11      LEU  12   6.918  -7.161 -16.106
   90   1HD2  LEU  12          HD22      LEU  12   8.415  -8.983 -13.036
   91   2HD2  LEU  12          HD21      LEU  12   7.178  -9.368 -14.234
   92   3HD2  LEU  12          HD23      LEU  12   8.811  -8.952 -14.755
   93    H    ILE  13           HN       ILE  13   5.674  -6.165 -12.614
   94    HA   ILE  13           HA       ILE  13   5.645  -5.815  -9.670
   95    HB   ILE  13           HB       ILE  13   3.329  -4.857  -9.792
   96   1HG1  ILE  13          HG12      ILE  13   3.998  -4.421 -12.718
   97   2HG1  ILE  13          HG11      ILE  13   2.921  -5.694 -12.144
   98   1HG2  ILE  13          HG22      ILE  13   5.520  -3.278 -11.177
   99   2HG2  ILE  13          HG21      ILE  13   4.069  -2.580 -10.456
  100   3HG2  ILE  13          HG23      ILE  13   5.262  -3.385  -9.436
  101   1HD1  ILE  13          HD11      ILE  13   2.459  -2.840 -11.315
  102   2HD1  ILE  13          HD13      ILE  13   1.882  -3.413 -12.880
  103   3HD1  ILE  13          HD12      ILE  13   1.304  -4.171 -11.395
  104    H    GLY  14           HN       GLY  14   4.356  -7.261 -12.595
  105   1HA   GLY  14           HA2      GLY  14   3.633  -9.675 -11.082
  106   2HA   GLY  14           HA1      GLY  14   2.275  -8.854 -11.855
  107    H    LYS  15           HN       LYS  15   2.422 -11.190 -12.890
  108    HA   LYS  15           HA       LYS  15   3.204 -10.851 -15.628
  109   1HB   LYS  15           HB2      LYS  15   5.465 -11.186 -14.517
  110   2HB   LYS  15           HB1      LYS  15   4.932 -12.814 -14.102
  111   1HG   LYS  15           HG2      LYS  15   4.435 -13.163 -16.568
  112   2HG   LYS  15           HG1      LYS  15   5.268 -11.638 -16.870
  113   1HD   LYS  15           HD2      LYS  15   7.338 -12.479 -16.093
  114   2HD   LYS  15           HD1      LYS  15   6.574 -13.847 -15.281
  115   1HE   LYS  15           HE2      LYS  15   7.485 -14.796 -17.244
  116   2HE   LYS  15           HE1      LYS  15   5.785 -14.552 -17.644
  117   1HZ   LYS  15           HZ3      LYS  15   6.408 -12.423 -18.665
  118   2HZ   LYS  15           HZ2      LYS  15   8.045 -12.763 -18.358
  119   3HZ   LYS  15           HZ1      LYS  15   7.155 -13.744 -19.423
  120    H    ASP  16           HN       ASP  16   1.553 -11.957 -16.543
  121    HA   ASP  16           HA       ASP  16   0.007 -13.662 -16.990
  122   1HB   ASP  16           HB2      ASP  16   2.396 -15.065 -15.902
  123   2HB   ASP  16           HB1      ASP  16   0.891 -15.986 -15.937
  124    H    GLY  17           HN       GLY  17  -0.309 -12.063 -14.584
  125   1HA   GLY  17           HA2      GLY  17  -1.988 -12.078 -12.904
  126   2HA   GLY  17           HA1      GLY  17  -2.198 -13.810 -13.167
  127    H    HIS  18           HN       HIS  18   0.076 -14.998 -12.620
  128    HA   HIS  18           HA       HIS  18   0.454 -14.560  -9.760
  129   1HB   HIS  18           HB2      HIS  18   2.061 -16.478  -9.969
  130   2HB   HIS  18           HB1      HIS  18   0.454 -16.842 -10.597
  131    HD1  HIS  18           HD1      HIS  18   3.958 -16.021 -11.749
  132    HD2  HIS  18           HD2      HIS  18   0.349 -17.336 -13.369
  133    HE1  HIS  18           HE1      HIS  18   4.453 -16.711 -14.135
  134    H    LEU  19           HN       LEU  19   2.909 -14.679  -9.008
  135    HA   LEU  19           HA       LEU  19   4.168 -12.251 -10.016
  136   1HB   LEU  19           HB2      LEU  19   4.799 -14.249  -7.857
  137   2HB   LEU  19           HB1      LEU  19   6.021 -13.079  -8.355
  138    HG   LEU  19           HG       LEU  19   3.236 -12.139  -7.735
  139   1HD1  LEU  19          HD11      LEU  19   5.401 -12.900  -5.769
  140   2HD1  LEU  19          HD13      LEU  19   4.169 -11.701  -5.377
  141   3HD1  LEU  19          HD12      LEU  19   3.697 -13.360  -5.748
  142   1HD2  LEU  19          HD22      LEU  19   6.023 -10.954  -7.552
  143   2HD2  LEU  19          HD21      LEU  19   4.773 -10.539  -8.724
  144   3HD2  LEU  19          HD23      LEU  19   4.560 -10.120  -7.024
  145    HA   PRO  20           HA       PRO  20   7.011 -14.144 -12.872
  146   1HB   PRO  20           HB2      PRO  20   9.060 -12.255 -12.685
  147   2HB   PRO  20           HB1      PRO  20   7.629 -12.127 -13.717
  148   1HG   PRO  20           HG2      PRO  20   8.302 -10.562 -11.408
  149   2HG   PRO  20           HG1      PRO  20   6.907 -10.396 -12.483
  150   1HD   PRO  20           HD2      PRO  20   7.035 -11.576  -9.818
  151   2HD   PRO  20           HD1      PRO  20   5.615 -11.136 -10.781
  152    H    TRP  21           HN       TRP  21   8.266 -13.165  -9.713
  153    HA   TRP  21           HA       TRP  21  10.424 -15.216  -9.973
  154   1HB   TRP  21           HB2      TRP  21  11.448 -14.037  -8.009
  155   2HB   TRP  21           HB1      TRP  21  11.291 -13.009  -9.432
  156    HD1  TRP  21           HD1      TRP  21   9.522 -13.732  -6.088
  157    HE1  TRP  21           HE1      TRP  21   8.232 -11.615  -5.378
  158    HE3  TRP  21           HE3      TRP  21  10.318 -10.796 -10.190
  159    HZ2  TRP  21           HZ2      TRP  21   7.619  -9.020  -6.414
  160    HZ3  TRP  21           HZ3      TRP  21   9.372  -8.508 -10.301
  161    HH2  TRP  21           HH2      TRP  21   8.025  -7.617  -8.421
  162    H    HIS  22           HN       HIS  22  10.936 -15.803  -7.365
  163    HA   HIS  22           HA       HIS  22   8.341 -16.669  -6.179
  164   1HB   HIS  22           HB2      HIS  22   9.489 -18.494  -7.588
  165   2HB   HIS  22           HB1      HIS  22  10.729 -18.514  -6.334
  166    HD1  HIS  22           HD1      HIS  22   6.901 -18.520  -6.335
  167    HD2  HIS  22           HD2      HIS  22  10.098 -20.414  -4.447
  168    HE1  HIS  22           HE1      HIS  22   5.891 -20.173  -4.702
  169    H    LEU  23           HN       LEU  23   8.719 -15.010  -4.587
  170    HA   LEU  23           HA       LEU  23  11.048 -15.515  -2.783
  171   1HB   LEU  23           HB2      LEU  23  10.776 -13.213  -3.822
  172   2HB   LEU  23           HB1      LEU  23   9.301 -13.041  -2.871
  173    HG   LEU  23           HG       LEU  23  10.639 -13.490  -0.805
  174   1HD1  LEU  23          HD12      LEU  23  12.840 -13.592  -2.859
  175   2HD1  LEU  23          HD11      LEU  23  13.186 -13.102  -1.201
  176   3HD1  LEU  23          HD13      LEU  23  12.520 -14.702  -1.527
  177   1HD2  LEU  23          HD22      LEU  23  10.308 -11.151  -2.132
  178   2HD2  LEU  23          HD21      LEU  23  11.161 -11.265  -0.593
  179   3HD2  LEU  23          HD23      LEU  23  12.070 -11.227  -2.103
  180    HA   PRO  24           HA       PRO  24   7.409 -17.519  -0.635
  181   1HB   PRO  24           HB2      PRO  24   9.509 -18.527   1.122
  182   2HB   PRO  24           HB1      PRO  24   8.373 -19.427   0.109
  183   1HG   PRO  24           HG2      PRO  24  11.144 -18.915  -0.369
  184   2HG   PRO  24           HG1      PRO  24  10.009 -19.829  -1.371
  185   1HD   PRO  24           HD2      PRO  24  11.167 -17.350  -2.009
  186   2HD   PRO  24           HD1      PRO  24   9.812 -18.124  -2.845
  187    H    ASP  25           HN       ASP  25  10.231 -15.822   0.707
  188    HA   ASP  25           HA       ASP  25   9.142 -15.288   3.295
  189   1HB   ASP  25           HB2      ASP  25  11.560 -14.893   2.239
  190   2HB   ASP  25           HB1      ASP  25  10.916 -13.271   1.984
  191    H    ASP  26           HN       ASP  26   8.949 -13.505   0.227
  192    HA   ASP  26           HA       ASP  26   7.581 -11.210   1.284
  193   1HB   ASP  26           HB2      ASP  26   8.704 -11.300  -0.954
  194   2HB   ASP  26           HB1      ASP  26   7.407 -12.352  -1.520
  195    H    LEU  27           HN       LEU  27   6.491 -14.360   0.136
  196    HA   LEU  27           HA       LEU  27   3.680 -13.701   0.041
  197   1HB   LEU  27           HB2      LEU  27   5.068 -16.378   0.380
  198   2HB   LEU  27           HB1      LEU  27   3.354 -16.165   0.020
  199    HG   LEU  27           HG       LEU  27   5.600 -15.091  -1.710
  200   1HD1  LEU  27          HD12      LEU  27   4.170 -17.706  -1.641
  201   2HD1  LEU  27          HD11      LEU  27   4.445 -16.986  -3.227
  202   3HD1  LEU  27          HD13      LEU  27   5.811 -17.336  -2.168
  203   1HD2  LEU  27          HD22      LEU  27   2.590 -15.152  -1.892
  204   2HD2  LEU  27          HD21      LEU  27   3.682 -13.787  -2.129
  205   3HD2  LEU  27          HD23      LEU  27   3.577 -15.054  -3.351
  206    H    HIS  28           HN       HIS  28   5.890 -14.563   2.589
  207    HA   HIS  28           HA       HIS  28   3.765 -15.271   4.491
  208   1HB   HIS  28           HB2      HIS  28   6.760 -14.940   4.695
  209   2HB   HIS  28           HB1      HIS  28   5.759 -15.168   6.128
  210    HD1  HIS  28           HD1      HIS  28   3.859 -17.294   5.524
  211    HD2  HIS  28           HD2      HIS  28   7.701 -17.405   3.912
  212    HE1  HIS  28           HE1      HIS  28   4.302 -19.707   4.894
  213    H    TYR  29           HN       TYR  29   5.667 -12.457   3.612
  214    HA   TYR  29           HA       TYR  29   4.963 -10.901   5.966
  215   1HB   TYR  29           HB2      TYR  29   6.962 -10.542   4.367
  216   2HB   TYR  29           HB1      TYR  29   5.798  -9.755   3.302
  217    HD1  TYR  29           HD2      TYR  29   6.527  -9.784   6.991
  218    HD2  TYR  29           HD1      TYR  29   5.746  -7.441   3.476
  219    HE1  TYR  29           HE2      TYR  29   6.695  -7.708   8.338
  220    HE2  TYR  29           HE1      TYR  29   5.915  -5.365   4.823
  221    HH   TYR  29           HH       TYR  29   5.725  -4.644   7.118
  222    H    PHE  30           HN       PHE  30   3.493 -11.565   2.876
  223    HA   PHE  30           HA       PHE  30   1.725  -9.305   2.753
  224   1HB   PHE  30           HB2      PHE  30   2.226 -10.917   0.865
  225   2HB   PHE  30           HB1      PHE  30   1.184 -12.085   1.677
  226    HD1  PHE  30           HD1      PHE  30   1.180  -8.523   0.500
  227    HD2  PHE  30           HD2      PHE  30  -1.104 -12.094   1.200
  228    HE1  PHE  30           HE1      PHE  30  -0.814  -7.446  -0.506
  229    HE2  PHE  30           HE2      PHE  30  -3.098 -11.016   0.195
  230    HZ   PHE  30           HZ       PHE  30  -2.953  -8.692  -0.659
  231    H    ARG  31           HN       ARG  31   1.314 -12.596   4.073
  232    HA   ARG  31           HA       ARG  31  -1.389 -12.217   4.957
  233   1HB   ARG  31           HB2      ARG  31  -0.066 -14.420   4.721
  234   2HB   ARG  31           HB1      ARG  31   0.609 -14.038   6.307
  235   1HG   ARG  31           HG2      ARG  31  -1.497 -14.153   7.365
  236   2HG   ARG  31           HG1      ARG  31  -2.369 -14.003   5.840
  237   1HD   ARG  31           HD2      ARG  31  -0.596 -16.364   6.509
  238   2HD   ARG  31           HD1      ARG  31  -2.334 -16.343   6.811
  239    HE   ARG  31           HE       ARG  31  -2.082 -15.633   4.129
  240   1HH1  ARG  31          HH21      ARG  31  -1.079 -18.288   6.132
  241   2HH1  ARG  31          HH22      ARG  31  -1.143 -19.441   4.842
  242   1HH2  ARG  31          HH11      ARG  31  -2.160 -17.138   2.462
  243   2HH2  ARG  31          HH12      ARG  31  -1.752 -18.792   2.774
  244    H    ALA  32           HN       ALA  32   1.734 -11.440   6.372
  245    HA   ALA  32           HA       ALA  32   0.672 -10.875   9.025
  246   1HB   ALA  32           HB1      ALA  32   3.300 -10.326   7.644
  247   2HB   ALA  32           HB3      ALA  32   2.954  -9.686   9.251
  248   3HB   ALA  32           HB2      ALA  32   2.975 -11.428   8.981
  249    H    GLN  33           HN       GLN  33   1.230  -9.054   6.070
  250    HA   GLN  33           HA       GLN  33   0.491  -6.520   7.438
  251   1HB   GLN  33           HB2      GLN  33   1.647  -7.180   4.729
  252   2HB   GLN  33           HB1      GLN  33   0.973  -5.587   5.073
  253   1HG   GLN  33           HG2      GLN  33   2.994  -6.825   6.932
  254   2HG   GLN  33           HG1      GLN  33   3.517  -5.964   5.483
  255   1HE2  GLN  33          HE22      GLN  33   1.773  -3.854   8.545
  256   2HE2  GLN  33          HE21      GLN  33   1.570  -5.538   8.470
  257    H    THR  34           HN       THR  34  -1.468  -8.671   7.025
  258    HA   THR  34           HA       THR  34  -3.447  -7.100   5.451
  259    HB   THR  34           HB       THR  34  -4.317  -9.329   4.553
  260    HG1  THR  34           HG1      THR  34  -1.731 -10.299   4.909
  261   1HG2  THR  34          HG22      THR  34  -1.644  -8.176   3.749
  262   2HG2  THR  34          HG21      THR  34  -2.429  -9.453   2.820
  263   3HG2  THR  34          HG23      THR  34  -3.220  -7.889   3.012
  264    H    VAL  35           HN       VAL  35  -2.762  -9.585   7.862
  265    HA   VAL  35           HA       VAL  35  -5.501  -9.949   8.707
  266    HB   VAL  35           HB       VAL  35  -4.453 -10.975  10.742
  267   1HG1  VAL  35          HG12      VAL  35  -3.422 -11.754   8.003
  268   2HG1  VAL  35          HG11      VAL  35  -3.189 -12.754   9.437
  269   3HG1  VAL  35          HG13      VAL  35  -4.819 -12.415   8.854
  270   1HG2  VAL  35          HG22      VAL  35  -1.937  -9.977   9.376
  271   2HG2  VAL  35          HG21      VAL  35  -2.498  -9.586  11.002
  272   3HG2  VAL  35          HG23      VAL  35  -1.929 -11.214  10.632
  273    H    GLY  36           HN       GLY  36  -6.710  -8.628   9.976
  274   1HA   GLY  36           HA2      GLY  36  -7.191  -7.065  11.699
  275   2HA   GLY  36           HA1      GLY  36  -5.459  -6.887  11.984
  276    H    LYS  37           HN       LYS  37  -6.932  -6.578   8.804
  277    HA   LYS  37           HA       LYS  37  -6.932  -3.644   8.904
  278   1HB   LYS  37           HB2      LYS  37  -4.853  -5.223   7.392
  279   2HB   LYS  37           HB1      LYS  37  -5.342  -3.614   6.859
  280   1HG   LYS  37           HG2      LYS  37  -4.902  -2.903   9.318
  281   2HG   LYS  37           HG1      LYS  37  -3.995  -4.411   9.434
  282   1HD   LYS  37           HD2      LYS  37  -2.690  -3.693   7.401
  283   2HD   LYS  37           HD1      LYS  37  -3.496  -2.127   7.508
  284   1HE   LYS  37           HE2      LYS  37  -2.504  -1.636   9.608
  285   2HE   LYS  37           HE1      LYS  37  -2.016  -3.313   9.858
  286   1HZ   LYS  37           HZ1      LYS  37  -0.907  -2.453   7.449
  287   2HZ   LYS  37           HZ3      LYS  37  -0.590  -1.248   8.599
  288   3HZ   LYS  37           HZ2      LYS  37  -0.098  -2.848   8.891
  289    H    ILE  38           HN       ILE  38  -7.473  -2.799   6.593
  290    HA   ILE  38           HA       ILE  38  -9.656  -4.500   5.552
  291    HB   ILE  38           HB       ILE  38  -8.862  -1.688   4.739
  292   1HG1  ILE  38          HG12      ILE  38 -11.016  -2.558   6.689
  293   2HG1  ILE  38          HG11      ILE  38  -9.435  -1.953   7.184
  294   1HG2  ILE  38          HG23      ILE  38 -10.295  -2.966   3.142
  295   2HG2  ILE  38          HG22      ILE  38 -11.470  -3.208   4.435
  296   3HG2  ILE  38          HG21      ILE  38 -11.133  -1.581   3.845
  297   1HD1  ILE  38          HD11      ILE  38  -9.999   0.070   5.628
  298   2HD1  ILE  38          HD13      ILE  38 -11.665  -0.488   5.792
  299   3HD1  ILE  38          HD12      ILE  38 -10.750  -0.012   7.222
  300    H    MET  39           HN       MET  39  -9.093  -5.938   3.994
  301    HA   MET  39           HA       MET  39  -6.746  -5.501   2.293
  302   1HB   MET  39           HB2      MET  39  -7.825  -7.757   3.238
  303   2HB   MET  39           HB1      MET  39  -8.719  -7.671   1.720
  304   1HG   MET  39           HG2      MET  39  -5.756  -7.231   1.673
  305   2HG   MET  39           HG1      MET  39  -6.369  -8.878   1.812
  306   1HE   MET  39           HE2      MET  39  -7.874  -9.954   0.514
  307   2HE   MET  39           HE1      MET  39  -9.124  -8.887  -0.121
  308   3HE   MET  39           HE3      MET  39  -8.081  -9.792  -1.228
  309    H    VAL  40           HN       VAL  40  -7.038  -3.934   0.753
  310    HA   VAL  40           HA       VAL  40  -9.541  -4.050  -0.883
  311    HB   VAL  40           HB       VAL  40  -7.635  -1.714  -0.552
  312   1HG1  VAL  40          HG12      VAL  40 -10.419  -1.940  -1.739
  313   2HG1  VAL  40          HG11      VAL  40  -9.499  -0.444  -1.569
  314   3HG1  VAL  40          HG13      VAL  40  -8.926  -1.714  -2.650
  315   1HG2  VAL  40          HG21      VAL  40 -10.223  -2.430   0.845
  316   2HG2  VAL  40          HG23      VAL  40  -8.666  -2.047   1.581
  317   3HG2  VAL  40          HG22      VAL  40  -9.603  -0.779   0.791
  318    H    VAL  41           HN       VAL  41  -9.263  -4.785  -2.925
  319    HA   VAL  41           HA       VAL  41  -6.655  -4.301  -4.284
  320    HB   VAL  41           HB       VAL  41  -6.772  -6.635  -5.204
  321   1HG1  VAL  41          HG12      VAL  41  -6.488  -6.119  -2.248
  322   2HG1  VAL  41          HG11      VAL  41  -6.214  -7.727  -2.917
  323   3HG1  VAL  41          HG13      VAL  41  -5.221  -6.371  -3.448
  324   1HG2  VAL  41          HG21      VAL  41  -9.310  -6.729  -4.535
  325   2HG2  VAL  41          HG23      VAL  41  -8.337  -8.196  -4.424
  326   3HG2  VAL  41          HG22      VAL  41  -8.691  -7.260  -2.972
  327    H    GLY  42           HN       GLY  42  -7.066  -5.292  -6.712
  328   1HA   GLY  42           HA2      GLY  42  -9.451  -3.802  -7.674
  329   2HA   GLY  42           HA1      GLY  42  -8.069  -4.271  -8.664
  330    H    ARG  43           HN       ARG  43  -9.845  -5.095 -10.116
  331    HA   ARG  43           HA       ARG  43 -11.282  -7.495  -9.227
  332   1HB   ARG  43           HB2      ARG  43 -11.075  -6.039 -11.872
  333   2HB   ARG  43           HB1      ARG  43 -11.967  -7.550 -11.691
  334   1HG   ARG  43           HG2      ARG  43 -13.195  -6.402  -9.746
  335   2HG   ARG  43           HG1      ARG  43 -12.511  -4.895 -10.358
  336   1HD   ARG  43           HD2      ARG  43 -14.050  -6.799 -12.131
  337   2HD   ARG  43           HD1      ARG  43 -14.842  -5.508 -11.225
  338    HE   ARG  43           HE       ARG  43 -12.935  -4.094 -12.512
  339   1HH1  ARG  43          HH11      ARG  43 -15.031  -6.628 -13.633
  340   2HH1  ARG  43          HH12      ARG  43 -15.073  -6.036 -15.260
  341   1HH2  ARG  43          HH21      ARG  43 -12.997  -3.336 -14.626
  342   2HH2  ARG  43          HH22      ARG  43 -13.927  -4.181 -15.819
  343    H    ARG  44           HN       ARG  44  -8.567  -6.720 -11.390
  344    HA   ARG  44           HA       ARG  44  -8.137  -9.447 -12.247
  345   1HB   ARG  44           HB2      ARG  44  -7.292  -7.293 -13.369
  346   2HB   ARG  44           HB1      ARG  44  -6.022  -7.291 -12.145
  347   1HG   ARG  44           HG2      ARG  44  -5.216  -9.444 -12.871
  348   2HG   ARG  44           HG1      ARG  44  -6.599  -9.657 -13.945
  349   1HD   ARG  44           HD2      ARG  44  -5.838  -7.580 -15.178
  350   2HD   ARG  44           HD1      ARG  44  -4.362  -7.633 -14.214
  351    HE   ARG  44           HE       ARG  44  -4.876 -10.173 -15.513
  352   1HH1  ARG  44          HH11      ARG  44  -3.646  -6.957 -15.973
  353   2HH1  ARG  44          HH12      ARG  44  -2.601  -7.415 -17.276
  354   1HH2  ARG  44          HH21      ARG  44  -3.517 -10.755 -17.204
  355   2HH2  ARG  44          HH22      ARG  44  -2.529  -9.556 -17.970
  356    H    THR  45           HN       THR  45  -6.977  -7.490  -9.554
  357    HA   THR  45           HA       THR  45  -4.963  -9.418  -8.709
  358    HB   THR  45           HB       THR  45  -6.247  -7.248  -7.030
  359    HG1  THR  45           HG1      THR  45  -4.809  -5.859  -7.915
  360   1HG2  THR  45          HG21      THR  45  -3.659  -8.796  -6.942
  361   2HG2  THR  45          HG23      THR  45  -3.851  -7.262  -6.093
  362   3HG2  THR  45          HG22      THR  45  -4.880  -8.633  -5.680
  363    H    TYR  46           HN       TYR  46  -8.365  -8.856  -8.064
  364    HA   TYR  46           HA       TYR  46  -8.569 -10.467  -5.689
  365   1HB   TYR  46           HB2      TYR  46 -10.294  -8.810  -6.564
  366   2HB   TYR  46           HB1      TYR  46 -10.747 -10.037  -7.748
  367    HD1  TYR  46           HD1      TYR  46 -10.022  -9.845  -4.064
  368    HD2  TYR  46           HD2      TYR  46 -12.532 -11.409  -7.178
  369    HE1  TYR  46           HE1      TYR  46 -11.433 -10.969  -2.363
  370    HE2  TYR  46           HE2      TYR  46 -13.943 -12.533  -5.476
  371    HH   TYR  46           HH       TYR  46 -12.981 -12.868  -2.225
  372    H    GLU  47           HN       GLU  47  -8.745 -11.193  -9.145
  373    HA   GLU  47           HA       GLU  47  -9.490 -13.993  -8.673
  374   1HB   GLU  47           HB2      GLU  47  -8.785 -12.375 -11.124
  375   2HB   GLU  47           HB1      GLU  47  -8.977 -14.128 -11.201
  376   1HG   GLU  47           HG2      GLU  47 -11.253 -14.010 -10.492
  377   2HG   GLU  47           HG1      GLU  47 -11.087 -12.321 -10.007
  378    H    SER  48           HN       SER  48  -6.578 -12.121  -9.079
  379    HA   SER  48           HA       SER  48  -4.797 -14.204  -9.893
  380   1HB   SER  48           HB2      SER  48  -3.023 -12.739  -9.165
  381   2HB   SER  48           HB1      SER  48  -4.288 -11.727  -9.855
  382    HG   SER  48           HG       SER  48  -4.748 -10.965  -7.921
  383    H    PHE  49           HN       PHE  49  -6.315 -13.500  -6.851
  384    HA   PHE  49           HA       PHE  49  -4.472 -14.783  -5.081
  385   1HB   PHE  49           HB2      PHE  49  -7.467 -14.362  -4.948
  386   2HB   PHE  49           HB1      PHE  49  -6.553 -15.107  -3.636
  387    HD1  PHE  49           HD2      PHE  49  -4.162 -13.706  -3.278
  388    HD2  PHE  49           HD1      PHE  49  -7.939 -12.117  -4.566
  389    HE1  PHE  49           HE2      PHE  49  -3.496 -11.461  -2.462
  390    HE2  PHE  49           HE1      PHE  49  -7.273  -9.872  -3.751
  391    HZ   PHE  49           HZ       PHE  49  -5.051  -9.544  -2.699
  392    HA   PRO  50           HA       PRO  50  -5.195 -19.107  -5.849
  393   1HB   PRO  50           HB2      PRO  50  -4.871 -20.072  -3.250
  394   2HB   PRO  50           HB1      PRO  50  -3.564 -19.721  -4.388
  395   1HG   PRO  50           HG2      PRO  50  -4.228 -18.342  -1.959
  396   2HG   PRO  50           HG1      PRO  50  -2.881 -18.041  -3.064
  397   1HD   PRO  50           HD2      PRO  50  -5.385 -16.567  -2.780
  398   2HD   PRO  50           HD1      PRO  50  -3.912 -16.112  -3.654
  399    H    LYS  51           HN       LYS  51  -6.505 -18.769  -2.544
  400    HA   LYS  51           HA       LYS  51  -9.082 -19.896  -3.565
  401   1HB   LYS  51           HB2      LYS  51  -7.838 -20.115  -0.805
  402   2HB   LYS  51           HB1      LYS  51  -9.400 -20.788  -1.272
  403   1HG   LYS  51           HG2      LYS  51  -8.371 -22.275  -2.862
  404   2HG   LYS  51           HG1      LYS  51  -6.806 -21.485  -2.670
  405   1HD   LYS  51           HD2      LYS  51  -6.508 -22.345  -0.485
  406   2HD   LYS  51           HD1      LYS  51  -8.216 -22.760  -0.326
  407   1HE   LYS  51           HE2      LYS  51  -7.127 -24.829  -0.747
  408   2HE   LYS  51           HE1      LYS  51  -7.837 -24.369  -2.295
  409   1HZ   LYS  51           HZ3      LYS  51  -5.502 -23.182  -2.522
  410   2HZ   LYS  51           HZ2      LYS  51  -5.038 -24.437  -1.476
  411   3HZ   LYS  51           HZ1      LYS  51  -5.739 -24.797  -2.980
  412    H    ARG  52           HN       ARG  52 -10.368 -18.108  -3.849
  413    HA   ARG  52           HA       ARG  52 -10.337 -15.952  -1.813
  414   1HB   ARG  52           HB2      ARG  52 -11.811 -16.195  -4.456
  415   2HB   ARG  52           HB1      ARG  52 -11.836 -14.775  -3.410
  416   1HG   ARG  52           HG2      ARG  52 -10.088 -14.135  -4.748
  417   2HG   ARG  52           HG1      ARG  52  -9.166 -15.122  -3.614
  418   1HD   ARG  52           HD2      ARG  52  -8.568 -15.792  -5.869
  419   2HD   ARG  52           HD1      ARG  52  -9.511 -17.088  -5.135
  420    HE   ARG  52           HE       ARG  52 -11.315 -15.374  -6.507
  421   1HH1  ARG  52          HH11      ARG  52  -8.702 -17.572  -7.152
  422   2HH1  ARG  52          HH12      ARG  52  -9.299 -18.008  -8.718
  423   1HH2  ARG  52          HH21      ARG  52 -12.079 -15.949  -8.541
  424   2HH2  ARG  52          HH22      ARG  52 -11.200 -17.093  -9.500
  425    HA   PRO  53           HA       PRO  53 -11.860 -14.237  -1.482
  426   1HB   PRO  53           HB2      PRO  53 -13.155 -13.490   0.884
  427   2HB   PRO  53           HB1      PRO  53 -13.758 -13.218  -0.756
  428   1HG   PRO  53           HG2      PRO  53 -14.813 -14.969   1.245
  429   2HG   PRO  53           HG1      PRO  53 -15.421 -14.682  -0.391
  430   1HD   PRO  53           HD2      PRO  53 -13.868 -16.946   0.628
  431   2HD   PRO  53           HD1      PRO  53 -14.785 -16.803  -0.881
  432    H    LEU  54           HN       LEU  54 -10.637 -12.983   0.283
  433    HA   LEU  54           HA       LEU  54  -8.938 -14.886   1.765
  434   1HB   LEU  54           HB2      LEU  54  -8.753 -11.932   1.164
  435   2HB   LEU  54           HB1      LEU  54  -7.651 -12.726   2.289
  436    HG   LEU  54           HG       LEU  54  -8.096 -13.618  -0.574
  437   1HD1  LEU  54          HD13      LEU  54  -6.276 -11.616   0.656
  438   2HD1  LEU  54          HD12      LEU  54  -5.534 -12.735  -0.489
  439   3HD1  LEU  54          HD11      LEU  54  -6.885 -11.720  -0.996
  440   1HD2  LEU  54          HD22      LEU  54  -6.259 -14.469   1.671
  441   2HD2  LEU  54          HD21      LEU  54  -7.333 -15.472   0.696
  442   3HD2  LEU  54          HD23      LEU  54  -5.865 -14.802  -0.016
  443    HA   PRO  55           HA       PRO  55 -11.449 -13.865   5.426
  444   1HB   PRO  55           HB2      PRO  55 -10.354 -15.977   6.917
  445   2HB   PRO  55           HB1      PRO  55 -11.853 -16.027   5.979
  446   1HG   PRO  55           HG2      PRO  55  -9.399 -17.396   5.457
  447   2HG   PRO  55           HG1      PRO  55 -10.901 -17.447   4.525
  448   1HD   PRO  55           HD2      PRO  55  -8.426 -16.008   3.945
  449   2HD   PRO  55           HD1      PRO  55  -9.805 -16.335   2.885
  450    H    GLU  56           HN       GLU  56 -10.675 -13.881   7.921
  451    HA   GLU  56           HA       GLU  56  -9.295 -12.868   9.518
  452   1HB   GLU  56           HB2      GLU  56  -7.040 -13.571   7.616
  453   2HB   GLU  56           HB1      GLU  56  -6.905 -13.242   9.343
  454   1HG   GLU  56           HG2      GLU  56  -8.673 -15.208   9.523
  455   2HG   GLU  56           HG1      GLU  56  -8.001 -15.659   7.955
  456    H    ARG  57           HN       ARG  57 -10.334 -11.380   7.086
  457    HA   ARG  57           HA       ARG  57  -9.193  -8.829   7.684
  458   1HB   ARG  57           HB2      ARG  57  -8.027  -8.407   5.521
  459   2HB   ARG  57           HB1      ARG  57  -7.229  -9.652   6.483
  460   1HG   ARG  57           HG2      ARG  57  -8.807 -11.274   5.112
  461   2HG   ARG  57           HG1      ARG  57  -8.822  -9.938   3.961
  462   1HD   ARG  57           HD2      ARG  57  -6.956 -11.107   3.222
  463   2HD   ARG  57           HD1      ARG  57  -6.206  -9.986   4.359
  464    HE   ARG  57           HE       ARG  57  -6.744 -12.120   5.970
  465   1HH1  ARG  57          HH11      ARG  57  -5.293 -11.856   2.825
  466   2HH1  ARG  57          HH12      ARG  57  -4.286 -13.248   3.043
  467   1HH2  ARG  57          HH21      ARG  57  -5.431 -13.923   6.242
  468   2HH2  ARG  57          HH22      ARG  57  -4.364 -14.412   4.967
  469    H    THR  58           HN       THR  58  -9.897  -7.189   5.870
  470    HA   THR  58           HA       THR  58 -12.701  -7.860   5.202
  471    HB   THR  58           HB       THR  58 -11.320  -5.216   4.720
  472    HG1  THR  58           HG1      THR  58 -12.752  -5.295   6.981
  473   1HG2  THR  58          HG21      THR  58 -13.706  -5.902   3.881
  474   2HG2  THR  58          HG23      THR  58 -14.166  -5.667   5.567
  475   3HG2  THR  58          HG22      THR  58 -13.479  -4.329   4.645
  476    H    ASN  59           HN       ASN  59 -13.358  -8.303   3.148
  477    HA   ASN  59           HA       ASN  59 -11.318  -8.177   0.988
  478   1HB   ASN  59           HB2      ASN  59 -14.006  -9.580   1.100
  479   2HB   ASN  59           HB1      ASN  59 -12.860  -9.679  -0.238
  480   1HD2  ASN  59          HD22      ASN  59 -10.423 -11.355   2.070
  481   2HD2  ASN  59          HD21      ASN  59 -10.419  -9.898   1.200
  482    H    VAL  60           HN       VAL  60 -11.383  -6.170   0.049
  483    HA   VAL  60           HA       VAL  60 -14.071  -5.115  -0.741
  484    HB   VAL  60           HB       VAL  60 -11.532  -3.524  -0.272
  485   1HG1  VAL  60          HG13      VAL  60 -13.140  -2.512  -1.851
  486   2HG1  VAL  60          HG12      VAL  60 -14.425  -2.691  -0.656
  487   3HG1  VAL  60          HG11      VAL  60 -13.075  -1.599  -0.343
  488   1HG2  VAL  60          HG21      VAL  60 -12.444  -4.578   1.809
  489   2HG2  VAL  60          HG23      VAL  60 -12.555  -2.818   1.830
  490   3HG2  VAL  60          HG22      VAL  60 -13.989  -3.788   1.492
  491    H    VAL  61           HN       VAL  61 -14.313  -4.417  -2.882
  492    HA   VAL  61           HA       VAL  61 -11.955  -4.738  -4.685
  493    HB   VAL  61           HB       VAL  61 -14.745  -5.761  -5.292
  494   1HG1  VAL  61          HG11      VAL  61 -13.373  -5.033  -7.242
  495   2HG1  VAL  61          HG13      VAL  61 -12.102  -6.142  -6.732
  496   3HG1  VAL  61          HG12      VAL  61 -13.668  -6.771  -7.243
  497   1HG2  VAL  61          HG23      VAL  61 -12.221  -7.216  -4.445
  498   2HG2  VAL  61          HG22      VAL  61 -13.746  -7.152  -3.564
  499   3HG2  VAL  61          HG21      VAL  61 -13.651  -8.016  -5.098
  500    H    LEU  62           HN       LEU  62 -11.695  -2.921  -5.876
  501    HA   LEU  62           HA       LEU  62 -13.966  -1.014  -6.080
  502   1HB   LEU  62           HB2      LEU  62 -11.683  -0.272  -5.256
  503   2HB   LEU  62           HB1      LEU  62 -11.080  -0.572  -6.887
  504    HG   LEU  62           HG       LEU  62 -12.958   0.962  -7.705
  505   1HD1  LEU  62          HD13      LEU  62 -13.123   1.338  -4.723
  506   2HD1  LEU  62          HD12      LEU  62 -13.547   2.659  -5.811
  507   3HD1  LEU  62          HD11      LEU  62 -14.433   1.136  -5.886
  508   1HD2  LEU  62          HD21      LEU  62 -10.756   2.063  -5.931
  509   2HD2  LEU  62          HD23      LEU  62 -10.631   1.704  -7.654
  510   3HD2  LEU  62          HD22      LEU  62 -11.668   3.018  -7.100
  511    H    THR  63           HN       THR  63 -15.165  -1.133  -7.903
  512    HA   THR  63           HA       THR  63 -13.845  -1.317 -10.523
  513    HB   THR  63           HB       THR  63 -14.095  -3.683 -10.010
  514    HG1  THR  63           HG1      THR  63 -15.809  -2.480 -11.854
  515   1HG2  THR  63          HG21      THR  63 -15.852  -3.359  -8.259
  516   2HG2  THR  63          HG23      THR  63 -17.028  -3.083  -9.544
  517   3HG2  THR  63          HG22      THR  63 -16.236  -4.652  -9.394
  518    H    HIS  64           HN       HIS  64 -15.044  -0.240 -12.064
  519    HA   HIS  64           HA       HIS  64 -17.565   1.016 -11.140
  520   1HB   HIS  64           HB2      HIS  64 -15.842   1.503 -13.591
  521   2HB   HIS  64           HB1      HIS  64 -17.300   2.413 -13.194
  522    HD1  HIS  64           HD1      HIS  64 -13.839   1.681 -11.818
  523    HD2  HIS  64           HD2      HIS  64 -16.928   4.434 -11.301
  524    HE1  HIS  64           HE1      HIS  64 -12.943   3.484 -10.280
  525    H    GLN  65           HN       GLN  65 -17.417  -1.853 -11.917
  526    HA   GLN  65           HA       GLN  65 -19.185  -1.814 -14.328
  527   1HB   GLN  65           HB2      GLN  65 -16.978  -3.233 -14.186
  528   2HB   GLN  65           HB1      GLN  65 -17.960  -4.318 -13.200
  529   1HG   GLN  65           HG2      GLN  65 -19.669  -4.333 -15.050
  530   2HG   GLN  65           HG1      GLN  65 -18.526  -3.427 -16.040
  531   1HE2  GLN  65          HE22      GLN  65 -17.305  -7.205 -14.943
  532   2HE2  GLN  65          HE21      GLN  65 -18.089  -6.227 -13.798
  533    H    GLU  66           HN       GLU  66 -21.309  -2.160 -13.940
  534    HA   GLU  66           HA       GLU  66 -22.180  -3.044 -11.269
  535   1HB   GLU  66           HB2      GLU  66 -23.249  -1.182 -12.760
  536   2HB   GLU  66           HB1      GLU  66 -24.028  -2.531 -13.589
  537   1HG   GLU  66           HG2      GLU  66 -25.034  -3.297 -11.517
  538   2HG   GLU  66           HG1      GLU  66 -24.147  -2.082 -10.594
  539    H    ASP  67           HN       ASP  67 -20.798  -4.946 -13.080
  540    HA   ASP  67           HA       ASP  67 -22.984  -6.978 -13.305
  541   1HB   ASP  67           HB2      ASP  67 -21.907  -6.068 -15.495
  542   2HB   ASP  67           HB1      ASP  67 -20.509  -7.034 -15.022
  543    H    TYR  68           HN       TYR  68 -19.620  -6.296 -12.497
  544    HA   TYR  68           HA       TYR  68 -18.897  -9.005 -11.816
  545   1HB   TYR  68           HB2      TYR  68 -17.338  -6.996 -12.254
  546   2HB   TYR  68           HB1      TYR  68 -17.677  -6.530 -10.587
  547    HD1  TYR  68           HD1      TYR  68 -16.233  -9.172 -12.749
  548    HD2  TYR  68           HD2      TYR  68 -16.777  -7.766  -8.727
  549    HE1  TYR  68           HE1      TYR  68 -14.563 -10.821 -11.947
  550    HE2  TYR  68           HE2      TYR  68 -15.107  -9.415  -7.925
  551    HH   TYR  68           HH       TYR  68 -13.928 -11.958  -9.927
  552    H    GLN  69           HN       GLN  69 -18.850  -9.992  -9.756
  553    HA   GLN  69           HA       GLN  69 -20.064  -8.534  -7.477
  554   1HB   GLN  69           HB2      GLN  69 -21.183 -11.069  -8.700
  555   2HB   GLN  69           HB1      GLN  69 -21.583 -10.532  -7.069
  556   1HG   GLN  69           HG2      GLN  69 -22.405  -8.385  -7.986
  557   2HG   GLN  69           HG1      GLN  69 -22.033  -8.946  -9.616
  558   1HE2  GLN  69          HE22      GLN  69 -25.157 -10.525  -9.893
  559   2HE2  GLN  69          HE21      GLN  69 -23.878  -9.703 -10.649
  560    H    ALA  70           HN       ALA  70 -19.671  -9.638  -5.427
  561    HA   ALA  70           HA       ALA  70 -17.687 -11.856  -5.547
  562   1HB   ALA  70           HB1      ALA  70 -17.375  -9.324  -3.905
  563   2HB   ALA  70           HB3      ALA  70 -16.299 -10.720  -3.847
  564   3HB   ALA  70           HB2      ALA  70 -16.413  -9.754  -5.319
  565    H    GLN  71           HN       GLN  71 -18.123 -13.414  -4.045
  566    HA   GLN  71           HA       GLN  71 -20.400 -12.986  -2.222
  567   1HB   GLN  71           HB2      GLN  71 -18.717 -15.428  -2.853
  568   2HB   GLN  71           HB1      GLN  71 -20.079 -15.431  -1.733
  569   1HG   GLN  71           HG2      GLN  71 -20.371 -14.440  -4.570
  570   2HG   GLN  71           HG1      GLN  71 -20.561 -16.146  -4.163
  571   1HE2  GLN  71          HE22      GLN  71 -23.411 -15.287  -1.920
  572   2HE2  GLN  71          HE21      GLN  71 -21.911 -16.057  -1.730
  573    H    GLY  72           HN       GLY  72 -20.053 -12.244  -0.196
  574   1HA   GLY  72           HA2      GLY  72 -19.095 -12.107   1.959
  575   2HA   GLY  72           HA1      GLY  72 -17.918 -13.327   1.470
  576    H    ALA  73           HN       ALA  73 -18.617 -10.185  -0.048
  577    HA   ALA  73           HA       ALA  73 -16.128  -9.009   0.955
  578   1HB   ALA  73           HB3      ALA  73 -16.422  -9.963  -1.893
  579   2HB   ALA  73           HB2      ALA  73 -15.358  -8.615  -1.490
  580   3HB   ALA  73           HB1      ALA  73 -15.070 -10.206  -0.787
  581    H    VAL  74           HN       VAL  74 -16.367  -6.813   1.022
  582    HA   VAL  74           HA       VAL  74 -18.872  -5.630   0.144
  583    HB   VAL  74           HB       VAL  74 -16.369  -4.234   1.136
  584   1HG1  VAL  74          HG11      VAL  74 -19.294  -3.448   1.001
  585   2HG1  VAL  74          HG13      VAL  74 -18.073  -2.541   1.893
  586   3HG1  VAL  74          HG12      VAL  74 -17.953  -2.694   0.141
  587   1HG2  VAL  74          HG23      VAL  74 -17.126  -5.988   2.712
  588   2HG2  VAL  74          HG22      VAL  74 -17.419  -4.375   3.365
  589   3HG2  VAL  74          HG21      VAL  74 -18.753  -5.306   2.682
  590    H    VAL  75           HN       VAL  75 -19.106  -5.480  -2.062
  591    HA   VAL  75           HA       VAL  75 -16.853  -4.733  -3.785
  592    HB   VAL  75           HB       VAL  75 -19.792  -4.993  -4.489
  593   1HG1  VAL  75          HG12      VAL  75 -18.130  -3.798  -6.058
  594   2HG1  VAL  75          HG11      VAL  75 -17.387  -5.382  -6.274
  595   3HG1  VAL  75          HG13      VAL  75 -19.068  -5.125  -6.743
  596   1HG2  VAL  75          HG22      VAL  75 -17.555  -7.045  -4.532
  597   2HG2  VAL  75          HG21      VAL  75 -18.976  -7.075  -3.486
  598   3HG2  VAL  75          HG23      VAL  75 -19.158  -7.288  -5.228
  599    H    VAL  76           HN       VAL  76 -16.234  -2.616  -3.502
  600    HA   VAL  76           HA       VAL  76 -18.281  -0.504  -3.221
  601    HB   VAL  76           HB       VAL  76 -16.286   0.995  -2.979
  602   1HG1  VAL  76          HG11      VAL  76 -17.382  -0.281  -1.064
  603   2HG1  VAL  76          HG13      VAL  76 -16.071  -1.452  -1.209
  604   3HG1  VAL  76          HG12      VAL  76 -15.715   0.222  -0.784
  605   1HG2  VAL  76          HG23      VAL  76 -14.827  -1.640  -3.351
  606   2HG2  VAL  76          HG22      VAL  76 -14.689  -0.200  -4.361
  607   3HG2  VAL  76          HG21      VAL  76 -14.071  -0.181  -2.710
  608    H    HIS  77           HN       HIS  77 -18.364   1.312  -4.703
  609    HA   HIS  77           HA       HIS  77 -17.105   0.833  -7.365
  610   1HB   HIS  77           HB2      HIS  77 -20.025   1.474  -6.847
  611   2HB   HIS  77           HB1      HIS  77 -19.264   1.500  -8.438
  612    HD1  HIS  77           HD1      HIS  77 -19.202  -0.678  -9.668
  613    HD2  HIS  77           HD2      HIS  77 -19.822  -1.230  -5.583
  614    HE1  HIS  77           HE1      HIS  77 -19.610  -3.156  -9.334
  615    H    ASP  78           HN       ASP  78 -16.553   2.708  -5.121
  616    HA   ASP  78           HA       ASP  78 -16.315   5.136  -6.705
  617   1HB   ASP  78           HB2      ASP  78 -18.721   5.129  -5.764
  618   2HB   ASP  78           HB1      ASP  78 -17.968   5.394  -4.192
  619    H    VAL  79           HN       VAL  79 -14.831   6.606  -5.740
  620    HA   VAL  79           HA       VAL  79 -12.944   5.433  -3.905
  621    HB   VAL  79           HB       VAL  79 -13.236   8.355  -4.665
  622   1HG1  VAL  79          HG13      VAL  79 -11.696   7.542  -2.724
  623   2HG1  VAL  79          HG12      VAL  79 -10.693   6.877  -4.013
  624   3HG1  VAL  79          HG11      VAL  79 -11.011   8.611  -3.948
  625   1HG2  VAL  79          HG22      VAL  79 -11.862   6.034  -6.047
  626   2HG2  VAL  79          HG21      VAL  79 -13.100   7.101  -6.711
  627   3HG2  VAL  79          HG23      VAL  79 -11.478   7.720  -6.396
  628    H    ALA  80           HN       ALA  80 -15.651   7.663  -3.535
  629    HA   ALA  80           HA       ALA  80 -15.046   8.442  -0.820
  630   1HB   ALA  80           HB1      ALA  80 -16.578   9.732  -2.287
  631   2HB   ALA  80           HB3      ALA  80 -17.721   8.388  -2.254
  632   3HB   ALA  80           HB2      ALA  80 -17.357   9.275  -0.773
  633    H    ALA  81           HN       ALA  81 -16.807   5.765  -2.283
  634    HA   ALA  81           HA       ALA  81 -18.086   4.832   0.121
  635   1HB   ALA  81           HB1      ALA  81 -18.470   4.175  -2.402
  636   2HB   ALA  81           HB3      ALA  81 -17.235   2.961  -2.069
  637   3HB   ALA  81           HB2      ALA  81 -18.732   2.974  -1.136
  638    H    VAL  82           HN       VAL  82 -14.916   4.270  -1.330
  639    HA   VAL  82           HA       VAL  82 -14.144   2.094   0.389
  640    HB   VAL  82           HB       VAL  82 -12.346   4.133  -0.957
  641   1HG1  VAL  82          HG11      VAL  82 -11.281   2.663   0.748
  642   2HG1  VAL  82          HG13      VAL  82 -11.868   1.253  -0.132
  643   3HG1  VAL  82          HG12      VAL  82 -10.690   2.331  -0.881
  644   1HG2  VAL  82          HG23      VAL  82 -13.881   1.774  -1.982
  645   2HG2  VAL  82          HG22      VAL  82 -13.518   3.304  -2.780
  646   3HG2  VAL  82          HG21      VAL  82 -12.268   2.068  -2.635
  647    H    PHE  83           HN       PHE  83 -13.692   5.622   0.583
  648    HA   PHE  83           HA       PHE  83 -12.226   5.486   3.093
  649   1HB   PHE  83           HB2      PHE  83 -13.556   7.749   1.585
  650   2HB   PHE  83           HB1      PHE  83 -12.722   7.987   3.121
  651    HD1  PHE  83           HD2      PHE  83 -10.341   6.591   3.158
  652    HD2  PHE  83           HD1      PHE  83 -12.284   8.257  -0.291
  653    HE1  PHE  83           HE2      PHE  83  -8.167   6.665   1.969
  654    HE2  PHE  83           HE1      PHE  83 -10.109   8.331  -1.480
  655    HZ   PHE  83           HZ       PHE  83  -8.051   7.535  -0.351
  656    H    ALA  84           HN       ALA  84 -15.592   5.760   2.150
  657    HA   ALA  84           HA       ALA  84 -16.637   6.671   4.663
  658   1HB   ALA  84           HB3      ALA  84 -17.822   5.146   2.343
  659   2HB   ALA  84           HB2      ALA  84 -18.769   5.494   3.790
  660   3HB   ALA  84           HB1      ALA  84 -18.118   6.817   2.822
  661    H    TYR  85           HN       TYR  85 -15.993   3.433   3.353
  662    HA   TYR  85           HA       TYR  85 -17.142   1.976   5.549
  663   1HB   TYR  85           HB2      TYR  85 -16.502   1.057   3.254
  664   2HB   TYR  85           HB1      TYR  85 -14.833   1.051   3.823
  665    HD1  TYR  85           HD2      TYR  85 -18.198  -0.402   4.301
  666    HD2  TYR  85           HD1      TYR  85 -14.078  -0.515   5.513
  667    HE1  TYR  85           HE2      TYR  85 -18.598  -2.556   5.462
  668    HE2  TYR  85           HE1      TYR  85 -14.479  -2.669   6.673
  669    HH   TYR  85           HH       TYR  85 -15.948  -4.411   6.856
  670    H    ALA  86           HN       ALA  86 -13.836   3.119   4.875
  671    HA   ALA  86           HA       ALA  86 -12.650   1.965   7.228
  672   1HB   ALA  86           HB3      ALA  86 -11.421   2.841   5.180
  673   2HB   ALA  86           HB2      ALA  86 -11.720   4.466   5.797
  674   3HB   ALA  86           HB1      ALA  86 -10.742   3.334   6.731
  675    H    LYS  87           HN       LYS  87 -14.529   4.843   6.658
  676    HA   LYS  87           HA       LYS  87 -13.726   6.365   8.948
  677   1HB   LYS  87           HB2      LYS  87 -15.301   6.939   6.877
  678   2HB   LYS  87           HB1      LYS  87 -16.564   6.443   8.004
  679   1HG   LYS  87           HG2      LYS  87 -16.417   8.671   8.584
  680   2HG   LYS  87           HG1      LYS  87 -15.181   8.020   9.661
  681   1HD   LYS  87           HD2      LYS  87 -14.371   8.796   6.887
  682   2HD   LYS  87           HD1      LYS  87 -14.649  10.078   8.066
  683   1HE   LYS  87           HE2      LYS  87 -13.143   8.633   9.633
  684   2HE   LYS  87           HE1      LYS  87 -12.614   7.861   8.139
  685   1HZ   LYS  87           HZ2      LYS  87 -12.680  10.785   8.232
  686   2HZ   LYS  87           HZ1      LYS  87 -11.429   9.992   9.064
  687   3HZ   LYS  87           HZ3      LYS  87 -11.622   9.752   7.397
  688    H    GLN  88           HN       GLN  88 -16.239   3.891   8.487
  689    HA   GLN  88           HA       GLN  88 -17.305   4.096  11.163
  690   1HB   GLN  88           HB2      GLN  88 -18.331   2.978   9.032
  691   2HB   GLN  88           HB1      GLN  88 -17.401   1.566   9.533
  692   1HG   GLN  88           HG2      GLN  88 -18.470   1.965  11.869
  693   2HG   GLN  88           HG1      GLN  88 -19.637   2.959  10.994
  694   1HE2  GLN  88          HE22      GLN  88 -19.807  -1.094  10.687
  695   2HE2  GLN  88          HE21      GLN  88 -18.584  -0.339  11.589
  696    H    HIS  89           HN       HIS  89 -14.658   2.303   9.701
  697    HA   HIS  89           HA       HIS  89 -14.049   1.137  12.390
  698   1HB   HIS  89           HB2      HIS  89 -13.694   0.030   9.608
  699   2HB   HIS  89           HB1      HIS  89 -12.705  -0.558  10.945
  700    HD1  HIS  89           HD1      HIS  89 -13.701  -2.678  11.785
  701    HD2  HIS  89           HD2      HIS  89 -16.644   0.105  10.803
  702    HE1  HIS  89           HE1      HIS  89 -15.919  -3.737  12.394
  703    HA   PRO  90           HA       PRO  90 -10.551   3.990  11.473
  704   1HB   PRO  90           HB2      PRO  90 -10.393   4.828  14.139
  705   2HB   PRO  90           HB1      PRO  90 -11.230   5.677  12.833
  706   1HG   PRO  90           HG2      PRO  90 -12.372   4.371  15.109
  707   2HG   PRO  90           HG1      PRO  90 -13.203   5.241  13.813
  708   1HD   PRO  90           HD2      PRO  90 -12.936   2.358  14.215
  709   2HD   PRO  90           HD1      PRO  90 -14.028   3.242  13.136
  710    H    ASP  91           HN       ASP  91 -11.068   1.467  13.818
  711    HA   ASP  91           HA       ASP  91  -8.402   1.326  14.888
  712   1HB   ASP  91           HB2      ASP  91 -10.665  -0.661  14.663
  713   2HB   ASP  91           HB1      ASP  91  -9.108  -1.111  15.360
  714    H    GLN  92           HN       GLN  92  -9.855   0.230  11.913
  715    HA   GLN  92           HA       GLN  92  -7.524  -1.480  11.264
  716   1HB   GLN  92           HB2      GLN  92 -10.144  -0.905   9.863
  717   2HB   GLN  92           HB1      GLN  92  -8.851  -1.836   9.106
  718   1HG   GLN  92           HG2      GLN  92  -8.942  -3.516  10.818
  719   2HG   GLN  92           HG1      GLN  92 -10.004  -2.525  11.819
  720   1HE2  GLN  92          HE22      GLN  92 -11.816  -5.086   9.507
  721   2HE2  GLN  92          HE21      GLN  92 -10.312  -5.264  10.272
  722    H    GLU  93           HN       GLU  93  -6.890  -1.130   8.759
  723    HA   GLU  93           HA       GLU  93  -6.606   1.785   8.214
  724   1HB   GLU  93           HB2      GLU  93  -4.359  -0.243   8.366
  725   2HB   GLU  93           HB1      GLU  93  -4.189   1.343   7.609
  726   1HG   GLU  93           HG2      GLU  93  -5.211   1.047  10.435
  727   2HG   GLU  93           HG1      GLU  93  -3.484   1.140  10.083
  728    H    LEU  94           HN       LEU  94  -6.370   2.272   5.984
  729    HA   LEU  94           HA       LEU  94  -7.441   0.241   4.175
  730   1HB   LEU  94           HB2      LEU  94  -7.917   2.778   4.125
  731   2HB   LEU  94           HB1      LEU  94  -6.336   2.929   3.355
  732    HG   LEU  94           HG       LEU  94  -7.157   1.133   1.705
  733   1HD1  LEU  94          HD11      LEU  94  -9.667   1.805   3.217
  734   2HD1  LEU  94          HD13      LEU  94  -9.764   1.371   1.511
  735   3HD1  LEU  94          HD12      LEU  94  -9.086   0.232   2.673
  736   1HD2  LEU  94          HD22      LEU  94  -8.131   3.970   1.895
  737   2HD2  LEU  94          HD21      LEU  94  -6.968   3.265   0.772
  738   3HD2  LEU  94          HD23      LEU  94  -8.692   2.954   0.566
  739    H    VAL  95           HN       VAL  95  -6.039  -1.338   3.538
  740    HA   VAL  95           HA       VAL  95  -3.250  -0.541   2.820
  741    HB   VAL  95           HB       VAL  95  -4.336  -3.321   3.360
  742   1HG1  VAL  95          HG12      VAL  95  -1.528  -2.203   3.091
  743   2HG1  VAL  95          HG11      VAL  95  -1.906  -3.851   3.592
  744   3HG1  VAL  95          HG13      VAL  95  -2.328  -3.305   1.969
  745   1HG2  VAL  95          HG21      VAL  95  -2.946  -1.310   5.148
  746   2HG2  VAL  95          HG23      VAL  95  -4.497  -2.105   5.421
  747   3HG2  VAL  95          HG22      VAL  95  -3.000  -3.035   5.517
  748    H    ILE  96           HN       ILE  96  -3.060  -0.197   0.663
  749    HA   ILE  96           HA       ILE  96  -4.830  -1.641  -1.221
  750    HB   ILE  96           HB       ILE  96  -2.719   0.452  -1.814
  751   1HG1  ILE  96          HG12      ILE  96  -4.408   1.339  -0.244
  752   2HG1  ILE  96          HG11      ILE  96  -4.588   2.070  -1.837
  753   1HG2  ILE  96          HG22      ILE  96  -3.455  -0.928  -3.734
  754   2HG2  ILE  96          HG21      ILE  96  -5.130  -0.498  -3.390
  755   3HG2  ILE  96          HG23      ILE  96  -3.988   0.746  -3.897
  756   1HD1  ILE  96          HD12      ILE  96  -6.409   0.473  -2.357
  757   2HD1  ILE  96          HD11      ILE  96  -6.238  -0.237  -0.752
  758   3HD1  ILE  96          HD13      ILE  96  -6.786   1.431  -0.925
  759    H    ALA  97           HN       ALA  97  -4.146  -3.500  -2.150
  760    HA   ALA  97           HA       ALA  97  -1.236  -4.131  -2.099
  761   1HB   ALA  97           HB3      ALA  97  -3.744  -5.740  -2.078
  762   2HB   ALA  97           HB2      ALA  97  -2.352  -6.439  -2.906
  763   3HB   ALA  97           HB1      ALA  97  -2.235  -5.999  -1.202
  764    H    GLY  98           HN       GLY  98  -3.947  -3.597  -4.254
  765   1HA   GLY  98           HA2      GLY  98  -2.506  -2.849  -6.502
  766   2HA   GLY  98           HA1      GLY  98  -2.623  -4.604  -6.638
  767    H    GLY  99           HN       GLY  99  -5.619  -3.474  -8.427
  768   1HA   GLY  99           HA2      GLY  99  -2.816  -4.326  -8.657
  769   2HA   GLY  99           HA1      GLY  99  -3.926  -4.026  -9.996
  770    H    ALA 100           HN       ALA 100  -2.351  -2.726 -11.090
  771    HA   ALA 100           HA       ALA 100  -1.123  -0.420  -9.842
  772   1HB   ALA 100           HB2      ALA 100  -1.505  -1.181 -12.752
  773   2HB   ALA 100           HB1      ALA 100  -0.555   0.204 -12.212
  774   3HB   ALA 100           HB3      ALA 100  -0.059  -1.431 -11.775
  775    H    GLN 101           HN       GLN 101  -4.155  -1.022 -11.461
  776    HA   GLN 101           HA       GLN 101  -4.767   1.768 -12.008
  777   1HB   GLN 101           HB2      GLN 101  -5.790  -0.367 -13.091
  778   2HB   GLN 101           HB1      GLN 101  -6.839  -0.393 -11.673
  779   1HG   GLN 101           HG2      GLN 101  -7.430   2.014 -12.182
  780   2HG   GLN 101           HG1      GLN 101  -6.564   1.833 -13.708
  781   1HE2  GLN 101          HE22      GLN 101 -10.328   0.477 -13.444
  782   2HE2  GLN 101          HE21      GLN 101  -9.617   1.476 -12.270
  783    H    ILE 102           HN       ILE 102  -5.037  -0.336  -9.253
  784    HA   ILE 102           HA       ILE 102  -7.018   1.312  -7.864
  785    HB   ILE 102           HB       ILE 102  -5.173  -0.812  -6.735
  786   1HG1  ILE 102          HG12      ILE 102  -6.514  -1.703  -8.609
  787   2HG1  ILE 102          HG11      ILE 102  -7.067  -2.365  -7.073
  788   1HG2  ILE 102          HG23      ILE 102  -7.708   0.518  -5.756
  789   2HG2  ILE 102          HG22      ILE 102  -7.116  -1.002  -5.084
  790   3HG2  ILE 102          HG21      ILE 102  -6.135   0.459  -4.958
  791   1HD1  ILE 102          HD13      ILE 102  -8.860  -0.614  -7.020
  792   2HD1  ILE 102          HD12      ILE 102  -8.350  -0.098  -8.628
  793   3HD1  ILE 102          HD11      ILE 102  -9.010  -1.715  -8.389
  794    H    PHE 103           HN       PHE 103  -3.494   0.902  -7.819
  795    HA   PHE 103           HA       PHE 103  -2.958   2.570  -5.560
  796   1HB   PHE 103           HB2      PHE 103  -1.310   1.892  -8.009
  797   2HB   PHE 103           HB1      PHE 103  -0.683   2.845  -6.665
  798    HD1  PHE 103           HD1      PHE 103  -1.609   1.658  -4.267
  799    HD2  PHE 103           HD2      PHE 103  -0.532  -0.301  -7.935
  800    HE1  PHE 103           HE1      PHE 103  -1.124  -0.424  -3.012
  801    HE2  PHE 103           HE2      PHE 103  -0.048  -2.384  -6.679
  802    HZ   PHE 103           HZ       PHE 103  -0.343  -2.445  -4.219
  803    H    THR 104           HN       THR 104  -3.030   3.324  -9.053
  804    HA   THR 104           HA       THR 104  -2.480   6.118  -8.767
  805    HB   THR 104           HB       THR 104  -2.277   5.017 -10.932
  806    HG1  THR 104           HG1      THR 104  -2.796   7.173 -11.067
  807   1HG2  THR 104          HG23      THR 104  -5.274   4.617 -10.730
  808   2HG2  THR 104          HG22      THR 104  -4.284   4.231 -12.137
  809   3HG2  THR 104          HG21      THR 104  -4.056   3.346 -10.628
  810    H    ALA 105           HN       ALA 105  -5.450   4.236  -8.586
  811    HA   ALA 105           HA       ALA 105  -7.273   6.465  -8.671
  812   1HB   ALA 105           HB3      ALA 105  -7.537   3.674  -7.520
  813   2HB   ALA 105           HB2      ALA 105  -8.870   4.828  -7.593
  814   3HB   ALA 105           HB1      ALA 105  -8.125   4.244  -9.083
  815    H    PHE 106           HN       PHE 106  -5.244   5.123  -6.185
  816    HA   PHE 106           HA       PHE 106  -6.493   6.997  -4.212
  817   1HB   PHE 106           HB2      PHE 106  -5.355   4.226  -3.845
  818   2HB   PHE 106           HB1      PHE 106  -5.491   5.348  -2.491
  819    HD1  PHE 106           HD1      PHE 106  -7.822   6.488  -2.157
  820    HD2  PHE 106           HD2      PHE 106  -7.196   2.908  -4.447
  821    HE1  PHE 106           HE1      PHE 106 -10.224   5.919  -1.924
  822    HE2  PHE 106           HE2      PHE 106  -9.599   2.339  -4.215
  823    HZ   PHE 106           HZ       PHE 106 -11.113   3.844  -2.953
  824    H    LYS 107           HN       LYS 107  -4.137   7.197  -6.183
  825    HA   LYS 107           HA       LYS 107  -1.698   7.229  -4.687
  826   1HB   LYS 107           HB2      LYS 107  -0.873   8.728  -6.504
  827   2HB   LYS 107           HB1      LYS 107  -1.684   7.293  -7.130
  828   1HG   LYS 107           HG2      LYS 107  -3.820   8.770  -7.148
  829   2HG   LYS 107           HG1      LYS 107  -2.702  10.128  -7.020
  830   1HD   LYS 107           HD2      LYS 107  -1.478   9.182  -9.027
  831   2HD   LYS 107           HD1      LYS 107  -2.811   8.042  -9.213
  832   1HE   LYS 107           HE2      LYS 107  -4.334   9.707  -9.789
  833   2HE   LYS 107           HE1      LYS 107  -3.419  10.970  -8.965
  834   1HZ   LYS 107           HZ3      LYS 107  -1.731   9.983 -10.895
  835   2HZ   LYS 107           HZ2      LYS 107  -3.243  10.093 -11.663
  836   3HZ   LYS 107           HZ1      LYS 107  -2.556  11.464 -10.930
  837    H    ASP 108           HN       ASP 108  -4.282   9.595  -5.076
  838    HA   ASP 108           HA       ASP 108  -2.784  11.727  -3.737
  839   1HB   ASP 108           HB2      ASP 108  -4.785  11.871  -5.476
  840   2HB   ASP 108           HB1      ASP 108  -5.766  11.783  -4.013
  841    H    ASP 109           HN       ASP 109  -3.142   9.166  -2.298
  842    HA   ASP 109           HA       ASP 109  -4.034  10.286   0.252
  843   1HB   ASP 109           HB2      ASP 109  -5.653   8.243  -1.242
  844   2HB   ASP 109           HB1      ASP 109  -5.601   8.190   0.521
  845    H    VAL 110           HN       VAL 110  -1.593   9.135  -0.906
  846    HA   VAL 110           HA       VAL 110  -1.331   6.575   0.583
  847    HB   VAL 110           HB       VAL 110  -0.540   6.614  -1.758
  848   1HG1  VAL 110          HG13      VAL 110   1.295   8.798  -0.736
  849   2HG1  VAL 110          HG12      VAL 110   1.505   7.978  -2.283
  850   3HG1  VAL 110          HG11      VAL 110   0.062   8.947  -1.987
  851   1HG2  VAL 110          HG23      VAL 110   0.662   5.360   0.210
  852   2HG2  VAL 110          HG22      VAL 110   1.456   5.452  -1.362
  853   3HG2  VAL 110          HG21      VAL 110   1.945   6.539  -0.063
  854    H    ASP 111           HN       ASP 111   0.192   6.343   2.258
  855    HA   ASP 111           HA       ASP 111   1.516   8.860   3.187
  856   1HB   ASP 111           HB2      ASP 111   0.175   6.759   4.920
  857   2HB   ASP 111           HB1      ASP 111   1.019   8.193   5.505
  858    H    THR 112           HN       THR 112   1.450   5.323   3.767
  859    HA   THR 112           HA       THR 112   4.411   5.413   4.118
  860    HB   THR 112           HB       THR 112   2.606   3.059   4.702
  861    HG1  THR 112           HG1      THR 112   2.641   5.441   5.902
  862   1HG2  THR 112          HG21      THR 112   5.156   2.873   4.566
  863   2HG2  THR 112          HG23      THR 112   5.202   3.888   6.008
  864   3HG2  THR 112          HG22      THR 112   4.411   2.313   6.063
  865    H    LEU 113           HN       LEU 113   5.366   5.141   2.142
  866    HA   LEU 113           HA       LEU 113   4.151   3.330   0.148
  867   1HB   LEU 113           HB2      LEU 113   6.481   5.253   0.101
  868   2HB   LEU 113           HB1      LEU 113   6.187   4.120  -1.219
  869    HG   LEU 113           HG       LEU 113   3.968   5.885  -0.207
  870   1HD1  LEU 113          HD12      LEU 113   6.180   6.592  -2.147
  871   2HD1  LEU 113          HD11      LEU 113   4.629   7.430  -2.126
  872   3HD1  LEU 113          HD13      LEU 113   5.679   7.483  -0.710
  873   1HD2  LEU 113          HD23      LEU 113   3.492   3.982  -1.745
  874   2HD2  LEU 113          HD22      LEU 113   3.127   5.542  -2.482
  875   3HD2  LEU 113          HD21      LEU 113   4.604   4.684  -2.921
  876    H    LEU 114           HN       LEU 114   4.527   1.218   0.774
  877    HA   LEU 114           HA       LEU 114   7.284   0.450   1.590
  878   1HB   LEU 114           HB2      LEU 114   4.623  -0.991   1.715
  879   2HB   LEU 114           HB1      LEU 114   6.158  -1.772   2.097
  880    HG   LEU 114           HG       LEU 114   5.360   0.816   3.422
  881   1HD1  LEU 114          HD11      LEU 114   3.566  -0.928   3.743
  882   2HD1  LEU 114          HD13      LEU 114   4.787  -1.967   4.478
  883   3HD1  LEU 114          HD12      LEU 114   4.363  -0.433   5.238
  884   1HD2  LEU 114          HD23      LEU 114   7.211  -1.485   4.121
  885   2HD2  LEU 114          HD22      LEU 114   7.687   0.149   3.656
  886   3HD2  LEU 114          HD21      LEU 114   6.872  -0.128   5.196
  887    H    VAL 115           HN       VAL 115   8.515   0.112  -0.219
  888    HA   VAL 115           HA       VAL 115   7.308  -1.479  -2.442
  889    HB   VAL 115           HB       VAL 115   8.079   0.778  -3.089
  890   1HG1  VAL 115          HG13      VAL 115   9.859   0.905  -1.305
  891   2HG1  VAL 115          HG12      VAL 115  10.849  -0.161  -2.302
  892   3HG1  VAL 115          HG11      VAL 115  10.391   1.434  -2.901
  893   1HG2  VAL 115          HG22      VAL 115   8.407  -1.403  -4.525
  894   2HG2  VAL 115          HG21      VAL 115   9.153   0.105  -5.053
  895   3HG2  VAL 115          HG23      VAL 115  10.120  -1.114  -4.223
  896    H    THR 116           HN       THR 116   8.242  -3.422  -2.975
  897    HA   THR 116           HA       THR 116  10.618  -4.255  -1.364
  898    HB   THR 116           HB       THR 116   8.583  -6.015  -2.766
  899    HG1  THR 116           HG1      THR 116   7.981  -6.372  -0.488
  900   1HG2  THR 116          HG23      THR 116  10.926  -6.504  -0.935
  901   2HG2  THR 116          HG22      THR 116   9.602  -7.665  -1.045
  902   3HG2  THR 116          HG21      THR 116  10.554  -7.274  -2.477
  903    H    ARG 117           HN       ARG 117  12.302  -3.624  -2.721
  904    HA   ARG 117           HA       ARG 117  12.206  -4.248  -5.596
  905   1HB   ARG 117           HB2      ARG 117  14.462  -3.125  -3.904
  906   2HB   ARG 117           HB1      ARG 117  14.417  -3.176  -5.667
  907   1HG   ARG 117           HG2      ARG 117  12.576  -1.647  -5.756
  908   2HG   ARG 117           HG1      ARG 117  12.300  -1.778  -4.019
  909   1HD   ARG 117           HD2      ARG 117  13.481   0.230  -4.149
  910   2HD   ARG 117           HD1      ARG 117  14.780  -0.923  -3.847
  911    HE   ARG 117           HE       ARG 117  14.213   0.406  -6.438
  912   1HH1  ARG 117          HH21      ARG 117  16.065  -1.841  -4.544
  913   2HH1  ARG 117          HH22      ARG 117  17.359  -1.924  -5.694
  914   1HH2  ARG 117          HH11      ARG 117  15.897   0.289  -7.922
  915   2HH2  ARG 117          HH12      ARG 117  17.263  -0.725  -7.596
  916    H    LEU 118           HN       LEU 118  13.323  -5.914  -6.587
  917    HA   LEU 118           HA       LEU 118  14.727  -7.828  -4.765
  918   1HB   LEU 118           HB2      LEU 118  12.772  -8.186  -6.954
  919   2HB   LEU 118           HB1      LEU 118  14.146  -9.289  -7.014
  920    HG   LEU 118           HG       LEU 118  13.718  -9.820  -4.583
  921   1HD1  LEU 118          HD12      LEU 118  12.411  -7.721  -4.145
  922   2HD1  LEU 118          HD11      LEU 118  11.097  -8.390  -5.113
  923   3HD1  LEU 118          HD13      LEU 118  11.583  -9.185  -3.615
  924   1HD2  LEU 118          HD22      LEU 118  12.910 -11.246  -6.477
  925   2HD2  LEU 118          HD21      LEU 118  11.864 -11.331  -5.060
  926   3HD2  LEU 118          HD23      LEU 118  11.387 -10.357  -6.450
  927    H    ALA 119           HN       ALA 119  16.824  -8.353  -5.262
  928    HA   ALA 119           HA       ALA 119  18.260  -6.777  -7.205
  929   1HB   ALA 119           HB1      ALA 119  19.218  -7.758  -5.071
  930   2HB   ALA 119           HB3      ALA 119  19.211  -9.327  -5.876
  931   3HB   ALA 119           HB2      ALA 119  20.204  -8.016  -6.510
  932    H    GLY 120           HN       GLY 120  16.898 -10.030  -7.205
  933   1HA   GLY 120           HA2      GLY 120  18.197 -10.913  -9.629
  934   2HA   GLY 120           HA1      GLY 120  16.763 -11.646  -8.907
  935    H    SER 121           HN       SER 121  17.757 -10.257 -11.670
  936    HA   SER 121           HA       SER 121  15.635  -8.381 -12.245
  937   1HB   SER 121           HB2      SER 121  17.795  -8.459 -13.496
  938   2HB   SER 121           HB1      SER 121  17.311 -10.007 -14.182
  939    HG   SER 121           HG       SER 121  15.393  -8.073 -14.405
  940    H    PHE 122           HN       PHE 122  13.646  -8.749 -13.215
  941    HA   PHE 122           HA       PHE 122  12.969 -11.473 -14.152
  942   1HB   PHE 122           HB2      PHE 122  11.538 -10.066 -11.879
  943   2HB   PHE 122           HB1      PHE 122  10.892 -11.470 -12.730
  944    HD1  PHE 122           HD2      PHE 122  12.602 -13.503 -12.958
  945    HD2  PHE 122           HD1      PHE 122  12.811 -10.432  -9.961
  946    HE1  PHE 122           HE2      PHE 122  13.955 -15.001 -11.517
  947    HE2  PHE 122           HE1      PHE 122  14.162 -11.931  -8.520
  948    HZ   PHE 122           HZ       PHE 122  14.735 -14.216  -9.298
  949    H    GLU 123           HN       GLU 123  12.314 -10.907 -16.184
  950    HA   GLU 123           HA       GLU 123  10.844  -8.410 -16.665
  951   1HB   GLU 123           HB2      GLU 123  12.574  -9.499 -18.241
  952   2HB   GLU 123           HB1      GLU 123  11.286 -10.626 -18.668
  953   1HG   GLU 123           HG2      GLU 123  11.113  -8.886 -20.274
  954   2HG   GLU 123           HG1      GLU 123   9.840  -8.541 -19.103
  955    H    GLY 124           HN       GLY 124   8.664  -8.290 -17.318
  956   1HA   GLY 124           HA2      GLY 124   7.079 -10.799 -17.366
  957   2HA   GLY 124           HA1      GLY 124   6.636  -9.577 -16.173
  958    H    ASP 125           HN       ASP 125   4.935  -8.393 -16.860
  959    HA   ASP 125           HA       ASP 125   4.953  -7.342 -19.639
  960   1HB   ASP 125           HB2      ASP 125   2.767  -9.007 -18.384
  961   2HB   ASP 125           HB1      ASP 125   2.429  -7.883 -19.701
  962    H    THR 126           HN       THR 126   3.157  -7.376 -16.544
  963    HA   THR 126           HA       THR 126   2.212  -4.633 -16.964
  964    HB   THR 126           HB       THR 126   2.102  -6.156 -14.360
  965    HG1  THR 126           HG1      THR 126   1.345  -7.536 -15.973
  966   1HG2  THR 126          HG21      THR 126   1.335  -3.663 -14.853
  967   2HG2  THR 126          HG23      THR 126  -0.085  -4.475 -15.513
  968   3HG2  THR 126          HG22      THR 126   0.367  -4.721 -13.826
  969    H    LYS 127           HN       LYS 127   3.033  -2.790 -15.974
  970    HA   LYS 127           HA       LYS 127   5.552  -3.156 -14.397
  971   1HB   LYS 127           HB2      LYS 127   4.773  -0.950 -16.329
  972   2HB   LYS 127           HB1      LYS 127   6.208  -0.909 -15.304
  973   1HG   LYS 127           HG2      LYS 127   7.129  -2.854 -16.378
  974   2HG   LYS 127           HG1      LYS 127   5.623  -3.156 -17.247
  975   1HD   LYS 127           HD2      LYS 127   5.968  -0.797 -18.257
  976   2HD   LYS 127           HD1      LYS 127   7.629  -0.945 -17.681
  977   1HE   LYS 127           HE2      LYS 127   7.557  -3.274 -18.880
  978   2HE   LYS 127           HE1      LYS 127   6.200  -2.574 -19.765
  979   1HZ   LYS 127           HZ1      LYS 127   8.111  -0.623 -19.777
  980   2HZ   LYS 127           HZ3      LYS 127   8.994  -2.050 -20.022
  981   3HZ   LYS 127           HZ2      LYS 127   7.719  -1.651 -21.071
  982    H    MET 128           HN       MET 128   5.981  -1.072 -13.033
  983    HA   MET 128           HA       MET 128   3.498  -0.530 -11.504
  984   1HB   MET 128           HB2      MET 128   5.948  -1.186 -10.609
  985   2HB   MET 128           HB1      MET 128   6.125   0.570 -10.632
  986   1HG   MET 128           HG2      MET 128   3.663  -0.653  -9.420
  987   2HG   MET 128           HG1      MET 128   5.159  -0.604  -8.488
  988   1HE   MET 128           HE1      MET 128   2.056   0.831  -8.609
  989   2HE   MET 128           HE3      MET 128   2.962   0.793  -7.090
  990   3HE   MET 128           HE2      MET 128   2.353   2.322  -7.720
  991    H    ILE 129           HN       ILE 129   2.751   1.594 -11.125
  992    HA   ILE 129           HA       ILE 129   3.200   3.497 -13.243
  993    HB   ILE 129           HB       ILE 129   1.794   5.010 -11.820
  994   1HG1  ILE 129          HG12      ILE 129   1.708   2.655  -9.915
  995   2HG1  ILE 129          HG11      ILE 129   2.722   4.074  -9.650
  996   1HG2  ILE 129          HG22      ILE 129   0.935   3.085 -13.344
  997   2HG2  ILE 129          HG21      ILE 129   0.580   2.252 -11.830
  998   3HG2  ILE 129          HG23      ILE 129  -0.192   3.797 -12.188
  999   1HD1  ILE 129          HD11      ILE 129  -0.239   4.343 -10.167
 1000   2HD1  ILE 129          HD13      ILE 129   0.385   4.058  -8.542
 1001   3HD1  ILE 129          HD12      ILE 129   0.856   5.510  -9.426
 1002    HA   PRO 130           HA       PRO 130   6.519   5.931 -11.554
 1003   1HB   PRO 130           HB2      PRO 130   5.716   8.451 -12.470
 1004   2HB   PRO 130           HB1      PRO 130   6.634   7.256 -13.395
 1005   1HG   PRO 130           HG2      PRO 130   3.947   8.143 -13.827
 1006   2HG   PRO 130           HG1      PRO 130   4.878   6.969 -14.766
 1007   1HD   PRO 130           HD2      PRO 130   2.773   6.494 -12.793
 1008   2HD   PRO 130           HD1      PRO 130   3.477   5.374 -13.971
 1009    H    LEU 131           HN       LEU 131   6.307   5.987  -9.304
 1010    HA   LEU 131           HA       LEU 131   4.285   7.711  -8.041
 1011   1HB   LEU 131           HB2      LEU 131   6.518   6.025  -6.867
 1012   2HB   LEU 131           HB1      LEU 131   5.305   6.887  -5.920
 1013    HG   LEU 131           HG       LEU 131   4.574   4.874  -8.056
 1014   1HD1  LEU 131          HD13      LEU 131   5.930   3.770  -6.308
 1015   2HD1  LEU 131          HD12      LEU 131   4.871   4.441  -5.067
 1016   3HD1  LEU 131          HD11      LEU 131   4.243   3.262  -6.219
 1017   1HD2  LEU 131          HD22      LEU 131   3.079   6.080  -5.704
 1018   2HD2  LEU 131          HD21      LEU 131   2.820   6.469  -7.405
 1019   3HD2  LEU 131          HD23      LEU 131   2.430   4.859  -6.800
 1020    H    ASN 132           HN       ASN 132   4.694   9.703  -7.124
 1021    HA   ASN 132           HA       ASN 132   7.165  11.061  -7.878
 1022   1HB   ASN 132           HB2      ASN 132   4.758  12.049  -7.686
 1023   2HB   ASN 132           HB1      ASN 132   5.124  12.176  -5.964
 1024   1HD2  ASN 132          HD22      ASN 132   7.696  14.263  -8.404
 1025   2HD2  ASN 132          HD21      ASN 132   7.277  12.669  -8.811
 1026    H    TRP 133           HN       TRP 133   8.722   9.782  -6.676
 1027    HA   TRP 133           HA       TRP 133   8.606   9.465  -3.818
 1028   1HB   TRP 133           HB2      TRP 133  10.969   9.426  -5.720
 1029   2HB   TRP 133           HB1      TRP 133  11.034   8.923  -4.031
 1030    HD1  TRP 133           HD1      TRP 133   9.912   7.800  -7.447
 1031    HE1  TRP 133           HE1      TRP 133   9.023   5.383  -7.309
 1032    HE3  TRP 133           HE3      TRP 133   9.777   7.196  -2.378
 1033    HZ2  TRP 133           HZ2      TRP 133   8.345   3.450  -5.313
 1034    HZ3  TRP 133           HZ3      TRP 133   9.006   5.060  -1.386
 1035    HH2  TRP 133           HH2      TRP 133   8.290   3.188  -2.846
 1036    H    ASP 134           HN       ASP 134   9.379  12.150  -5.829
 1037    HA   ASP 134           HA       ASP 134  11.230  13.545  -4.155
 1038   1HB   ASP 134           HB2      ASP 134   9.375  14.256  -6.370
 1039   2HB   ASP 134           HB1      ASP 134   9.896  15.580  -5.327
 1040    H    ASP 135           HN       ASP 135   7.780  13.064  -3.951
 1041    HA   ASP 135           HA       ASP 135   7.521  15.143  -1.847
 1042   1HB   ASP 135           HB2      ASP 135   5.600  13.529  -3.492
 1043   2HB   ASP 135           HB1      ASP 135   5.058  14.183  -1.947
 1044    H    PHE 136           HN       PHE 136   9.088  12.660  -1.438
 1045    HA   PHE 136           HA       PHE 136   7.706  11.765   1.028
 1046   1HB   PHE 136           HB2      PHE 136   8.671   9.930  -1.180
 1047   2HB   PHE 136           HB1      PHE 136   8.328   9.373   0.458
 1048    HD1  PHE 136           HD1      PHE 136   5.987  10.009   1.434
 1049    HD2  PHE 136           HD2      PHE 136   6.938  10.038  -2.754
 1050    HE1  PHE 136           HE1      PHE 136   3.573   9.874   0.886
 1051    HE2  PHE 136           HE2      PHE 136   4.523   9.904  -3.303
 1052    HZ   PHE 136           HZ       PHE 136   2.840   9.822  -1.484
 1053    H    THR 137           HN       THR 137   9.349  10.176   2.212
 1054    HA   THR 137           HA       THR 137  12.172  10.835   1.694
 1055    HB   THR 137           HB       THR 137  10.978  11.528   4.386
 1056    HG1  THR 137           HG1      THR 137  10.929  13.629   3.698
 1057   1HG2  THR 137          HG21      THR 137  13.636  11.912   3.018
 1058   2HG2  THR 137          HG23      THR 137  13.153  12.931   4.374
 1059   3HG2  THR 137          HG22      THR 137  13.302  11.187   4.591
 1060    H    LYS 138           HN       LYS 138  13.410   9.099   2.253
 1061    HA   LYS 138           HA       LYS 138  12.168   6.727   3.359
 1062   1HB   LYS 138           HB2      LYS 138  14.164   6.893   1.709
 1063   2HB   LYS 138           HB1      LYS 138  15.146   7.159   3.150
 1064   1HG   LYS 138           HG2      LYS 138  14.571   5.039   4.063
 1065   2HG   LYS 138           HG1      LYS 138  13.244   4.822   2.923
 1066   1HD   LYS 138           HD2      LYS 138  15.034   3.453   2.118
 1067   2HD   LYS 138           HD1      LYS 138  14.995   4.871   1.070
 1068   1HE   LYS 138           HE2      LYS 138  17.276   4.687   1.593
 1069   2HE   LYS 138           HE1      LYS 138  16.706   5.875   2.766
 1070   1HZ   LYS 138           HZ3      LYS 138  16.238   3.634   4.096
 1071   2HZ   LYS 138           HZ2      LYS 138  17.570   3.128   3.171
 1072   3HZ   LYS 138           HZ1      LYS 138  17.707   4.475   4.197
 1073    H    VAL 139           HN       VAL 139  11.731   6.511   5.492
 1074    HA   VAL 139           HA       VAL 139  13.345   8.018   7.473
 1075    HB   VAL 139           HB       VAL 139  11.578   7.245   9.078
 1076   1HG1  VAL 139          HG11      VAL 139  11.470   9.356   7.568
 1077   2HG1  VAL 139          HG13      VAL 139  10.265   8.455   6.648
 1078   3HG1  VAL 139          HG12      VAL 139   9.982   8.822   8.350
 1079   1HG2  VAL 139          HG23      VAL 139  10.462   6.008   6.543
 1080   2HG2  VAL 139          HG22      VAL 139  10.918   5.166   8.025
 1081   3HG2  VAL 139          HG21      VAL 139   9.519   6.241   8.015
 1082    H    SER 140           HN       SER 140  12.504   4.704   6.556
 1083    HA   SER 140           HA       SER 140  14.904   3.723   7.947
 1084   1HB   SER 140           HB2      SER 140  13.594   1.986   9.194
 1085   2HB   SER 140           HB1      SER 140  13.289   3.626   9.760
 1086    HG   SER 140           HG       SER 140  11.281   3.181   9.348
 1087    H    SER 141           HN       SER 141  14.846   1.142   7.658
 1088    HA   SER 141           HA       SER 141  13.425   0.171   5.315
 1089   1HB   SER 141           HB2      SER 141  15.086   1.512   4.143
 1090   2HB   SER 141           HB1      SER 141  16.384   0.801   5.098
 1091    HG   SER 141           HG       SER 141  15.182  -0.124   2.869
 1092    H    ARG 142           HN       ARG 142  13.989  -2.106   4.873
 1093    HA   ARG 142           HA       ARG 142  15.549  -3.402   7.065
 1094   1HB   ARG 142           HB2      ARG 142  13.013  -3.484   7.418
 1095   2HB   ARG 142           HB1      ARG 142  12.952  -4.525   5.995
 1096   1HG   ARG 142           HG2      ARG 142  14.457  -6.130   7.057
 1097   2HG   ARG 142           HG1      ARG 142  14.635  -5.072   8.457
 1098   1HD   ARG 142           HD2      ARG 142  12.065  -5.221   8.662
 1099   2HD   ARG 142           HD1      ARG 142  12.188  -6.594   7.561
 1100    HE   ARG 142           HE       ARG 142  13.037  -6.551  10.363
 1101   1HH1  ARG 142          HH21      ARG 142  13.398  -8.028   7.239
 1102   2HH1  ARG 142          HH22      ARG 142  13.991  -9.523   7.883
 1103   1HH2  ARG 142          HH11      ARG 142  13.807  -8.495  11.186
 1104   2HH2  ARG 142          HH12      ARG 142  14.220  -9.785  10.107
 1105    H    THR 143           HN       THR 143  17.277  -4.048   5.800
 1106    HA   THR 143           HA       THR 143  16.862  -5.196   3.134
 1107    HB   THR 143           HB       THR 143  19.434  -5.309   4.710
 1108    HG1  THR 143           HG1      THR 143  19.552  -3.191   3.292
 1109   1HG2  THR 143          HG23      THR 143  19.164  -6.446   2.465
 1110   2HG2  THR 143          HG22      THR 143  18.911  -4.847   1.765
 1111   3HG2  THR 143          HG21      THR 143  20.450  -5.240   2.532
 1112    H    VAL 144           HN       VAL 144  17.383  -7.400   2.581
 1113    HA   VAL 144           HA       VAL 144  17.877  -9.336   4.730
 1114    HB   VAL 144           HB       VAL 144  15.436  -8.998   4.893
 1115   1HG1  VAL 144          HG12      VAL 144  15.191  -8.299   2.468
 1116   2HG1  VAL 144          HG11      VAL 144  15.287 -10.008   2.043
 1117   3HG1  VAL 144          HG13      VAL 144  13.960  -9.422   3.046
 1118   1HG2  VAL 144          HG21      VAL 144  16.577 -11.306   5.107
 1119   2HG2  VAL 144          HG23      VAL 144  14.829 -11.290   4.872
 1120   3HG2  VAL 144          HG22      VAL 144  15.897 -11.647   3.515
 1121    H    GLU 145           HN       GLU 145  19.156 -10.900   3.882
 1122    HA   GLU 145           HA       GLU 145  19.251 -11.176   0.913
 1123   1HB   GLU 145           HB2      GLU 145  21.347 -10.597   2.285
 1124   2HB   GLU 145           HB1      GLU 145  21.275 -12.257   2.879
 1125   1HG   GLU 145           HG2      GLU 145  21.501 -13.149   0.658
 1126   2HG   GLU 145           HG1      GLU 145  21.289 -11.553  -0.065
 1127    H    ASP 146           HN       ASP 146  18.298 -12.956   0.074
 1128    HA   ASP 146           HA       ASP 146  17.402 -15.128   1.820
 1129   1HB   ASP 146           HB2      ASP 146  16.238 -14.130  -0.315
 1130   2HB   ASP 146           HB1      ASP 146  17.297 -15.243  -1.182
 1131    H    THR 147           HN       THR 147  17.736 -17.374   0.210
 1132    HA   THR 147           HA       THR 147  20.475 -18.101   0.809
 1133    HB   THR 147           HB       THR 147  19.778 -20.205  -0.550
 1134    HG1  THR 147           HG1      THR 147  17.904 -18.701  -1.315
 1135   1HG2  THR 147          HG21      THR 147  18.225 -19.355   1.911
 1136   2HG2  THR 147          HG23      THR 147  18.416 -21.015   1.348
 1137   3HG2  THR 147          HG22      THR 147  19.821 -20.106   1.907
 1138    H    ASN 148           HN       ASN 148  18.710 -17.231  -2.136
 1139    HA   ASN 148           HA       ASN 148  21.244 -17.497  -3.683
 1140   1HB   ASN 148           HB2      ASN 148  19.113 -18.654  -4.475
 1141   2HB   ASN 148           HB1      ASN 148  18.466 -17.045  -4.796
 1142   1HD2  ASN 148          HD22      ASN 148  21.357 -18.589  -7.243
 1143   2HD2  ASN 148          HD21      ASN 148  20.973 -19.367  -5.784
 1144    HA   PRO 149           HA       PRO 149  21.957 -13.096  -3.641
 1145   1HB   PRO 149           HB2      PRO 149  22.707 -13.119  -6.448
 1146   2HB   PRO 149           HB1      PRO 149  23.734 -12.895  -5.026
 1147   1HG   PRO 149           HG2      PRO 149  23.466 -15.218  -6.684
 1148   2HG   PRO 149           HG1      PRO 149  24.545 -14.965  -5.306
 1149   1HD   PRO 149           HD2      PRO 149  22.338 -16.696  -5.387
 1150   2HD   PRO 149           HD1      PRO 149  23.227 -16.197  -3.941
 1151    H    ALA 150           HN       ALA 150  20.426 -14.401  -6.601
 1152    HA   ALA 150           HA       ALA 150  19.123 -11.985  -7.381
 1153   1HB   ALA 150           HB2      ALA 150  19.394 -14.028  -8.819
 1154   2HB   ALA 150           HB1      ALA 150  18.146 -14.816  -7.854
 1155   3HB   ALA 150           HB3      ALA 150  17.751 -13.386  -8.810
 1156    H    LEU 151           HN       LEU 151  18.295 -14.437  -5.015
 1157    HA   LEU 151           HA       LEU 151  15.541 -13.501  -4.688
 1158   1HB   LEU 151           HB2      LEU 151  17.302 -15.468  -3.229
 1159   2HB   LEU 151           HB1      LEU 151  15.736 -14.988  -2.571
 1160    HG   LEU 151           HG       LEU 151  16.092 -16.027  -5.391
 1161   1HD1  LEU 151          HD12      LEU 151  16.746 -17.687  -3.578
 1162   2HD1  LEU 151          HD11      LEU 151  15.085 -17.577  -2.993
 1163   3HD1  LEU 151          HD13      LEU 151  15.411 -18.194  -4.613
 1164   1HD2  LEU 151          HD22      LEU 151  13.739 -15.469  -3.574
 1165   2HD2  LEU 151          HD21      LEU 151  14.058 -14.797  -5.173
 1166   3HD2  LEU 151          HD23      LEU 151  13.596 -16.491  -5.004
 1167    H    THR 152           HN       THR 152  18.009 -11.704  -4.249
 1168    HA   THR 152           HA       THR 152  17.686 -10.993  -1.393
 1169    HB   THR 152           HB       THR 152  19.431  -9.704  -3.515
 1170    HG1  THR 152           HG1      THR 152  21.057 -10.971  -2.345
 1171   1HG2  THR 152          HG22      THR 152  18.778  -8.533  -1.257
 1172   2HG2  THR 152          HG21      THR 152  19.918  -9.679  -0.552
 1173   3HG2  THR 152          HG23      THR 152  20.463  -8.535  -1.779
 1174    H    HIS 153           HN       HIS 153  16.566  -9.192  -0.710
 1175    HA   HIS 153           HA       HIS 153  15.743  -7.130  -2.653
 1176   1HB   HIS 153           HB2      HIS 153  13.330  -7.368  -1.998
 1177   2HB   HIS 153           HB1      HIS 153  13.943  -8.742  -2.917
 1178    HD1  HIS 153           HD1      HIS 153  14.840 -10.810  -1.326
 1179    HD2  HIS 153           HD2      HIS 153  12.189  -8.102   0.413
 1180    HE1  HIS 153           HE1      HIS 153  13.900 -11.948   0.732
 1181    H    THR 154           HN       THR 154  14.461  -5.372  -1.448
 1182    HA   THR 154           HA       THR 154  15.139  -5.267   1.448
 1183    HB   THR 154           HB       THR 154  15.699  -2.969  -0.443
 1184    HG1  THR 154           HG1      THR 154  17.918  -3.609  -0.012
 1185   1HG2  THR 154          HG23      THR 154  15.266  -2.801   2.171
 1186   2HG2  THR 154          HG22      THR 154  16.939  -3.355   2.251
 1187   3HG2  THR 154          HG21      THR 154  16.544  -1.859   1.402
 1188    H    TYR 155           HN       TYR 155  13.558  -4.258   2.652
 1189    HA   TYR 155           HA       TYR 155  11.146  -3.352   1.180
 1190   1HB   TYR 155           HB2      TYR 155  11.595  -3.915   4.128
 1191   2HB   TYR 155           HB1      TYR 155  10.047  -3.472   3.404
 1192    HD1  TYR 155           HD2      TYR 155   8.864  -5.014   1.903
 1193    HD2  TYR 155           HD1      TYR 155  12.578  -6.111   3.762
 1194    HE1  TYR 155           HE2      TYR 155   8.460  -7.388   1.308
 1195    HE2  TYR 155           HE1      TYR 155  12.174  -8.485   3.168
 1196    HH   TYR 155           HH       TYR 155   9.121  -9.570   1.913
 1197    H    GLU 156           HN       GLU 156  11.700  -1.247   0.532
 1198    HA   GLU 156           HA       GLU 156  12.885   0.667   2.381
 1199   1HB   GLU 156           HB2      GLU 156  11.671   0.877  -0.378
 1200   2HB   GLU 156           HB1      GLU 156  12.189   2.307   0.516
 1201   1HG   GLU 156           HG2      GLU 156  14.427   1.023   0.837
 1202   2HG   GLU 156           HG1      GLU 156  13.861   0.012  -0.494
 1203    H    VAL 157           HN       VAL 157  11.804   1.926   3.821
 1204    HA   VAL 157           HA       VAL 157   8.820   2.026   3.613
 1205    HB   VAL 157           HB       VAL 157  10.534   2.398   6.088
 1206   1HG1  VAL 157          HG11      VAL 157   7.567   2.238   5.550
 1207   2HG1  VAL 157          HG13      VAL 157   8.234   1.888   7.145
 1208   3HG1  VAL 157          HG12      VAL 157   8.455   3.484   6.428
 1209   1HG2  VAL 157          HG21      VAL 157   9.321  -0.012   4.794
 1210   2HG2  VAL 157          HG23      VAL 157  10.821   0.131   5.710
 1211   3HG2  VAL 157          HG22      VAL 157   9.273   0.090   6.554
 1212    H    TRP 158           HN       TRP 158   8.431   3.944   2.554
 1213    HA   TRP 158           HA       TRP 158   9.917   6.374   3.431
 1214   1HB   TRP 158           HB2      TRP 158   8.151   5.841   1.023
 1215   2HB   TRP 158           HB1      TRP 158   8.866   7.409   1.395
 1216    HD1  TRP 158           HD1      TRP 158  10.075   3.757   0.940
 1217    HE1  TRP 158           HE1      TRP 158  12.369   3.817  -0.237
 1218    HE3  TRP 158           HE3      TRP 158  10.754   8.806   0.589
 1219    HZ2  TRP 158           HZ2      TRP 158  14.243   5.751  -1.199
 1220    HZ3  TRP 158           HZ3      TRP 158  12.802   9.729  -0.460
 1221    HH2  TRP 158           HH2      TRP 158  14.545   8.210  -1.353
 1222    H    GLN 159           HN       GLN 159   8.580   8.382   3.692
 1223    HA   GLN 159           HA       GLN 159   5.768   7.854   4.514
 1224   1HB   GLN 159           HB2      GLN 159   7.958   9.043   6.228
 1225   2HB   GLN 159           HB1      GLN 159   6.250   9.344   6.553
 1226   1HG   GLN 159           HG2      GLN 159   7.307   6.538   6.208
 1227   2HG   GLN 159           HG1      GLN 159   7.355   7.351   7.774
 1228   1HE2  GLN 159          HE22      GLN 159   3.813   7.232   8.241
 1229   2HE2  GLN 159          HE21      GLN 159   5.236   8.026   8.715
 1230    H    LYS 160           HN       LYS 160   4.413   9.670   4.275
 1231    HA   LYS 160           HA       LYS 160   5.226  11.641   2.346
 1232   1HB   LYS 160           HB2      LYS 160   2.853  10.797   2.814
 1233   2HB   LYS 160           HB1      LYS 160   2.852  11.883   4.204
 1234   1HG   LYS 160           HG2      LYS 160   3.207  13.809   2.789
 1235   2HG   LYS 160           HG1      LYS 160   3.460  12.784   1.376
 1236   1HD   LYS 160           HD2      LYS 160   1.107  11.906   1.717
 1237   2HD   LYS 160           HD1      LYS 160   0.889  13.172   2.926
 1238   1HE   LYS 160           HE2      LYS 160   1.695  14.796   1.077
 1239   2HE   LYS 160           HE1      LYS 160   1.361  13.470  -0.037
 1240   1HZ   LYS 160           HZ3      LYS 160  -0.844  13.562   1.551
 1241   2HZ   LYS 160           HZ2      LYS 160  -0.460  15.203   1.334
 1242   3HZ   LYS 160           HZ1      LYS 160  -0.724  14.203  -0.014
 1243    H    LYS 161           HN       LYS 161   6.565  13.315   2.784
 1244    HA   LYS 161           HA       LYS 161   6.054  15.111   5.012
 1245   1HB   LYS 161           HB2      LYS 161   7.355  13.151   6.031
 1246   2HB   LYS 161           HB1      LYS 161   8.722  13.687   5.054
 1247   1HG   LYS 161           HG2      LYS 161   8.257  16.027   6.097
 1248   2HG   LYS 161           HG1      LYS 161   7.339  15.130   7.308
 1249   1HD   LYS 161           HD2      LYS 161   9.485  13.634   7.444
 1250   2HD   LYS 161           HD1      LYS 161  10.283  15.024   6.710
 1251   1HE   LYS 161           HE2      LYS 161   9.116  16.408   8.568
 1252   2HE   LYS 161           HE1      LYS 161   8.874  14.856   9.369
 1253   1HZ   LYS 161           HZ1      LYS 161  11.519  15.774   8.400
 1254   2HZ   LYS 161           HZ3      LYS 161  10.961  16.076   9.974
 1255   3HZ   LYS 161           HZ2      LYS 161  11.184  14.477   9.445
 1256    H    ALA 162           HN       ALA 162   6.325  17.011   3.955
 1257    HA   ALA 162           HA       ALA 162   8.265  17.220   1.743
 1258   1HB   ALA 162           HB1      ALA 162   6.003  18.224   1.530
 1259   2HB   ALA 162           HB3      ALA 162   6.367  19.293   2.886
 1260   3HB   ALA 162           HB2      ALA 162   7.275  19.436   1.380
 1261   1H9   TMQ 170           H91      TMQ 170   0.009 -10.520  -6.144
 1262   2H9   TMQ 170           H92      TMQ 170  -0.832 -11.326  -4.810
 1263    HN1  TMQ 170           H1N      TMQ 170   1.253 -12.475  -6.496
 1264   1H17  TMQ 170           HM1      TMQ 170  -1.079  -9.126  -4.894
 1265   2H17  TMQ 170           HM2      TMQ 170  -1.201  -8.312  -3.336
 1266   3H17  TMQ 170           HM3      TMQ 170  -0.330  -7.545  -4.672
 1267   1H21  TMQ 170          HW11      TMQ 170   0.054 -13.392  -1.259
 1268   2H21  TMQ 170          HW12      TMQ 170  -1.118 -13.908  -0.038
 1269   3H21  TMQ 170          HW13      TMQ 170  -1.643 -12.908  -1.401
 1270   1H22  TMQ 170           HI1      TMQ 170   0.363 -16.833  -1.581
 1271   2H22  TMQ 170           HI2      TMQ 170   0.004 -18.548  -1.835
 1272   3H22  TMQ 170           HI3      TMQ 170   1.183 -17.728  -2.870
 1273   1H23  TMQ 170          HW21      TMQ 170   2.268 -16.903  -6.379
 1274   2H23  TMQ 170          HW22      TMQ 170   1.012 -16.656  -7.602
 1275   3H23  TMQ 170          HW23      TMQ 170   1.529 -18.296  -7.182
 1276   1HN2  TMQ 170          HN21      TMQ 170   5.278  -7.561   0.149
 1277   2HN2  TMQ 170          HN22      TMQ 170   4.326  -6.130   0.351
 1278   1HN5  TMQ 170          HN41      TMQ 170   0.429  -5.495  -1.826
 1279   2HN5  TMQ 170          HN42      TMQ 170  -0.275  -6.603  -2.921
 1280    HN   TMQ 170           H1       TMQ 170   4.568  -9.210  -1.262
 1281    H7   TMQ 170           H7       TMQ 170   2.471 -12.091  -4.285
 1282    H8   TMQ 170           H8       TMQ 170   4.028 -11.076  -2.686
 1283    H12  TMQ 170           HP2      TMQ 170  -0.456 -12.671  -3.293
 1284    H16  TMQ 170           HP6      TMQ 170   0.940 -14.850  -6.753
   
  No H/Q in entry =        1284
  Start of MODEL    8
    1   1H    THR   1           HT2      THR   1  -3.033   6.218   4.673
    2   2H    THR   1           HT1      THR   1  -3.589   7.181   3.389
    3   3H    THR   1           HT3      THR   1  -4.700   6.389   4.397
    4    HA   THR   1           HA       THR   1  -4.474   4.414   3.370
    5    HB   THR   1           HB       THR   1  -3.218   6.117   1.204
    6    HG1  THR   1           HG1      THR   1  -5.320   6.749   2.509
    7   1HG2  THR   1          HG22      THR   1  -5.092   3.737   1.205
    8   2HG2  THR   1          HG21      THR   1  -4.652   4.654  -0.236
    9   3HG2  THR   1          HG23      THR   1  -3.417   3.761   0.652
   10    H    ALA   2           HN       ALA   2  -3.048   2.763   2.405
   11    HA   ALA   2           HA       ALA   2  -0.139   3.289   2.841
   12   1HB   ALA   2           HB3      ALA   2  -1.049   2.073   4.799
   13   2HB   ALA   2           HB2      ALA   2  -1.653   0.812   3.725
   14   3HB   ALA   2           HB1      ALA   2   0.084   1.072   3.889
   15    H    PHE   3           HN       PHE   3   1.047   2.681   1.098
   16    HA   PHE   3           HA       PHE   3  -0.267   0.980  -0.967
   17   1HB   PHE   3           HB2      PHE   3   1.926   3.039  -1.032
   18   2HB   PHE   3           HB1      PHE   3   1.811   1.835  -2.316
   19    HD1  PHE   3           HD2      PHE   3  -0.688   3.836  -0.344
   20    HD2  PHE   3           HD1      PHE   3   0.765   2.665  -4.213
   21    HE1  PHE   3           HE2      PHE   3  -2.497   5.146  -1.420
   22    HE2  PHE   3           HE1      PHE   3  -1.044   3.976  -5.289
   23    HZ   PHE   3           HZ       PHE   3  -2.675   5.215  -3.894
   24    H    LEU   4           HN       LEU   4   0.604  -0.990  -1.529
   25    HA   LEU   4           HA       LEU   4   3.314  -1.726  -0.604
   26   1HB   LEU   4           HB2      LEU   4   1.763  -2.297   1.280
   27   2HB   LEU   4           HB1      LEU   4   0.874  -3.351   0.180
   28    HG   LEU   4           HG       LEU   4   3.272  -4.373  -0.274
   29   1HD1  LEU   4          HD11      LEU   4   3.552  -2.812   2.270
   30   2HD1  LEU   4          HD13      LEU   4   4.380  -4.363   2.129
   31   3HD1  LEU   4          HD12      LEU   4   4.729  -3.068   0.982
   32   1HD2  LEU   4          HD23      LEU   4   1.142  -5.329   0.919
   33   2HD2  LEU   4          HD22      LEU   4   2.694  -6.127   1.171
   34   3HD2  LEU   4          HD21      LEU   4   2.055  -5.033   2.398
   35    H    TRP   5           HN       TRP   5   4.163  -2.441  -2.507
   36    HA   TRP   5           HA       TRP   5   2.668  -4.536  -3.988
   37   1HB   TRP   5           HB2      TRP   5   3.129  -3.445  -6.148
   38   2HB   TRP   5           HB1      TRP   5   2.154  -2.398  -5.119
   39    HD1  TRP   5           HD1      TRP   5   5.237  -2.428  -7.124
   40    HE1  TRP   5           HE1      TRP   5   6.653  -0.325  -6.669
   41    HE3  TRP   5           HE3      TRP   5   2.894  -0.670  -2.937
   42    HZ2  TRP   5           HZ2      TRP   5   6.780   1.817  -4.782
   43    HZ3  TRP   5           HZ3      TRP   5   3.687   1.401  -1.832
   44    HH2  TRP   5           HH2      TRP   5   5.624   2.647  -2.749
   45    H    ALA   6           HN       ALA   6   4.049  -5.936  -5.217
   46    HA   ALA   6           HA       ALA   6   6.876  -5.884  -4.290
   47   1HB   ALA   6           HB3      ALA   6   5.453  -7.954  -3.982
   48   2HB   ALA   6           HB2      ALA   6   5.412  -8.109  -5.738
   49   3HB   ALA   6           HB1      ALA   6   6.947  -8.226  -4.877
   50    H    GLN   7           HN       GLN   7   8.216  -4.840  -5.682
   51    HA   GLN   7           HA       GLN   7   7.918  -5.418  -8.598
   52   1HB   GLN   7           HB2      GLN   7   8.618  -3.048  -9.033
   53   2HB   GLN   7           HB1      GLN   7   7.045  -3.176  -8.245
   54   1HG   GLN   7           HG2      GLN   7   7.852  -2.414  -6.201
   55   2HG   GLN   7           HG1      GLN   7   9.504  -2.932  -6.545
   56   1HE2  GLN   7          HE22      GLN   7  10.276   0.008  -8.478
   57   2HE2  GLN   7          HE21      GLN   7  10.649  -1.641  -8.334
   58    H    ASP   8           HN       ASP   8   9.910  -5.462  -9.760
   59    HA   ASP   8           HA       ASP   8  12.295  -5.816  -8.010
   60   1HB   ASP   8           HB2      ASP   8  13.257  -6.965 -10.048
   61   2HB   ASP   8           HB1      ASP   8  11.843  -7.762  -9.359
   62    H    ARG   9           HN       ARG   9  14.421  -5.172  -9.190
   63    HA   ARG   9           HA       ARG   9  14.403  -2.357  -9.649
   64   1HB   ARG   9           HB2      ARG   9  16.747  -2.716 -10.465
   65   2HB   ARG   9           HB1      ARG   9  16.428  -3.480  -8.908
   66   1HG   ARG   9           HG2      ARG   9  16.075  -5.639 -10.002
   67   2HG   ARG   9           HG1      ARG   9  16.294  -4.896 -11.586
   68   1HD   ARG   9           HD2      ARG   9  18.426  -4.724  -9.456
   69   2HD   ARG   9           HD1      ARG   9  18.336  -6.094 -10.563
   70    HE   ARG   9           HE       ARG   9  18.288  -3.536 -11.953
   71   1HH1  ARG   9          HH11      ARG   9  20.298  -5.960 -10.483
   72   2HH1  ARG   9          HH12      ARG   9  21.685  -5.560 -11.442
   73   1HH2  ARG   9          HH21      ARG   9  20.094  -3.028 -13.190
   74   2HH2  ARG   9          HH22      ARG   9  21.569  -3.910 -12.966
   75    H    ASP  10           HN       ASP  10  13.710  -4.996 -11.757
   76    HA   ASP  10           HA       ASP  10  14.361  -3.615 -14.242
   77   1HB   ASP  10           HB2      ASP  10  12.868  -6.138 -13.543
   78   2HB   ASP  10           HB1      ASP  10  12.849  -5.506 -15.189
   79    H    GLY  11           HN       GLY  11  12.307  -2.589 -12.089
   80   1HA   GLY  11           HA2      GLY  11  10.362  -1.280 -12.159
   81   2HA   GLY  11           HA1      GLY  11  10.631  -1.149 -13.897
   82    H    LEU  12           HN       LEU  12  10.120  -4.151 -12.087
   83    HA   LEU  12           HA       LEU  12   7.683  -4.619 -13.751
   84   1HB   LEU  12           HB2      LEU  12   9.826  -6.208 -13.634
   85   2HB   LEU  12           HB1      LEU  12   8.990  -6.818 -12.205
   86    HG   LEU  12           HG       LEU  12   6.911  -7.027 -13.661
   87   1HD1  LEU  12          HD12      LEU  12   9.004  -6.455 -15.773
   88   2HD1  LEU  12          HD11      LEU  12   7.466  -7.241 -16.134
   89   3HD1  LEU  12          HD13      LEU  12   7.489  -5.595 -15.499
   90   1HD2  LEU  12          HD23      LEU  12   8.601  -8.882 -13.039
   91   2HD2  LEU  12          HD22      LEU  12   7.539  -9.189 -14.412
   92   3HD2  LEU  12          HD21      LEU  12   9.211  -8.700 -14.684
   93    H    ILE  13           HN       ILE  13   5.974  -5.974 -12.601
   94    HA   ILE  13           HA       ILE  13   5.889  -5.502  -9.666
   95    HB   ILE  13           HB       ILE  13   3.533  -4.670  -9.891
   96   1HG1  ILE  13          HG12      ILE  13   4.250  -4.387 -12.824
   97   2HG1  ILE  13          HG11      ILE  13   3.209  -5.662 -12.190
   98   1HG2  ILE  13          HG21      ILE  13   5.668  -3.065 -11.329
   99   2HG2  ILE  13          HG23      ILE  13   4.175  -2.402 -10.666
  100   3HG2  ILE  13          HG22      ILE  13   5.390  -3.089  -9.589
  101   1HD1  ILE  13          HD13      ILE  13   2.595  -2.809 -11.501
  102   2HD1  ILE  13          HD12      ILE  13   2.149  -3.419 -13.094
  103   3HD1  ILE  13          HD11      ILE  13   1.499  -4.182 -11.643
  104    H    GLY  14           HN       GLY  14   4.707  -7.171 -12.524
  105   1HA   GLY  14           HA2      GLY  14   4.250  -9.605 -11.025
  106   2HA   GLY  14           HA1      GLY  14   2.728  -8.843 -11.487
  107    H    LYS  15           HN       LYS  15   2.558 -10.944 -12.751
  108    HA   LYS  15           HA       LYS  15   3.071 -10.450 -15.536
  109   1HB   LYS  15           HB2      LYS  15   5.375 -11.128 -14.694
  110   2HB   LYS  15           HB1      LYS  15   4.693 -12.720 -14.360
  111   1HG   LYS  15           HG2      LYS  15   3.883 -12.689 -16.808
  112   2HG   LYS  15           HG1      LYS  15   5.002 -11.343 -17.028
  113   1HD   LYS  15           HD2      LYS  15   6.882 -12.700 -16.361
  114   2HD   LYS  15           HD1      LYS  15   5.820 -14.021 -15.874
  115   1HE   LYS  15           HE2      LYS  15   6.548 -14.699 -18.003
  116   2HE   LYS  15           HE1      LYS  15   4.987 -13.952 -18.342
  117   1HZ   LYS  15           HZ3      LYS  15   6.161 -11.879 -18.852
  118   2HZ   LYS  15           HZ2      LYS  15   7.649 -12.660 -18.600
  119   3HZ   LYS  15           HZ1      LYS  15   6.637 -13.145 -19.876
  120    H    ASP  16           HN       ASP  16   1.209 -11.281 -16.332
  121    HA   ASP  16           HA       ASP  16  -0.567 -12.759 -16.725
  122   1HB   ASP  16           HB2      ASP  16   1.736 -14.505 -16.025
  123   2HB   ASP  16           HB1      ASP  16   0.138 -15.248 -15.945
  124    H    GLY  17           HN       GLY  17  -0.398 -11.356 -14.167
  125   1HA   GLY  17           HA2      GLY  17  -1.964 -11.342 -12.359
  126   2HA   GLY  17           HA1      GLY  17  -2.290 -13.050 -12.659
  127    H    HIS  18           HN       HIS  18  -0.115 -14.417 -12.349
  128    HA   HIS  18           HA       HIS  18   0.609 -14.096  -9.551
  129   1HB   HIS  18           HB2      HIS  18   2.079 -16.082  -9.994
  130   2HB   HIS  18           HB1      HIS  18   0.400 -16.338 -10.468
  131    HD1  HIS  18           HD1      HIS  18   3.754 -15.415 -12.004
  132    HD2  HIS  18           HD2      HIS  18   0.051 -16.936 -13.167
  133    HE1  HIS  18           HE1      HIS  18   3.987 -16.083 -14.436
  134    H    LEU  19           HN       LEU  19   3.036 -14.215  -8.955
  135    HA   LEU  19           HA       LEU  19   4.359 -11.915 -10.184
  136   1HB   LEU  19           HB2      LEU  19   4.984 -13.753  -7.880
  137   2HB   LEU  19           HB1      LEU  19   6.207 -12.638  -8.491
  138    HG   LEU  19           HG       LEU  19   3.425 -11.704  -7.779
  139   1HD1  LEU  19          HD11      LEU  19   5.747 -12.340  -6.015
  140   2HD1  LEU  19          HD13      LEU  19   4.857 -10.855  -5.679
  141   3HD1  LEU  19          HD12      LEU  19   4.019 -12.407  -5.666
  142   1HD2  LEU  19          HD23      LEU  19   6.083 -10.470  -8.421
  143   2HD2  LEU  19          HD22      LEU  19   4.474 -10.008  -8.976
  144   3HD2  LEU  19          HD21      LEU  19   4.989  -9.609  -7.338
  145    HA   PRO  20           HA       PRO  20   7.038 -14.184 -12.923
  146   1HB   PRO  20           HB2      PRO  20   9.169 -12.374 -12.952
  147   2HB   PRO  20           HB1      PRO  20   7.725 -12.287 -13.967
  148   1HG   PRO  20           HG2      PRO  20   8.507 -10.536 -11.836
  149   2HG   PRO  20           HG1      PRO  20   7.093 -10.421 -12.893
  150   1HD   PRO  20           HD2      PRO  20   7.242 -11.340 -10.129
  151   2HD   PRO  20           HD1      PRO  20   5.816 -10.939 -11.099
  152    H    TRP  21           HN       TRP  21   8.338 -13.048  -9.852
  153    HA   TRP  21           HA       TRP  21  10.492 -15.108 -10.010
  154   1HB   TRP  21           HB2      TRP  21  11.465 -13.877  -8.051
  155   2HB   TRP  21           HB1      TRP  21  11.331 -12.883  -9.501
  156    HD1  TRP  21           HD1      TRP  21   9.619 -13.482  -6.117
  157    HE1  TRP  21           HE1      TRP  21   8.253 -11.382  -5.508
  158    HE3  TRP  21           HE3      TRP  21  10.190 -10.780 -10.413
  159    HZ2  TRP  21           HZ2      TRP  21   7.502  -8.886  -6.686
  160    HZ3  TRP  21           HZ3      TRP  21   9.140  -8.547 -10.642
  161    HH2  TRP  21           HH2      TRP  21   7.798  -7.597  -8.787
  162    H    HIS  22           HN       HIS  22  10.961 -15.654  -7.397
  163    HA   HIS  22           HA       HIS  22   8.357 -16.473  -6.204
  164   1HB   HIS  22           HB2      HIS  22   9.416 -18.339  -7.604
  165   2HB   HIS  22           HB1      HIS  22  10.705 -18.369  -6.401
  166    HD1  HIS  22           HD1      HIS  22   6.879 -18.366  -6.303
  167    HD2  HIS  22           HD2      HIS  22  10.123 -20.179  -4.414
  168    HE1  HIS  22           HE1      HIS  22   5.910 -19.968  -4.598
  169    H    LEU  23           HN       LEU  23   8.511 -15.227  -4.364
  170    HA   LEU  23           HA       LEU  23  10.953 -15.622  -2.680
  171   1HB   LEU  23           HB2      LEU  23  10.510 -13.275  -3.764
  172   2HB   LEU  23           HB1      LEU  23   9.275 -13.131  -2.512
  173    HG   LEU  23           HG       LEU  23  11.018 -13.680  -0.800
  174   1HD1  LEU  23          HD11      LEU  23  12.706 -13.743  -3.289
  175   2HD1  LEU  23          HD13      LEU  23  13.427 -13.259  -1.755
  176   3HD1  LEU  23          HD12      LEU  23  12.701 -14.857  -1.922
  177   1HD2  LEU  23          HD23      LEU  23  10.437 -11.285  -1.913
  178   2HD2  LEU  23          HD22      LEU  23  11.619 -11.470  -0.617
  179   3HD2  LEU  23          HD21      LEU  23  12.158 -11.369  -2.292
  180    HA   PRO  24           HA       PRO  24   7.267 -17.574  -0.551
  181   1HB   PRO  24           HB2      PRO  24   9.336 -18.738   1.137
  182   2HB   PRO  24           HB1      PRO  24   8.164 -19.550   0.091
  183   1HG   PRO  24           HG2      PRO  24  10.954 -19.112  -0.375
  184   2HG   PRO  24           HG1      PRO  24   9.788 -19.958  -1.401
  185   1HD   PRO  24           HD2      PRO  24  11.018 -17.498  -1.967
  186   2HD   PRO  24           HD1      PRO  24   9.632 -18.200  -2.816
  187    H    ASP  25           HN       ASP  25  10.186 -16.057   0.802
  188    HA   ASP  25           HA       ASP  25   9.153 -15.562   3.422
  189   1HB   ASP  25           HB2      ASP  25  11.580 -15.305   2.481
  190   2HB   ASP  25           HB1      ASP  25  11.058 -13.673   2.057
  191    H    ASP  26           HN       ASP  26   9.317 -13.407   0.565
  192    HA   ASP  26           HA       ASP  26   7.864 -11.251   1.755
  193   1HB   ASP  26           HB2      ASP  26   9.224 -11.079  -0.341
  194   2HB   ASP  26           HB1      ASP  26   7.980 -12.004  -1.182
  195    H    LEU  27           HN       LEU  27   6.821 -14.130  -0.023
  196    HA   LEU  27           HA       LEU  27   4.072 -13.392  -0.332
  197   1HB   LEU  27           HB2      LEU  27   5.443 -16.085  -0.151
  198   2HB   LEU  27           HB1      LEU  27   3.717 -15.909  -0.474
  199    HG   LEU  27           HG       LEU  27   5.898 -14.603  -2.125
  200   1HD1  LEU  27          HD11      LEU  27   4.378 -17.191  -2.451
  201   2HD1  LEU  27          HD13      LEU  27   5.062 -16.344  -3.839
  202   3HD1  LEU  27          HD12      LEU  27   6.118 -16.924  -2.550
  203   1HD2  LEU  27          HD23      LEU  27   2.908 -14.641  -2.159
  204   2HD2  LEU  27          HD22      LEU  27   4.016 -13.329  -2.559
  205   3HD2  LEU  27          HD21      LEU  27   3.746 -14.637  -3.710
  206    H    HIS  28           HN       HIS  28   5.906 -14.535   2.395
  207    HA   HIS  28           HA       HIS  28   3.519 -15.294   3.938
  208   1HB   HIS  28           HB2      HIS  28   6.476 -15.192   4.527
  209   2HB   HIS  28           HB1      HIS  28   5.298 -15.453   5.812
  210    HD1  HIS  28           HD1      HIS  28   3.297 -17.304   4.536
  211    HD2  HIS  28           HD2      HIS  28   7.400 -17.733   3.937
  212    HE1  HIS  28           HE1      HIS  28   3.670 -19.709   3.838
  213    H    TYR  29           HN       TYR  29   5.671 -12.547   3.579
  214    HA   TYR  29           HA       TYR  29   4.922 -11.144   5.968
  215   1HB   TYR  29           HB2      TYR  29   6.896 -10.610   4.472
  216   2HB   TYR  29           HB1      TYR  29   5.751  -9.901   3.333
  217    HD1  TYR  29           HD1      TYR  29   6.178  -9.838   7.067
  218    HD2  TYR  29           HD2      TYR  29   5.683  -7.580   3.447
  219    HE1  TYR  29           HE1      TYR  29   6.171  -7.734   8.380
  220    HE2  TYR  29           HE2      TYR  29   5.676  -5.477   4.760
  221    HH   TYR  29           HH       TYR  29   5.986  -4.565   6.770
  222    H    PHE  30           HN       PHE  30   3.343 -11.614   2.905
  223    HA   PHE  30           HA       PHE  30   1.598  -9.348   2.921
  224   1HB   PHE  30           HB2      PHE  30   1.964 -10.940   0.990
  225   2HB   PHE  30           HB1      PHE  30   0.953 -12.106   1.845
  226    HD1  PHE  30           HD1      PHE  30   0.962  -8.585   0.576
  227    HD2  PHE  30           HD2      PHE  30  -1.388 -12.019   1.641
  228    HE1  PHE  30           HE1      PHE  30  -1.071  -7.466  -0.299
  229    HE2  PHE  30           HE2      PHE  30  -3.420 -10.901   0.766
  230    HZ   PHE  30           HZ       PHE  30  -3.262  -8.623  -0.204
  231    H    ARG  31           HN       ARG  31   1.176 -12.652   4.208
  232    HA   ARG  31           HA       ARG  31  -1.462 -12.218   5.251
  233   1HB   ARG  31           HB2      ARG  31  -0.054 -14.432   4.925
  234   2HB   ARG  31           HB1      ARG  31   0.457 -14.103   6.581
  235   1HG   ARG  31           HG2      ARG  31  -2.044 -13.826   7.118
  236   2HG   ARG  31           HG1      ARG  31  -2.343 -14.581   5.551
  237   1HD   ARG  31           HD2      ARG  31  -1.302 -16.605   6.200
  238   2HD   ARG  31           HD1      ARG  31  -0.507 -15.852   7.581
  239    HE   ARG  31           HE       ARG  31  -3.401 -15.720   7.787
  240   1HH1  ARG  31          HH21      ARG  31  -0.604 -17.729   8.247
  241   2HH1  ARG  31          HH22      ARG  31  -1.358 -18.705   9.464
  242   1HH2  ARG  31          HH11      ARG  31  -4.368 -16.994   9.367
  243   2HH2  ARG  31          HH12      ARG  31  -3.479 -18.290  10.093
  244    H    ALA  32           HN       ALA  32   1.719 -11.388   6.409
  245    HA   ALA  32           HA       ALA  32   0.866 -10.920   9.169
  246   1HB   ALA  32           HB1      ALA  32   3.249 -11.501   8.336
  247   2HB   ALA  32           HB3      ALA  32   3.360  -9.798   7.891
  248   3HB   ALA  32           HB2      ALA  32   3.100 -10.255   9.574
  249    H    GLN  33           HN       GLN  33   1.064  -9.093   6.199
  250    HA   GLN  33           HA       GLN  33   0.399  -6.589   7.688
  251   1HB   GLN  33           HB2      GLN  33   1.581  -7.101   4.955
  252   2HB   GLN  33           HB1      GLN  33   0.905  -5.531   5.391
  253   1HG   GLN  33           HG2      GLN  33   3.009  -6.937   7.054
  254   2HG   GLN  33           HG1      GLN  33   3.404  -5.774   5.788
  255   1HE2  GLN  33          HE22      GLN  33   1.886  -3.009   7.622
  256   2HE2  GLN  33          HE21      GLN  33   1.974  -3.619   6.040
  257    H    THR  34           HN       THR  34  -1.559  -8.673   7.255
  258    HA   THR  34           HA       THR  34  -3.491  -7.125   5.599
  259    HB   THR  34           HB       THR  34  -4.395  -9.390   4.812
  260    HG1  THR  34           HG1      THR  34  -1.875 -10.113   5.873
  261   1HG2  THR  34          HG23      THR  34  -1.728  -8.268   3.959
  262   2HG2  THR  34          HG22      THR  34  -2.478  -9.616   3.103
  263   3HG2  THR  34          HG21      THR  34  -3.301  -8.058   3.190
  264    H    VAL  35           HN       VAL  35  -2.902  -9.528   8.122
  265    HA   VAL  35           HA       VAL  35  -5.644  -9.818   8.949
  266    HB   VAL  35           HB       VAL  35  -4.636 -10.693  11.073
  267   1HG1  VAL  35          HG11      VAL  35  -4.900 -12.026   8.894
  268   2HG1  VAL  35          HG13      VAL  35  -3.170 -11.777   8.662
  269   3HG1  VAL  35          HG12      VAL  35  -3.751 -12.663  10.072
  270   1HG2  VAL  35          HG21      VAL  35  -2.100  -9.765   9.700
  271   2HG2  VAL  35          HG23      VAL  35  -2.696  -9.282  11.287
  272   3HG2  VAL  35          HG22      VAL  35  -2.106 -10.923  11.029
  273    H    GLY  36           HN       GLY  36  -6.891  -8.385  10.038
  274   1HA   GLY  36           HA2      GLY  36  -7.462  -6.674  11.568
  275   2HA   GLY  36           HA1      GLY  36  -5.763  -6.572  12.034
  276    H    LYS  37           HN       LYS  37  -7.079  -6.290   8.752
  277    HA   LYS  37           HA       LYS  37  -6.691  -3.371   8.740
  278   1HB   LYS  37           HB2      LYS  37  -4.966  -5.253   7.107
  279   2HB   LYS  37           HB1      LYS  37  -5.117  -3.528   6.769
  280   1HG   LYS  37           HG2      LYS  37  -4.452  -3.159   9.226
  281   2HG   LYS  37           HG1      LYS  37  -3.959  -4.853   9.224
  282   1HD   LYS  37           HD2      LYS  37  -2.497  -4.380   7.252
  283   2HD   LYS  37           HD1      LYS  37  -2.920  -2.673   7.390
  284   1HE   LYS  37           HE2      LYS  37  -1.993  -2.613   9.668
  285   2HE   LYS  37           HE1      LYS  37  -1.597  -4.328   9.562
  286   1HZ   LYS  37           HZ2      LYS  37  -0.535  -2.211   7.770
  287   2HZ   LYS  37           HZ1      LYS  37   0.313  -2.914   9.063
  288   3HZ   LYS  37           HZ3      LYS  37  -0.124  -3.859   7.725
  289    H    ILE  38           HN       ILE  38  -7.255  -2.501   6.490
  290    HA   ILE  38           HA       ILE  38  -9.593  -4.018   5.480
  291    HB   ILE  38           HB       ILE  38  -8.656  -1.226   4.752
  292   1HG1  ILE  38          HG12      ILE  38 -10.800  -2.053   6.733
  293   2HG1  ILE  38          HG11      ILE  38  -9.176  -1.548   7.200
  294   1HG2  ILE  38          HG23      ILE  38 -11.200  -2.797   4.297
  295   2HG2  ILE  38          HG22      ILE  38 -11.138  -1.040   4.159
  296   3HG2  ILE  38          HG21      ILE  38 -10.160  -2.044   3.088
  297   1HD1  ILE  38          HD11      ILE  38 -10.757   0.221   5.370
  298   2HD1  ILE  38          HD13      ILE  38 -11.146   0.218   7.090
  299   3HD1  ILE  38          HD12      ILE  38  -9.523   0.654   6.552
  300    H    MET  39           HN       MET  39  -8.944  -5.534   3.996
  301    HA   MET  39           HA       MET  39  -6.731  -5.043   2.153
  302   1HB   MET  39           HB2      MET  39  -7.708  -7.315   3.167
  303   2HB   MET  39           HB1      MET  39  -8.683  -7.260   1.698
  304   1HG   MET  39           HG2      MET  39  -5.742  -6.747   1.474
  305   2HG   MET  39           HG1      MET  39  -6.292  -8.409   1.688
  306   1HE   MET  39           HE1      MET  39  -7.715  -9.591   0.542
  307   2HE   MET  39           HE3      MET  39  -9.068  -8.741  -0.217
  308   3HE   MET  39           HE2      MET  39  -7.884  -9.585  -1.212
  309    H    VAL  40           HN       VAL  40  -6.978  -3.807   0.367
  310    HA   VAL  40           HA       VAL  40  -9.619  -3.876  -1.039
  311    HB   VAL  40           HB       VAL  40  -7.748  -1.497  -0.846
  312   1HG1  VAL  40          HG11      VAL  40  -9.206  -1.685  -2.885
  313   2HG1  VAL  40          HG13      VAL  40 -10.612  -1.695  -1.820
  314   3HG1  VAL  40          HG12      VAL  40  -9.567  -0.276  -1.888
  315   1HG2  VAL  40          HG23      VAL  40 -10.205  -2.291   0.717
  316   2HG2  VAL  40          HG22      VAL  40  -8.652  -1.722   1.330
  317   3HG2  VAL  40          HG21      VAL  40  -9.752  -0.596   0.533
  318    H    VAL  41           HN       VAL  41  -9.386  -4.757  -3.025
  319    HA   VAL  41           HA       VAL  41  -6.886  -4.197  -4.553
  320    HB   VAL  41           HB       VAL  41  -6.940  -6.571  -5.367
  321   1HG1  VAL  41          HG13      VAL  41  -6.511  -5.873  -2.472
  322   2HG1  VAL  41          HG12      VAL  41  -6.266  -7.530  -3.025
  323   3HG1  VAL  41          HG11      VAL  41  -5.312  -6.219  -3.719
  324   1HG2  VAL  41          HG23      VAL  41  -9.460  -6.661  -4.432
  325   2HG2  VAL  41          HG22      VAL  41  -8.468  -8.111  -4.589
  326   3HG2  VAL  41          HG21      VAL  41  -8.627  -7.317  -3.022
  327    H    GLY  42           HN       GLY  42  -7.269  -4.978  -6.937
  328   1HA   GLY  42           HA2      GLY  42  -9.820  -3.775  -7.806
  329   2HA   GLY  42           HA1      GLY  42  -8.461  -4.186  -8.852
  330    H    ARG  43           HN       ARG  43 -10.322  -5.119 -10.166
  331    HA   ARG  43           HA       ARG  43 -11.492  -7.618  -9.156
  332   1HB   ARG  43           HB2      ARG  43 -11.738  -5.985 -11.662
  333   2HB   ARG  43           HB1      ARG  43 -12.253  -7.672 -11.687
  334   1HG   ARG  43           HG2      ARG  43 -13.682  -7.221  -9.686
  335   2HG   ARG  43           HG1      ARG  43 -13.240  -5.517  -9.797
  336   1HD   ARG  43           HD2      ARG  43 -15.391  -5.893 -10.912
  337   2HD   ARG  43           HD1      ARG  43 -14.166  -5.445 -12.100
  338    HE   ARG  43           HE       ARG  43 -14.302  -8.311 -11.835
  339   1HH1  ARG  43          HH21      ARG  43 -15.955  -5.559 -13.163
  340   2HH1  ARG  43          HH22      ARG  43 -16.693  -6.468 -14.439
  341   1HH2  ARG  43          HH11      ARG  43 -15.266  -9.481 -13.494
  342   2HH2  ARG  43          HH12      ARG  43 -16.303  -8.677 -14.625
  343    H    ARG  44           HN       ARG  44  -8.975  -6.615 -11.432
  344    HA   ARG  44           HA       ARG  44  -8.462  -9.238 -12.508
  345   1HB   ARG  44           HB2      ARG  44  -6.566  -6.880 -12.267
  346   2HB   ARG  44           HB1      ARG  44  -6.381  -8.261 -13.350
  347   1HG   ARG  44           HG2      ARG  44  -8.473  -7.658 -14.498
  348   2HG   ARG  44           HG1      ARG  44  -8.685  -6.290 -13.406
  349   1HD   ARG  44           HD2      ARG  44  -7.659  -5.248 -15.216
  350   2HD   ARG  44           HD1      ARG  44  -6.257  -5.653 -14.226
  351    HE   ARG  44           HE       ARG  44  -7.058  -7.012 -16.735
  352   1HH1  ARG  44          HH11      ARG  44  -4.967  -6.795 -13.969
  353   2HH1  ARG  44          HH12      ARG  44  -3.743  -7.803 -14.666
  354   1HH2  ARG  44          HH21      ARG  44  -5.462  -8.319 -17.629
  355   2HH2  ARG  44          HH22      ARG  44  -4.023  -8.662 -16.728
  356    H    THR  45           HN       THR  45  -7.344  -7.505  -9.657
  357    HA   THR  45           HA       THR  45  -5.280  -9.496  -9.033
  358    HB   THR  45           HB       THR  45  -6.403  -7.397  -7.167
  359    HG1  THR  45           HG1      THR  45  -4.193  -6.552  -8.283
  360   1HG2  THR  45          HG21      THR  45  -4.820  -9.225  -6.360
  361   2HG2  THR  45          HG23      THR  45  -3.599  -8.500  -7.407
  362   3HG2  THR  45          HG22      THR  45  -4.285  -7.568  -6.076
  363    H    TYR  46           HN       TYR  46  -8.637  -8.900  -8.249
  364    HA   TYR  46           HA       TYR  46  -8.815 -10.541  -5.903
  365   1HB   TYR  46           HB2      TYR  46 -10.559  -8.891  -6.776
  366   2HB   TYR  46           HB1      TYR  46 -11.018 -10.137  -7.938
  367    HD1  TYR  46           HD1      TYR  46 -10.363  -9.738  -4.262
  368    HD2  TYR  46           HD2      TYR  46 -12.667 -11.668  -7.330
  369    HE1  TYR  46           HE1      TYR  46 -11.742 -10.850  -2.526
  370    HE2  TYR  46           HE2      TYR  46 -14.047 -12.779  -5.594
  371    HH   TYR  46           HH       TYR  46 -13.964 -11.853  -2.311
  372    H    GLU  47           HN       GLU  47  -9.013 -11.256  -9.361
  373    HA   GLU  47           HA       GLU  47  -9.712 -14.069  -8.878
  374   1HB   GLU  47           HB2      GLU  47  -8.947 -12.582 -11.409
  375   2HB   GLU  47           HB1      GLU  47  -9.476 -14.263 -11.357
  376   1HG   GLU  47           HG2      GLU  47 -11.565 -13.384 -10.131
  377   2HG   GLU  47           HG1      GLU  47 -11.061 -11.785 -10.678
  378    H    SER  48           HN       SER  48  -6.849 -12.143  -9.382
  379    HA   SER  48           HA       SER  48  -5.077 -14.257 -10.199
  380   1HB   SER  48           HB2      SER  48  -4.413 -11.718  -8.681
  381   2HB   SER  48           HB1      SER  48  -3.278 -12.719  -9.581
  382    HG   SER  48           HG       SER  48  -3.953 -11.837 -11.366
  383    H    PHE  49           HN       PHE  49  -6.573 -13.547  -7.198
  384    HA   PHE  49           HA       PHE  49  -4.600 -14.475  -5.357
  385   1HB   PHE  49           HB2      PHE  49  -7.615 -14.371  -5.295
  386   2HB   PHE  49           HB1      PHE  49  -6.703 -15.082  -3.962
  387    HD1  PHE  49           HD2      PHE  49  -4.437 -13.525  -3.471
  388    HD2  PHE  49           HD1      PHE  49  -8.261 -12.176  -4.884
  389    HE1  PHE  49           HE2      PHE  49  -3.967 -11.260  -2.578
  390    HE2  PHE  49           HE1      PHE  49  -7.792  -9.910  -3.991
  391    HZ   PHE  49           HZ       PHE  49  -5.644  -9.452  -2.839
  392    HA   PRO  50           HA       PRO  50  -4.665 -18.885  -5.938
  393   1HB   PRO  50           HB2      PRO  50  -4.167 -19.647  -3.290
  394   2HB   PRO  50           HB1      PRO  50  -2.945 -19.208  -4.491
  395   1HG   PRO  50           HG2      PRO  50  -3.699 -17.777  -2.129
  396   2HG   PRO  50           HG1      PRO  50  -2.458 -17.358  -3.318
  397   1HD   PRO  50           HD2      PRO  50  -5.139 -16.244  -2.989
  398   2HD   PRO  50           HD1      PRO  50  -3.781 -15.628  -3.944
  399    H    LYS  51           HN       LYS  51  -5.980 -18.531  -2.632
  400    HA   LYS  51           HA       LYS  51  -8.393 -20.047  -3.550
  401   1HB   LYS  51           HB2      LYS  51  -8.515 -20.884  -1.177
  402   2HB   LYS  51           HB1      LYS  51  -7.090 -21.438  -2.055
  403   1HG   LYS  51           HG2      LYS  51  -5.653 -20.217  -0.764
  404   2HG   LYS  51           HG1      LYS  51  -6.779 -18.869  -0.604
  405   1HD   LYS  51           HD2      LYS  51  -7.940 -19.883   1.168
  406   2HD   LYS  51           HD1      LYS  51  -7.346 -21.493   0.760
  407   1HE   LYS  51           HE2      LYS  51  -5.637 -19.223   1.822
  408   2HE   LYS  51           HE1      LYS  51  -6.222 -20.585   2.777
  409   1HZ   LYS  51           HZ2      LYS  51  -4.521 -20.825   0.354
  410   2HZ   LYS  51           HZ1      LYS  51  -3.944 -20.900   1.950
  411   3HZ   LYS  51           HZ3      LYS  51  -5.009 -22.090   1.378
  412    H    ARG  52           HN       ARG  52  -9.161 -17.766  -4.016
  413    HA   ARG  52           HA       ARG  52  -9.671 -15.961  -1.805
  414   1HB   ARG  52           HB2      ARG  52 -11.148 -14.794  -3.466
  415   2HB   ARG  52           HB1      ARG  52  -9.513 -15.075  -4.065
  416   1HG   ARG  52           HG2      ARG  52 -10.216 -16.930  -5.397
  417   2HG   ARG  52           HG1      ARG  52 -11.792 -16.989  -4.604
  418   1HD   ARG  52           HD2      ARG  52 -12.496 -14.954  -5.630
  419   2HD   ARG  52           HD1      ARG  52 -10.858 -14.570  -6.159
  420    HE   ARG  52           HE       ARG  52 -11.160 -16.019  -8.004
  421   1HH1  ARG  52          HH11      ARG  52 -13.634 -16.492  -5.611
  422   2HH1  ARG  52          HH12      ARG  52 -14.577 -17.537  -6.620
  423   1HH2  ARG  52          HH21      ARG  52 -12.393 -17.375  -9.304
  424   2HH2  ARG  52          HH22      ARG  52 -13.877 -18.034  -8.701
  425    HA   PRO  53           HA       PRO  53 -11.348 -14.348  -1.533
  426   1HB   PRO  53           HB2      PRO  53 -12.873 -13.837   0.757
  427   2HB   PRO  53           HB1      PRO  53 -13.360 -13.498  -0.910
  428   1HG   PRO  53           HG2      PRO  53 -14.448 -15.440   0.889
  429   2HG   PRO  53           HG1      PRO  53 -14.946 -15.080  -0.770
  430   1HD   PRO  53           HD2      PRO  53 -13.340 -17.313   0.226
  431   2HD   PRO  53           HD1      PRO  53 -14.130 -17.115  -1.346
  432    H    LEU  54           HN       LEU  54 -10.437 -13.114   0.459
  433    HA   LEU  54           HA       LEU  54  -8.757 -15.019   1.996
  434   1HB   LEU  54           HB2      LEU  54  -8.531 -12.010   1.698
  435   2HB   LEU  54           HB1      LEU  54  -7.352 -13.064   2.480
  436    HG   LEU  54           HG       LEU  54  -8.208 -13.453  -0.394
  437   1HD1  LEU  54          HD12      LEU  54  -6.221 -11.573   0.812
  438   2HD1  LEU  54          HD11      LEU  54  -5.772 -12.401  -0.678
  439   3HD1  LEU  54          HD13      LEU  54  -7.211 -11.381  -0.634
  440   1HD2  LEU  54          HD22      LEU  54  -5.849 -14.375   1.277
  441   2HD2  LEU  54          HD21      LEU  54  -7.150 -15.383   0.644
  442   3HD2  LEU  54          HD23      LEU  54  -5.993 -14.640  -0.460
  443    HA   PRO  55           HA       PRO  55 -11.589 -14.009   5.426
  444   1HB   PRO  55           HB2      PRO  55 -10.609 -16.135   6.992
  445   2HB   PRO  55           HB1      PRO  55 -12.050 -16.160   5.967
  446   1HG   PRO  55           HG2      PRO  55  -9.598 -17.569   5.586
  447   2HG   PRO  55           HG1      PRO  55 -11.035 -17.579   4.556
  448   1HD   PRO  55           HD2      PRO  55  -8.495 -16.195   4.153
  449   2HD   PRO  55           HD1      PRO  55  -9.812 -16.477   3.003
  450    H    GLU  56           HN       GLU  56 -11.061 -13.940   7.949
  451    HA   GLU  56           HA       GLU  56  -9.818 -12.915   9.650
  452   1HB   GLU  56           HB2      GLU  56  -7.403 -13.757   8.021
  453   2HB   GLU  56           HB1      GLU  56  -7.441 -13.378   9.743
  454   1HG   GLU  56           HG2      GLU  56  -9.146 -15.274   9.974
  455   2HG   GLU  56           HG1      GLU  56  -8.694 -15.740   8.334
  456    H    ARG  57           HN       ARG  57 -10.632 -11.416   7.218
  457    HA   ARG  57           HA       ARG  57  -9.352  -8.928   7.791
  458   1HB   ARG  57           HB2      ARG  57  -8.116  -8.627   5.642
  459   2HB   ARG  57           HB1      ARG  57  -7.413  -9.886   6.657
  460   1HG   ARG  57           HG2      ARG  57  -8.971 -11.497   5.317
  461   2HG   ARG  57           HG1      ARG  57  -9.042 -10.182   4.144
  462   1HD   ARG  57           HD2      ARG  57  -7.178 -11.267   3.335
  463   2HD   ARG  57           HD1      ARG  57  -6.390 -10.226   4.522
  464    HE   ARG  57           HE       ARG  57  -6.911 -13.134   4.849
  465   1HH1  ARG  57          HH21      ARG  57  -5.634 -10.132   6.043
  466   2HH1  ARG  57          HH22      ARG  57  -4.685 -10.889   7.279
  467   1HH2  ARG  57          HH11      ARG  57  -5.675 -14.105   6.456
  468   2HH2  ARG  57          HH12      ARG  57  -4.710 -13.128   7.510
  469    H    THR  58           HN       THR  58  -9.846  -7.340   5.797
  470    HA   THR  58           HA       THR  58 -12.655  -7.945   4.984
  471    HB   THR  58           HB       THR  58 -11.308  -5.237   4.943
  472    HG1  THR  58           HG1      THR  58 -12.860  -5.316   6.985
  473   1HG2  THR  58          HG23      THR  58 -13.519  -5.780   3.717
  474   2HG2  THR  58          HG22      THR  58 -14.225  -5.894   5.328
  475   3HG2  THR  58          HG21      THR  58 -13.501  -4.379   4.788
  476    H    ASN  59           HN       ASN  59 -12.899  -8.530   2.892
  477    HA   ASN  59           HA       ASN  59 -10.781  -7.825   0.934
  478   1HB   ASN  59           HB2      ASN  59 -13.033  -9.830   0.973
  479   2HB   ASN  59           HB1      ASN  59 -12.229  -9.405  -0.538
  480   1HD2  ASN  59          HD22      ASN  59  -9.756 -11.013   2.333
  481   2HD2  ASN  59          HD21      ASN  59 -10.884  -9.828   2.783
  482    H    VAL  60           HN       VAL  60 -11.109  -5.897  -0.062
  483    HA   VAL  60           HA       VAL  60 -13.913  -5.145  -0.786
  484    HB   VAL  60           HB       VAL  60 -11.508  -3.321  -0.489
  485   1HG1  VAL  60          HG11      VAL  60 -14.457  -2.896  -0.990
  486   2HG1  VAL  60          HG13      VAL  60 -13.435  -1.617  -0.334
  487   3HG1  VAL  60          HG12      VAL  60 -13.091  -2.291  -1.927
  488   1HG2  VAL  60          HG23      VAL  60 -13.802  -3.902   1.413
  489   2HG2  VAL  60          HG22      VAL  60 -12.104  -4.299   1.679
  490   3HG2  VAL  60          HG21      VAL  60 -12.619  -2.612   1.628
  491    H    VAL  61           HN       VAL  61 -14.350  -4.647  -2.932
  492    HA   VAL  61           HA       VAL  61 -12.061  -4.860  -4.848
  493    HB   VAL  61           HB       VAL  61 -14.886  -5.864  -5.309
  494   1HG1  VAL  61          HG13      VAL  61 -12.304  -6.139  -6.877
  495   2HG1  VAL  61          HG12      VAL  61 -13.809  -6.973  -7.267
  496   3HG1  VAL  61          HG11      VAL  61 -13.726  -5.214  -7.358
  497   1HG2  VAL  61          HG22      VAL  61 -12.338  -7.302  -4.516
  498   2HG2  VAL  61          HG21      VAL  61 -13.873  -7.286  -3.649
  499   3HG2  VAL  61          HG23      VAL  61 -13.742  -8.129  -5.192
  500    H    LEU  62           HN       LEU  62 -11.858  -3.065  -6.083
  501    HA   LEU  62           HA       LEU  62 -14.134  -1.149  -6.186
  502   1HB   LEU  62           HB2      LEU  62 -11.811  -0.416  -5.441
  503   2HB   LEU  62           HB1      LEU  62 -11.287  -0.684  -7.104
  504    HG   LEU  62           HG       LEU  62 -13.330   0.827  -7.723
  505   1HD1  LEU  62          HD12      LEU  62 -12.905   1.381  -4.784
  506   2HD1  LEU  62          HD11      LEU  62 -13.606   2.586  -5.864
  507   3HD1  LEU  62          HD13      LEU  62 -14.419   1.039  -5.623
  508   1HD2  LEU  62          HD21      LEU  62 -10.784   1.849  -6.431
  509   2HD2  LEU  62          HD23      LEU  62 -11.050   1.522  -8.144
  510   3HD2  LEU  62          HD22      LEU  62 -11.883   2.867  -7.362
  511    H    THR  63           HN       THR  63 -15.429  -1.525  -7.924
  512    HA   THR  63           HA       THR  63 -14.134  -1.754 -10.595
  513    HB   THR  63           HB       THR  63 -14.683  -4.046  -9.994
  514    HG1  THR  63           HG1      THR  63 -16.437  -2.762 -11.791
  515   1HG2  THR  63          HG22      THR  63 -17.444  -2.944  -9.405
  516   2HG2  THR  63          HG21      THR  63 -17.028  -4.658  -9.428
  517   3HG2  THR  63          HG23      THR  63 -16.305  -3.591  -8.225
  518    H    HIS  64           HN       HIS  64 -15.287  -0.704 -12.224
  519    HA   HIS  64           HA       HIS  64 -17.531   0.999 -11.302
  520   1HB   HIS  64           HB2      HIS  64 -17.194   2.144 -13.510
  521   2HB   HIS  64           HB1      HIS  64 -15.752   2.147 -12.495
  522    HD1  HIS  64           HD1      HIS  64 -17.024   1.010 -15.763
  523    HD2  HIS  64           HD2      HIS  64 -13.765   0.142 -13.312
  524    HE1  HIS  64           HE1      HIS  64 -15.359  -0.242 -17.202
  525    H    GLN  65           HN       GLN  65 -17.908  -1.889 -11.769
  526    HA   GLN  65           HA       GLN  65 -20.003  -1.686 -13.892
  527   1HB   GLN  65           HB2      GLN  65 -18.087  -3.982 -13.390
  528   2HB   GLN  65           HB1      GLN  65 -19.499  -4.089 -14.442
  529   1HG   GLN  65           HG2      GLN  65 -18.593  -2.152 -15.754
  530   2HG   GLN  65           HG1      GLN  65 -17.131  -2.227 -14.771
  531   1HE2  GLN  65          HE22      GLN  65 -15.841  -5.091 -16.418
  532   2HE2  GLN  65          HE21      GLN  65 -15.672  -4.032 -15.103
  533    H    GLU  66           HN       GLU  66 -21.985  -2.273 -13.149
  534    HA   GLU  66           HA       GLU  66 -22.202  -3.395 -10.426
  535   1HB   GLU  66           HB2      GLU  66 -23.629  -1.462 -11.391
  536   2HB   GLU  66           HB1      GLU  66 -24.509  -2.725 -12.253
  537   1HG   GLU  66           HG2      GLU  66 -25.224  -3.757 -10.243
  538   2HG   GLU  66           HG1      GLU  66 -24.037  -2.881  -9.276
  539    H    ASP  67           HN       ASP  67 -21.218  -5.059 -12.687
  540    HA   ASP  67           HA       ASP  67 -23.420  -7.075 -12.835
  541   1HB   ASP  67           HB2      ASP  67 -20.965  -6.689 -14.573
  542   2HB   ASP  67           HB1      ASP  67 -22.102  -8.026 -14.741
  543    H    TYR  68           HN       TYR  68 -20.050  -6.549 -11.943
  544    HA   TYR  68           HA       TYR  68 -19.433  -9.314 -11.388
  545   1HB   TYR  68           HB2      TYR  68 -17.805  -7.326 -11.708
  546   2HB   TYR  68           HB1      TYR  68 -18.136  -6.960 -10.015
  547    HD1  TYR  68           HD2      TYR  68 -17.325  -9.936 -12.163
  548    HD2  TYR  68           HD1      TYR  68 -16.736  -7.913  -8.419
  549    HE1  TYR  68           HE2      TYR  68 -15.717 -11.691 -11.466
  550    HE2  TYR  68           HE1      TYR  68 -15.128  -9.668  -7.723
  551    HH   TYR  68           HH       TYR  68 -14.273 -11.676  -8.219
  552    H    GLN  69           HN       GLN  69 -19.307 -10.332  -9.303
  553    HA   GLN  69           HA       GLN  69 -20.528  -8.963  -6.994
  554   1HB   GLN  69           HB2      GLN  69 -21.820 -11.249  -8.473
  555   2HB   GLN  69           HB1      GLN  69 -22.087 -11.039  -6.742
  556   1HG   GLN  69           HG2      GLN  69 -22.745  -8.639  -7.242
  557   2HG   GLN  69           HG1      GLN  69 -22.720  -9.070  -8.952
  558   1HE2  GLN  69          HE22      GLN  69 -25.581 -11.288  -8.633
  559   2HE2  GLN  69          HE21      GLN  69 -24.088 -11.183  -9.434
  560    H    ALA  70           HN       ALA  70 -18.959  -9.395  -5.514
  561    HA   ALA  70           HA       ALA  70 -17.650 -12.065  -5.525
  562   1HB   ALA  70           HB3      ALA  70 -16.987  -9.490  -4.066
  563   2HB   ALA  70           HB2      ALA  70 -16.078 -10.991  -3.891
  564   3HB   ALA  70           HB1      ALA  70 -16.129 -10.168  -5.450
  565    H    GLN  71           HN       GLN  71 -18.297 -13.578  -4.082
  566    HA   GLN  71           HA       GLN  71 -20.286 -12.910  -2.041
  567   1HB   GLN  71           HB2      GLN  71 -18.898 -15.488  -2.817
  568   2HB   GLN  71           HB1      GLN  71 -20.079 -15.385  -1.509
  569   1HG   GLN  71           HG2      GLN  71 -20.737 -14.327  -4.252
  570   2HG   GLN  71           HG1      GLN  71 -20.925 -16.041  -3.882
  571   1HE2  GLN  71          HE22      GLN  71 -23.357 -15.165  -1.187
  572   2HE2  GLN  71          HE21      GLN  71 -21.866 -15.973  -1.244
  573    H    GLY  72           HN       GLY  72 -19.883 -12.580   0.105
  574   1HA   GLY  72           HA2      GLY  72 -18.707 -12.462   2.138
  575   2HA   GLY  72           HA1      GLY  72 -17.577 -13.648   1.484
  576    H    ALA  73           HN       ALA  73 -18.366 -10.500   0.062
  577    HA   ALA  73           HA       ALA  73 -15.858  -9.294   0.987
  578   1HB   ALA  73           HB3      ALA  73 -16.268  -9.999  -1.935
  579   2HB   ALA  73           HB2      ALA  73 -14.993  -8.942  -1.329
  580   3HB   ALA  73           HB1      ALA  73 -15.020 -10.645  -0.870
  581    H    VAL  74           HN       VAL  74 -16.124  -7.103   1.078
  582    HA   VAL  74           HA       VAL  74 -18.672  -5.943   0.309
  583    HB   VAL  74           HB       VAL  74 -16.140  -4.523   1.187
  584   1HG1  VAL  74          HG12      VAL  74 -17.880  -3.070   0.209
  585   2HG1  VAL  74          HG11      VAL  74 -19.072  -3.748   1.319
  586   3HG1  VAL  74          HG13      VAL  74 -17.729  -2.789   1.944
  587   1HG2  VAL  74          HG22      VAL  74 -18.319  -5.940   2.715
  588   2HG2  VAL  74          HG21      VAL  74 -16.573  -6.041   2.938
  589   3HG2  VAL  74          HG23      VAL  74 -17.444  -4.594   3.443
  590    H    VAL  75           HN       VAL  75 -18.953  -5.911  -1.914
  591    HA   VAL  75           HA       VAL  75 -16.807  -5.082  -3.718
  592    HB   VAL  75           HB       VAL  75 -19.762  -5.423  -4.305
  593   1HG1  VAL  75          HG13      VAL  75 -18.256  -4.189  -5.961
  594   2HG1  VAL  75          HG12      VAL  75 -17.388  -5.712  -6.158
  595   3HG1  VAL  75          HG11      VAL  75 -19.094  -5.607  -6.594
  596   1HG2  VAL  75          HG22      VAL  75 -17.472  -7.413  -4.397
  597   2HG2  VAL  75          HG21      VAL  75 -18.879  -7.481  -3.334
  598   3HG2  VAL  75          HG23      VAL  75 -19.074  -7.705  -5.073
  599    H    VAL  76           HN       VAL  76 -16.234  -2.946  -3.441
  600    HA   VAL  76           HA       VAL  76 -18.333  -0.890  -3.121
  601    HB   VAL  76           HB       VAL  76 -16.373   0.664  -2.929
  602   1HG1  VAL  76          HG13      VAL  76 -16.317  -1.817  -1.182
  603   2HG1  VAL  76          HG12      VAL  76 -15.556  -0.278  -0.775
  604   3HG1  VAL  76          HG11      VAL  76 -17.310  -0.382  -0.922
  605   1HG2  VAL  76          HG23      VAL  76 -14.835  -1.930  -3.278
  606   2HG2  VAL  76          HG22      VAL  76 -14.793  -0.533  -4.354
  607   3HG2  VAL  76          HG21      VAL  76 -14.120  -0.414  -2.728
  608    H    HIS  77           HN       HIS  77 -18.357   1.002  -4.580
  609    HA   HIS  77           HA       HIS  77 -17.212   0.496  -7.282
  610   1HB   HIS  77           HB2      HIS  77 -20.113   1.190  -6.721
  611   2HB   HIS  77           HB1      HIS  77 -19.378   1.103  -8.321
  612    HD1  HIS  77           HD1      HIS  77 -19.204  -1.175  -9.391
  613    HD2  HIS  77           HD2      HIS  77 -20.146  -1.409  -5.336
  614    HE1  HIS  77           HE1      HIS  77 -19.720  -3.608  -8.914
  615    H    ASP  78           HN       ASP  78 -16.588   2.373  -5.066
  616    HA   ASP  78           HA       ASP  78 -16.417   4.802  -6.660
  617   1HB   ASP  78           HB2      ASP  78 -18.785   4.732  -5.542
  618   2HB   ASP  78           HB1      ASP  78 -17.904   5.132  -4.066
  619    H    VAL  79           HN       VAL  79 -14.806   6.179  -5.846
  620    HA   VAL  79           HA       VAL  79 -12.916   5.019  -4.005
  621    HB   VAL  79           HB       VAL  79 -13.090   7.902  -4.929
  622   1HG1  VAL  79          HG13      VAL  79 -11.541   7.346  -3.017
  623   2HG1  VAL  79          HG12      VAL  79 -10.698   6.235  -4.097
  624   3HG1  VAL  79          HG11      VAL  79 -10.719   7.963  -4.450
  625   1HG2  VAL  79          HG23      VAL  79 -11.729   5.501  -6.196
  626   2HG2  VAL  79          HG22      VAL  79 -13.116   6.370  -6.852
  627   3HG2  VAL  79          HG21      VAL  79 -11.548   7.171  -6.736
  628    H    ALA  80           HN       ALA  80 -15.491   7.411  -3.688
  629    HA   ALA  80           HA       ALA  80 -14.756   8.310  -1.043
  630   1HB   ALA  80           HB3      ALA  80 -17.419   8.349  -2.495
  631   2HB   ALA  80           HB2      ALA  80 -17.098   9.182  -0.974
  632   3HB   ALA  80           HB1      ALA  80 -16.237   9.657  -2.438
  633    H    ALA  81           HN       ALA  81 -16.696   5.649  -2.290
  634    HA   ALA  81           HA       ALA  81 -17.951   4.933   0.199
  635   1HB   ALA  81           HB3      ALA  81 -17.279   3.215  -2.210
  636   2HB   ALA  81           HB2      ALA  81 -18.373   2.754  -0.905
  637   3HB   ALA  81           HB1      ALA  81 -18.782   4.104  -1.963
  638    H    VAL  82           HN       VAL  82 -14.878   4.058  -1.323
  639    HA   VAL  82           HA       VAL  82 -14.176   1.994   0.563
  640    HB   VAL  82           HB       VAL  82 -12.313   3.748  -1.066
  641   1HG1  VAL  82          HG13      VAL  82 -11.259   2.373   0.722
  642   2HG1  VAL  82          HG12      VAL  82 -11.999   0.933   0.021
  643   3HG1  VAL  82          HG11      VAL  82 -10.791   1.836  -0.892
  644   1HG2  VAL  82          HG21      VAL  82 -14.033   1.389  -1.771
  645   2HG2  VAL  82          HG23      VAL  82 -13.686   2.837  -2.716
  646   3HG2  VAL  82          HG22      VAL  82 -12.466   1.573  -2.559
  647    H    PHE  83           HN       PHE  83 -13.693   5.494   0.463
  648    HA   PHE  83           HA       PHE  83 -11.940   5.565   2.781
  649   1HB   PHE  83           HB2      PHE  83 -13.465   7.630   1.203
  650   2HB   PHE  83           HB1      PHE  83 -12.684   8.066   2.724
  651    HD1  PHE  83           HD2      PHE  83 -10.197   6.901   2.917
  652    HD2  PHE  83           HD1      PHE  83 -12.203   8.061  -0.700
  653    HE1  PHE  83           HE2      PHE  83  -8.012   7.056   1.754
  654    HE2  PHE  83           HE1      PHE  83 -10.017   8.215  -1.863
  655    HZ   PHE  83           HZ       PHE  83  -7.923   7.712  -0.636
  656    H    ALA  84           HN       ALA  84 -15.417   5.792   2.238
  657    HA   ALA  84           HA       ALA  84 -16.107   6.711   4.881
  658   1HB   ALA  84           HB3      ALA  84 -17.747   5.108   2.894
  659   2HB   ALA  84           HB2      ALA  84 -18.387   5.947   4.306
  660   3HB   ALA  84           HB1      ALA  84 -17.674   6.868   2.981
  661    H    TYR  85           HN       TYR  85 -15.484   3.546   3.479
  662    HA   TYR  85           HA       TYR  85 -16.543   2.015   5.696
  663   1HB   TYR  85           HB2      TYR  85 -16.094   1.146   3.347
  664   2HB   TYR  85           HB1      TYR  85 -14.380   1.147   3.762
  665    HD1  TYR  85           HD2      TYR  85 -13.559  -0.258   5.676
  666    HD2  TYR  85           HD1      TYR  85 -17.572  -0.544   4.171
  667    HE1  TYR  85           HE2      TYR  85 -13.832  -2.444   6.818
  668    HE2  TYR  85           HE1      TYR  85 -17.844  -2.729   5.313
  669    HH   TYR  85           HH       TYR  85 -16.630  -3.824   7.495
  670    H    ALA  86           HN       ALA  86 -13.360   3.336   4.878
  671    HA   ALA  86           HA       ALA  86 -12.005   2.064   7.115
  672   1HB   ALA  86           HB2      ALA  86 -11.269   4.324   5.244
  673   2HB   ALA  86           HB1      ALA  86 -10.212   3.805   6.556
  674   3HB   ALA  86           HB3      ALA  86 -10.629   2.680   5.263
  675    H    LYS  87           HN       LYS  87 -13.814   5.012   6.638
  676    HA   LYS  87           HA       LYS  87 -12.818   6.423   8.956
  677   1HB   LYS  87           HB2      LYS  87 -15.279   6.678   7.230
  678   2HB   LYS  87           HB1      LYS  87 -15.082   7.661   8.682
  679   1HG   LYS  87           HG2      LYS  87 -13.091   8.675   7.845
  680   2HG   LYS  87           HG1      LYS  87 -12.952   7.494   6.542
  681   1HD   LYS  87           HD2      LYS  87 -13.866   9.338   5.428
  682   2HD   LYS  87           HD1      LYS  87 -15.306   8.399   5.828
  683   1HE   LYS  87           HE2      LYS  87 -15.802  10.641   6.479
  684   2HE   LYS  87           HE1      LYS  87 -15.439   9.781   7.975
  685   1HZ   LYS  87           HZ2      LYS  87 -13.034  10.732   6.943
  686   2HZ   LYS  87           HZ1      LYS  87 -14.140  12.021   6.888
  687   3HZ   LYS  87           HZ3      LYS  87 -13.833  11.231   8.357
  688    H    GLN  88           HN       GLN  88 -15.529   4.206   8.387
  689    HA   GLN  88           HA       GLN  88 -16.706   4.491  10.999
  690   1HB   GLN  88           HB2      GLN  88 -17.492   3.273   8.702
  691   2HB   GLN  88           HB1      GLN  88 -16.951   1.870   9.625
  692   1HG   GLN  88           HG2      GLN  88 -18.418   2.466  11.478
  693   2HG   GLN  88           HG1      GLN  88 -18.893   3.957  10.660
  694   1HE2  GLN  88          HE22      GLN  88 -21.332   2.373   8.671
  695   2HE2  GLN  88          HE21      GLN  88 -20.608   3.828   9.161
  696    H    HIS  89           HN       HIS  89 -13.986   2.697   9.774
  697    HA   HIS  89           HA       HIS  89 -13.725   1.323  12.421
  698   1HB   HIS  89           HB2      HIS  89 -12.483   0.516   9.774
  699   2HB   HIS  89           HB1      HIS  89 -12.422  -0.392  11.284
  700    HD1  HIS  89           HD1      HIS  89 -13.686  -1.699   8.807
  701    HD2  HIS  89           HD2      HIS  89 -15.874   0.459  11.622
  702    HE1  HIS  89           HE1      HIS  89 -16.082  -2.494   8.614
  703    HA   PRO  90           HA       PRO  90 -10.256   4.348  12.384
  704   1HB   PRO  90           HB2      PRO  90 -10.373   4.629  15.182
  705   2HB   PRO  90           HB1      PRO  90 -11.073   5.727  13.987
  706   1HG   PRO  90           HG2      PRO  90 -12.440   4.011  15.816
  707   2HG   PRO  90           HG1      PRO  90 -13.135   5.113  14.620
  708   1HD   PRO  90           HD2      PRO  90 -12.881   2.209  14.509
  709   2HD   PRO  90           HD1      PRO  90 -13.833   3.289  13.478
  710    H    ASP  91           HN       ASP  91 -10.834   1.368  14.051
  711    HA   ASP  91           HA       ASP  91  -8.137   1.158  15.182
  712   1HB   ASP  91           HB2      ASP  91  -8.853  -1.190  15.701
  713   2HB   ASP  91           HB1      ASP  91  -9.960   0.030  16.332
  714    H    GLN  92           HN       GLN  92  -9.753   0.320  12.210
  715    HA   GLN  92           HA       GLN  92  -7.522  -1.437  11.359
  716   1HB   GLN  92           HB2      GLN  92 -10.079  -0.639   9.933
  717   2HB   GLN  92           HB1      GLN  92  -8.910  -1.823   9.348
  718   1HG   GLN  92           HG2      GLN  92  -9.266  -3.080  11.532
  719   2HG   GLN  92           HG1      GLN  92 -10.628  -2.001  11.832
  720   1HE2  GLN  92          HE22      GLN  92 -11.127  -5.122   9.354
  721   2HE2  GLN  92          HE21      GLN  92  -9.750  -4.929  10.326
  722    H    GLU  93           HN       GLU  93  -6.992  -0.965   8.849
  723    HA   GLU  93           HA       GLU  93  -6.681   1.958   8.410
  724   1HB   GLU  93           HB2      GLU  93  -4.425  -0.061   8.504
  725   2HB   GLU  93           HB1      GLU  93  -4.264   1.535   7.771
  726   1HG   GLU  93           HG2      GLU  93  -5.182   2.423  10.037
  727   2HG   GLU  93           HG1      GLU  93  -4.737   0.833  10.662
  728    H    LEU  94           HN       LEU  94  -6.473   2.507   6.195
  729    HA   LEU  94           HA       LEU  94  -7.516   0.500   4.336
  730   1HB   LEU  94           HB2      LEU  94  -7.934   3.121   4.448
  731   2HB   LEU  94           HB1      LEU  94  -6.499   3.166   3.423
  732    HG   LEU  94           HG       LEU  94  -8.886   1.401   2.835
  733   1HD1  LEU  94          HD13      LEU  94  -8.228   4.194   1.856
  734   2HD1  LEU  94          HD12      LEU  94  -9.414   3.139   1.088
  735   3HD1  LEU  94          HD11      LEU  94  -9.667   3.691   2.743
  736   1HD2  LEU  94          HD22      LEU  94  -6.332   2.158   1.441
  737   2HD2  LEU  94          HD21      LEU  94  -7.069   0.567   1.623
  738   3HD2  LEU  94          HD23      LEU  94  -7.750   1.728   0.483
  739    H    VAL  95           HN       VAL  95  -6.240  -0.837   3.166
  740    HA   VAL  95           HA       VAL  95  -3.456   0.054   2.534
  741    HB   VAL  95           HB       VAL  95  -4.296  -2.776   3.227
  742   1HG1  VAL  95          HG11      VAL  95  -1.653  -1.437   2.615
  743   2HG1  VAL  95          HG13      VAL  95  -1.756  -3.000   3.423
  744   3HG1  VAL  95          HG12      VAL  95  -2.388  -2.811   1.788
  745   1HG2  VAL  95          HG21      VAL  95  -2.796  -0.713   4.875
  746   2HG2  VAL  95          HG23      VAL  95  -4.429  -1.298   5.198
  747   3HG2  VAL  95          HG22      VAL  95  -3.055  -2.395   5.336
  748    H    ILE  96           HN       ILE  96  -2.993  -0.060   0.388
  749    HA   ILE  96           HA       ILE  96  -4.940  -1.465  -1.379
  750    HB   ILE  96           HB       ILE  96  -2.803   0.547  -2.135
  751   1HG1  ILE  96          HG12      ILE  96  -4.450   1.558  -0.595
  752   2HG1  ILE  96          HG11      ILE  96  -4.644   2.194  -2.226
  753   1HG2  ILE  96          HG22      ILE  96  -5.242  -0.495  -3.607
  754   2HG2  ILE  96          HG21      ILE  96  -4.141   0.746  -4.204
  755   3HG2  ILE  96          HG23      ILE  96  -3.566  -0.904  -3.970
  756   1HD1  ILE  96          HD12      ILE  96  -6.470   0.506  -2.601
  757   2HD1  ILE  96          HD11      ILE  96  -6.335   0.053  -0.901
  758   3HD1  ILE  96          HD13      ILE  96  -6.846   1.683  -1.343
  759    H    ALA  97           HN       ALA  97  -4.306  -3.281  -2.445
  760    HA   ALA  97           HA       ALA  97  -1.410  -4.012  -2.331
  761   1HB   ALA  97           HB1      ALA  97  -3.953  -5.590  -2.239
  762   2HB   ALA  97           HB3      ALA  97  -2.529  -6.344  -2.957
  763   3HB   ALA  97           HB2      ALA  97  -2.480  -5.781  -1.285
  764    H    GLY  98           HN       GLY  98  -4.101  -3.384  -4.447
  765   1HA   GLY  98           HA2      GLY  98  -2.645  -2.895  -6.761
  766   2HA   GLY  98           HA1      GLY  98  -2.962  -4.631  -6.810
  767    H    GLY  99           HN       GLY  99  -5.853  -3.201  -8.581
  768   1HA   GLY  99           HA2      GLY  99  -3.155  -4.328  -8.866
  769   2HA   GLY  99           HA1      GLY  99  -4.255  -3.916 -10.182
  770    H    ALA 100           HN       ALA 100  -2.480  -2.833 -11.266
  771    HA   ALA 100           HA       ALA 100  -1.034  -0.648 -10.064
  772   1HB   ALA 100           HB1      ALA 100  -1.525  -1.477 -12.932
  773   2HB   ALA 100           HB3      ALA 100  -0.556  -0.065 -12.513
  774   3HB   ALA 100           HB2      ALA 100  -0.050  -1.669 -11.984
  775    H    GLN 101           HN       GLN 101  -4.057  -0.883 -11.870
  776    HA   GLN 101           HA       GLN 101  -4.385   1.977 -12.225
  777   1HB   GLN 101           HB2      GLN 101  -6.420  -0.275 -12.285
  778   2HB   GLN 101           HB1      GLN 101  -6.725   1.380 -12.814
  779   1HG   GLN 101           HG2      GLN 101  -4.414  -0.173 -13.958
  780   2HG   GLN 101           HG1      GLN 101  -6.041  -0.395 -14.601
  781   1HE2  GLN 101          HE22      GLN 101  -3.966   2.736 -15.877
  782   2HE2  GLN 101          HE21      GLN 101  -3.289   1.348 -15.175
  783    H    ILE 102           HN       ILE 102  -5.060  -0.286  -9.659
  784    HA   ILE 102           HA       ILE 102  -6.969   1.397  -8.254
  785    HB   ILE 102           HB       ILE 102  -5.237  -0.830  -7.145
  786   1HG1  ILE 102          HG12      ILE 102  -6.520  -1.599  -9.112
  787   2HG1  ILE 102          HG11      ILE 102  -7.158  -2.308  -7.630
  788   1HG2  ILE 102          HG22      ILE 102  -7.875   0.358  -6.234
  789   2HG2  ILE 102          HG21      ILE 102  -7.074  -1.027  -5.493
  790   3HG2  ILE 102          HG23      ILE 102  -6.315   0.564  -5.437
  791   1HD1  ILE 102          HD13      ILE 102  -8.921  -0.553  -7.576
  792   2HD1  ILE 102          HD12      ILE 102  -8.302   0.092  -9.096
  793   3HD1  ILE 102          HD11      ILE 102  -9.003  -1.525  -9.046
  794    H    PHE 103           HN       PHE 103  -3.464   0.913  -8.142
  795    HA   PHE 103           HA       PHE 103  -2.955   2.434  -5.770
  796   1HB   PHE 103           HB2      PHE 103  -1.270   1.807  -8.204
  797   2HB   PHE 103           HB1      PHE 103  -0.648   2.738  -6.841
  798    HD1  PHE 103           HD2      PHE 103  -1.603   1.544  -4.466
  799    HD2  PHE 103           HD1      PHE 103  -0.535  -0.399  -8.146
  800    HE1  PHE 103           HE2      PHE 103  -1.162  -0.559  -3.228
  801    HE2  PHE 103           HE1      PHE 103  -0.094  -2.502  -6.907
  802    HZ   PHE 103           HZ       PHE 103  -0.408  -2.582  -4.448
  803    H    THR 104           HN       THR 104  -2.866   3.387  -9.217
  804    HA   THR 104           HA       THR 104  -2.284   6.145  -8.750
  805    HB   THR 104           HB       THR 104  -2.015   5.175 -10.966
  806    HG1  THR 104           HG1      THR 104  -3.607   6.690 -12.071
  807   1HG2  THR 104          HG23      THR 104  -3.855   3.527 -10.791
  808   2HG2  THR 104          HG22      THR 104  -5.027   4.836 -10.936
  809   3HG2  THR 104          HG21      THR 104  -3.956   4.458 -12.286
  810    H    ALA 105           HN       ALA 105  -5.317   4.341  -8.850
  811    HA   ALA 105           HA       ALA 105  -7.085   6.599  -8.876
  812   1HB   ALA 105           HB2      ALA 105  -7.423   3.768  -7.858
  813   2HB   ALA 105           HB1      ALA 105  -8.736   4.945  -7.878
  814   3HB   ALA 105           HB3      ALA 105  -7.988   4.433  -9.391
  815    H    PHE 106           HN       PHE 106  -5.398   4.903  -6.281
  816    HA   PHE 106           HA       PHE 106  -6.674   6.726  -4.291
  817   1HB   PHE 106           HB2      PHE 106  -5.283   4.060  -4.064
  818   2HB   PHE 106           HB1      PHE 106  -5.492   5.098  -2.654
  819    HD1  PHE 106           HD1      PHE 106  -7.889   5.983  -2.183
  820    HD2  PHE 106           HD2      PHE 106  -7.032   2.654  -4.760
  821    HE1  PHE 106           HE1      PHE 106 -10.231   5.200  -1.951
  822    HE2  PHE 106           HE2      PHE 106  -9.374   1.872  -4.527
  823    HZ   PHE 106           HZ       PHE 106 -10.973   3.145  -3.123
  824    H    LYS 107           HN       LYS 107  -4.203   7.036  -6.249
  825    HA   LYS 107           HA       LYS 107  -1.969   7.485  -4.438
  826   1HB   LYS 107           HB2      LYS 107  -1.898   6.992  -6.983
  827   2HB   LYS 107           HB1      LYS 107  -2.239   8.711  -7.180
  828   1HG   LYS 107           HG2      LYS 107  -0.074   8.002  -5.267
  829   2HG   LYS 107           HG1      LYS 107   0.272   7.743  -6.977
  830   1HD   LYS 107           HD2      LYS 107  -1.011  10.327  -6.211
  831   2HD   LYS 107           HD1      LYS 107   0.693  10.112  -5.805
  832   1HE   LYS 107           HE2      LYS 107   0.816  11.009  -7.964
  833   2HE   LYS 107           HE1      LYS 107   0.908   9.277  -8.278
  834   1HZ   LYS 107           HZ1      LYS 107  -1.746  10.489  -8.157
  835   2HZ   LYS 107           HZ3      LYS 107  -0.800  10.828  -9.523
  836   3HZ   LYS 107           HZ2      LYS 107  -1.175   9.218  -9.130
  837    H    ASP 108           HN       ASP 108  -4.689   9.348  -5.540
  838    HA   ASP 108           HA       ASP 108  -3.642  11.980  -5.084
  839   1HB   ASP 108           HB2      ASP 108  -5.869  11.207  -6.232
  840   2HB   ASP 108           HB1      ASP 108  -6.529  11.288  -4.599
  841    H    ASP 109           HN       ASP 109  -4.705   9.474  -2.933
  842    HA   ASP 109           HA       ASP 109  -4.333  11.354  -0.639
  843   1HB   ASP 109           HB2      ASP 109  -6.455   9.220  -0.994
  844   2HB   ASP 109           HB1      ASP 109  -6.080   9.960   0.564
  845    H    VAL 110           HN       VAL 110  -2.306   9.722  -1.755
  846    HA   VAL 110           HA       VAL 110  -2.115   7.296  -0.099
  847    HB   VAL 110           HB       VAL 110  -1.271   7.272  -2.420
  848   1HG1  VAL 110          HG11      VAL 110  -0.589   9.670  -2.484
  849   2HG1  VAL 110          HG13      VAL 110   0.776   9.282  -1.435
  850   3HG1  VAL 110          HG12      VAL 110   0.682   8.590  -3.055
  851   1HG2  VAL 110          HG21      VAL 110  -0.134   6.050  -0.360
  852   2HG2  VAL 110          HG23      VAL 110   0.622   6.004  -1.954
  853   3HG2  VAL 110          HG22      VAL 110   1.206   7.135  -0.733
  854    H    ASP 111           HN       ASP 111  -0.310   6.972   1.400
  855    HA   ASP 111           HA       ASP 111   0.925   9.484   2.427
  856   1HB   ASP 111           HB2      ASP 111  -0.424   7.368   4.133
  857   2HB   ASP 111           HB1      ASP 111   0.440   8.781   4.741
  858    H    THR 112           HN       THR 112   0.869   6.040   3.402
  859    HA   THR 112           HA       THR 112   3.798   6.069   3.674
  860    HB   THR 112           HB       THR 112   2.104   3.596   3.913
  861    HG1  THR 112           HG1      THR 112   2.250   4.723   6.263
  862   1HG2  THR 112          HG23      THR 112   4.533   4.687   5.356
  863   2HG2  THR 112          HG22      THR 112   3.728   3.172   5.766
  864   3HG2  THR 112          HG21      THR 112   4.508   3.361   4.195
  865    H    LEU 113           HN       LEU 113   5.133   4.417   2.567
  866    HA   LEU 113           HA       LEU 113   3.972   3.360   0.042
  867   1HB   LEU 113           HB2      LEU 113   6.287   5.277   0.288
  868   2HB   LEU 113           HB1      LEU 113   6.167   4.170  -1.082
  869    HG   LEU 113           HG       LEU 113   3.849   5.928  -0.280
  870   1HD1  LEU 113          HD11      LEU 113   6.303   6.601  -1.884
  871   2HD1  LEU 113          HD13      LEU 113   4.752   7.331  -2.305
  872   3HD1  LEU 113          HD12      LEU 113   5.442   7.590  -0.704
  873   1HD2  LEU 113          HD22      LEU 113   3.703   3.899  -1.882
  874   2HD2  LEU 113          HD21      LEU 113   3.035   5.430  -2.448
  875   3HD2  LEU 113          HD23      LEU 113   4.618   4.897  -3.012
  876    H    LEU 114           HN       LEU 114   4.235   1.229   0.757
  877    HA   LEU 114           HA       LEU 114   6.941   0.380   1.654
  878   1HB   LEU 114           HB2      LEU 114   4.267  -1.052   1.623
  879   2HB   LEU 114           HB1      LEU 114   5.777  -1.795   2.151
  880    HG   LEU 114           HG       LEU 114   4.803   0.803   3.339
  881   1HD1  LEU 114          HD11      LEU 114   4.173  -2.026   4.236
  882   2HD1  LEU 114          HD13      LEU 114   3.878  -0.580   5.202
  883   3HD1  LEU 114          HD12      LEU 114   3.010  -0.819   3.686
  884   1HD2  LEU 114          HD21      LEU 114   6.780  -1.356   4.091
  885   2HD2  LEU 114          HD23      LEU 114   7.079   0.368   3.868
  886   3HD2  LEU 114          HD22      LEU 114   6.181  -0.196   5.277
  887    H    VAL 115           HN       VAL 115   8.268  -0.106  -0.032
  888    HA   VAL 115           HA       VAL 115   7.098  -1.625  -2.329
  889    HB   VAL 115           HB       VAL 115   7.885   0.631  -2.962
  890   1HG1  VAL 115          HG13      VAL 115   9.597   0.838  -1.162
  891   2HG1  VAL 115          HG12      VAL 115  10.604  -0.325  -2.024
  892   3HG1  VAL 115          HG11      VAL 115  10.239   1.237  -2.755
  893   1HG2  VAL 115          HG22      VAL 115   8.129  -1.316  -4.533
  894   2HG2  VAL 115          HG21      VAL 115   9.309  -0.036  -4.813
  895   3HG2  VAL 115          HG23      VAL 115   9.788  -1.507  -3.966
  896    H    THR 116           HN       THR 116   8.150  -3.507  -2.959
  897    HA   THR 116           HA       THR 116  10.413  -4.382  -1.210
  898    HB   THR 116           HB       THR 116   8.552  -6.164  -2.801
  899    HG1  THR 116           HG1      THR 116   7.924  -4.691  -0.754
  900   1HG2  THR 116          HG21      THR 116  10.744  -7.100  -2.090
  901   2HG2  THR 116          HG23      THR 116  10.348  -6.700  -0.419
  902   3HG2  THR 116          HG22      THR 116   9.388  -7.895  -1.291
  903    H    ARG 117           HN       ARG 117  12.225  -3.842  -2.394
  904    HA   ARG 117           HA       ARG 117  12.289  -4.254  -5.306
  905   1HB   ARG 117           HB2      ARG 117  14.388  -3.313  -3.331
  906   2HB   ARG 117           HB1      ARG 117  14.646  -3.416  -5.073
  907   1HG   ARG 117           HG2      ARG 117  12.305  -1.886  -3.946
  908   2HG   ARG 117           HG1      ARG 117  13.894  -1.134  -4.091
  909   1HD   ARG 117           HD2      ARG 117  13.858  -1.962  -6.536
  910   2HD   ARG 117           HD1      ARG 117  12.130  -2.217  -6.287
  911    HE   ARG 117           HE       ARG 117  12.472   0.371  -5.438
  912   1HH1  ARG 117          HH21      ARG 117  13.425  -1.364  -8.294
  913   2HH1  ARG 117          HH22      ARG 117  13.357   0.037  -9.312
  914   1HH2  ARG 117          HH11      ARG 117  12.388   2.180  -6.769
  915   2HH2  ARG 117          HH12      ARG 117  12.772   2.033  -8.451
  916    H    LEU 118           HN       LEU 118  13.726  -5.733  -6.354
  917    HA   LEU 118           HA       LEU 118  14.812  -7.900  -4.603
  918   1HB   LEU 118           HB2      LEU 118  12.873  -8.053  -6.830
  919   2HB   LEU 118           HB1      LEU 118  14.198  -9.212  -6.937
  920    HG   LEU 118           HG       LEU 118  13.709  -9.785  -4.494
  921   1HD1  LEU 118          HD12      LEU 118  11.457  -7.919  -5.148
  922   2HD1  LEU 118          HD11      LEU 118  11.139  -9.287  -4.081
  923   3HD1  LEU 118          HD13      LEU 118  12.362  -8.095  -3.645
  924   1HD2  LEU 118          HD22      LEU 118  11.705 -10.324  -6.702
  925   2HD2  LEU 118          HD21      LEU 118  13.064 -11.336  -6.214
  926   3HD2  LEU 118          HD23      LEU 118  11.670 -11.160  -5.150
  927    H    ALA 119           HN       ALA 119  16.899  -8.463  -5.077
  928    HA   ALA 119           HA       ALA 119  18.420  -6.879  -6.952
  929   1HB   ALA 119           HB3      ALA 119  19.285  -7.968  -4.811
  930   2HB   ALA 119           HB2      ALA 119  19.292  -9.492  -5.697
  931   3HB   ALA 119           HB1      ALA 119  20.313  -8.156  -6.231
  932    H    GLY 120           HN       GLY 120  16.897 -10.045  -7.076
  933   1HA   GLY 120           HA2      GLY 120  18.236 -10.921  -9.495
  934   2HA   GLY 120           HA1      GLY 120  16.780 -11.640  -8.805
  935    H    SER 121           HN       SER 121  17.779 -10.315 -11.556
  936    HA   SER 121           HA       SER 121  15.639  -8.389 -12.064
  937   1HB   SER 121           HB2      SER 121  16.496  -8.592 -14.452
  938   2HB   SER 121           HB1      SER 121  17.684  -8.051 -13.269
  939    HG   SER 121           HG       SER 121  18.787  -9.793 -13.655
  940    H    PHE 122           HN       PHE 122  13.730  -8.777 -13.187
  941    HA   PHE 122           HA       PHE 122  13.248 -11.457 -14.345
  942   1HB   PHE 122           HB2      PHE 122  11.570 -10.287 -12.103
  943   2HB   PHE 122           HB1      PHE 122  11.134 -11.712 -13.047
  944    HD1  PHE 122           HD2      PHE 122  12.736 -13.704 -13.057
  945    HD2  PHE 122           HD1      PHE 122  13.048 -10.457 -10.261
  946    HE1  PHE 122           HE2      PHE 122  14.126 -15.119 -11.569
  947    HE2  PHE 122           HE1      PHE 122  14.437 -11.873  -8.772
  948    HZ   PHE 122           HZ       PHE 122  14.976 -14.204  -9.427
  949    H    GLU 123           HN       GLU 123  12.112 -11.206 -16.206
  950    HA   GLU 123           HA       GLU 123  10.938  -8.558 -16.802
  951   1HB   GLU 123           HB2      GLU 123  11.512 -11.015 -18.471
  952   2HB   GLU 123           HB1      GLU 123  10.609  -9.637 -19.101
  953   1HG   GLU 123           HG2      GLU 123  12.516  -8.151 -18.522
  954   2HG   GLU 123           HG1      GLU 123  13.423  -9.561 -17.973
  955    H    GLY 124           HN       GLY 124   8.751  -8.506 -17.852
  956   1HA   GLY 124           HA2      GLY 124   6.945 -10.757 -17.364
  957   2HA   GLY 124           HA1      GLY 124   6.672  -9.383 -16.292
  958    H    ASP 125           HN       ASP 125   4.769  -8.557 -17.109
  959    HA   ASP 125           HA       ASP 125   4.897  -7.437 -19.861
  960   1HB   ASP 125           HB2      ASP 125   2.702  -9.214 -18.771
  961   2HB   ASP 125           HB1      ASP 125   2.484  -8.174 -20.180
  962    H    THR 126           HN       THR 126   4.651  -6.714 -16.751
  963    HA   THR 126           HA       THR 126   2.969  -4.333 -17.279
  964    HB   THR 126           HB       THR 126   2.511  -5.922 -14.756
  965    HG1  THR 126           HG1      THR 126   0.507  -6.217 -16.459
  966   1HG2  THR 126          HG21      THR 126   1.816  -3.463 -15.117
  967   2HG2  THR 126          HG23      THR 126   0.622  -4.102 -16.247
  968   3HG2  THR 126          HG22      THR 126   0.574  -4.579 -14.550
  969    H    LYS 127           HN       LYS 127   3.927  -2.559 -16.398
  970    HA   LYS 127           HA       LYS 127   6.149  -3.010 -14.455
  971   1HB   LYS 127           HB2      LYS 127   5.568  -0.663 -16.289
  972   2HB   LYS 127           HB1      LYS 127   6.930  -0.757 -15.172
  973   1HG   LYS 127           HG2      LYS 127   7.615  -2.897 -16.340
  974   2HG   LYS 127           HG1      LYS 127   6.385  -2.545 -17.554
  975   1HD   LYS 127           HD2      LYS 127   7.497  -0.280 -17.860
  976   2HD   LYS 127           HD1      LYS 127   8.821  -0.887 -16.866
  977   1HE   LYS 127           HE2      LYS 127   9.443  -1.282 -19.153
  978   2HE   LYS 127           HE1      LYS 127   8.987  -2.845 -18.474
  979   1HZ   LYS 127           HZ1      LYS 127   6.641  -2.078 -19.363
  980   2HZ   LYS 127           HZ3      LYS 127   7.602  -1.198 -20.448
  981   3HZ   LYS 127           HZ2      LYS 127   7.755  -2.887 -20.359
  982    H    MET 128           HN       MET 128   6.428  -0.905 -13.012
  983    HA   MET 128           HA       MET 128   3.829  -0.531 -11.638
  984   1HB   MET 128           HB2      MET 128   6.251  -1.061 -10.604
  985   2HB   MET 128           HB1      MET 128   6.334   0.702 -10.593
  986   1HG   MET 128           HG2      MET 128   3.864  -0.647  -9.555
  987   2HG   MET 128           HG1      MET 128   5.298  -0.578  -8.533
  988   1HE   MET 128           HE1      MET 128   2.968   0.557  -7.329
  989   2HE   MET 128           HE3      MET 128   2.456   2.215  -7.677
  990   3HE   MET 128           HE2      MET 128   2.105   0.921  -8.821
  991    H    ILE 129           HN       ILE 129   2.958   1.551 -11.231
  992    HA   ILE 129           HA       ILE 129   3.353   3.506 -13.304
  993    HB   ILE 129           HB       ILE 129   1.863   4.935 -11.879
  994   1HG1  ILE 129          HG12      ILE 129   1.799   2.561 -10.003
  995   2HG1  ILE 129          HG11      ILE 129   2.842   3.954  -9.718
  996   1HG2  ILE 129          HG23      ILE 129   1.014   3.149 -13.455
  997   2HG2  ILE 129          HG22      ILE 129   0.900   2.067 -12.066
  998   3HG2  ILE 129          HG21      ILE 129  -0.082   3.530 -12.128
  999   1HD1  ILE 129          HD11      ILE 129  -0.113   4.289 -10.227
 1000   2HD1  ILE 129          HD13      ILE 129   0.509   3.974  -8.607
 1001   3HD1  ILE 129          HD12      ILE 129   1.006   5.426  -9.475
 1002    HA   PRO 130           HA       PRO 130   6.529   6.083 -11.554
 1003   1HB   PRO 130           HB2      PRO 130   5.597   8.578 -12.414
 1004   2HB   PRO 130           HB1      PRO 130   6.574   7.452 -13.366
 1005   1HG   PRO 130           HG2      PRO 130   3.843   8.210 -13.776
 1006   2HG   PRO 130           HG1      PRO 130   4.833   7.108 -14.742
 1007   1HD   PRO 130           HD2      PRO 130   2.758   6.476 -12.783
 1008   2HD   PRO 130           HD1      PRO 130   3.520   5.423 -13.986
 1009    H    LEU 131           HN       LEU 131   6.536   6.314  -9.347
 1010    HA   LEU 131           HA       LEU 131   4.363   7.874  -8.050
 1011   1HB   LEU 131           HB2      LEU 131   6.522   6.056  -6.951
 1012   2HB   LEU 131           HB1      LEU 131   5.436   6.997  -5.927
 1013    HG   LEU 131           HG       LEU 131   4.449   5.085  -8.056
 1014   1HD1  LEU 131          HD12      LEU 131   5.159   4.647  -5.162
 1015   2HD1  LEU 131          HD11      LEU 131   3.882   3.697  -5.920
 1016   3HD1  LEU 131          HD13      LEU 131   5.525   3.630  -6.555
 1017   1HD2  LEU 131          HD22      LEU 131   3.173   6.530  -5.714
 1018   2HD2  LEU 131          HD21      LEU 131   2.804   6.735  -7.427
 1019   3HD2  LEU 131          HD23      LEU 131   2.373   5.235  -6.606
 1020    H    ASN 132           HN       ASN 132   4.776   9.810  -7.001
 1021    HA   ASN 132           HA       ASN 132   7.246  11.201  -7.693
 1022   1HB   ASN 132           HB2      ASN 132   4.865  12.204  -7.467
 1023   2HB   ASN 132           HB1      ASN 132   5.181  12.199  -5.732
 1024   1HD2  ASN 132          HD22      ASN 132   7.144  14.861  -8.137
 1025   2HD2  ASN 132          HD21      ASN 132   6.230  13.605  -8.824
 1026    H    TRP 133           HN       TRP 133   8.786   9.824  -6.555
 1027    HA   TRP 133           HA       TRP 133   8.675   9.412  -3.705
 1028   1HB   TRP 133           HB2      TRP 133  11.013   9.350  -5.636
 1029   2HB   TRP 133           HB1      TRP 133  11.090   8.809  -3.959
 1030    HD1  TRP 133           HD1      TRP 133   9.906   7.783  -7.382
 1031    HE1  TRP 133           HE1      TRP 133   8.941   5.394  -7.281
 1032    HE3  TRP 133           HE3      TRP 133   9.778   7.096  -2.323
 1033    HZ2  TRP 133           HZ2      TRP 133   8.213   3.449  -5.315
 1034    HZ3  TRP 133           HZ3      TRP 133   8.945   4.969  -1.364
 1035    HH2  TRP 133           HH2      TRP 133   8.162   3.145  -2.852
 1036    H    ASP 134           HN       ASP 134   9.596  12.102  -5.669
 1037    HA   ASP 134           HA       ASP 134  11.458  13.389  -3.924
 1038   1HB   ASP 134           HB2      ASP 134  10.807  13.995  -6.355
 1039   2HB   ASP 134           HB1      ASP 134   9.463  14.878  -5.631
 1040    H    ASP 135           HN       ASP 135   8.005  13.007  -3.775
 1041    HA   ASP 135           HA       ASP 135   7.772  15.098  -1.675
 1042   1HB   ASP 135           HB2      ASP 135   5.818  13.565  -3.364
 1043   2HB   ASP 135           HB1      ASP 135   5.277  14.269  -1.840
 1044    H    PHE 136           HN       PHE 136   9.204  12.508  -1.284
 1045    HA   PHE 136           HA       PHE 136   7.706  11.652   1.137
 1046   1HB   PHE 136           HB2      PHE 136   8.673   9.849  -1.090
 1047   2HB   PHE 136           HB1      PHE 136   8.372   9.246   0.540
 1048    HD1  PHE 136           HD1      PHE 136   6.050   9.861   1.588
 1049    HD2  PHE 136           HD2      PHE 136   6.904   9.972  -2.619
 1050    HE1  PHE 136           HE1      PHE 136   3.624   9.725   1.092
 1051    HE2  PHE 136           HE2      PHE 136   4.479   9.837  -3.116
 1052    HZ   PHE 136           HZ       PHE 136   2.838   9.713  -1.260
 1053    H    THR 137           HN       THR 137   9.230  10.088   2.439
 1054    HA   THR 137           HA       THR 137  12.100  10.676   2.040
 1055    HB   THR 137           HB       THR 137  10.795  11.313   4.693
 1056    HG1  THR 137           HG1      THR 137  11.298  13.543   3.861
 1057   1HG2  THR 137          HG23      THR 137  13.220  10.807   4.669
 1058   2HG2  THR 137          HG22      THR 137  13.460  12.076   3.468
 1059   3HG2  THR 137          HG21      THR 137  12.909  12.491   5.092
 1060    H    LYS 138           HN       LYS 138  13.350   8.984   2.758
 1061    HA   LYS 138           HA       LYS 138  12.053   6.538   3.592
 1062   1HB   LYS 138           HB2      LYS 138  14.233   6.772   2.259
 1063   2HB   LYS 138           HB1      LYS 138  15.012   7.128   3.802
 1064   1HG   LYS 138           HG2      LYS 138  14.210   4.983   4.713
 1065   2HG   LYS 138           HG1      LYS 138  13.421   4.623   3.177
 1066   1HD   LYS 138           HD2      LYS 138  16.375   5.225   3.337
 1067   2HD   LYS 138           HD1      LYS 138  15.748   3.590   3.554
 1068   1HE   LYS 138           HE2      LYS 138  14.542   3.876   1.339
 1069   2HE   LYS 138           HE1      LYS 138  15.466   5.361   1.115
 1070   1HZ   LYS 138           HZ1      LYS 138  16.958   2.966   1.848
 1071   2HZ   LYS 138           HZ3      LYS 138  16.325   3.018   0.275
 1072   3HZ   LYS 138           HZ2      LYS 138  17.386   4.236   0.805
 1073    H    VAL 139           HN       VAL 139  12.415   5.421   5.635
 1074    HA   VAL 139           HA       VAL 139  13.386   7.088   7.891
 1075    HB   VAL 139           HB       VAL 139  11.333   6.505   9.210
 1076   1HG1  VAL 139          HG12      VAL 139  11.666   8.685   7.929
 1077   2HG1  VAL 139          HG11      VAL 139  10.643   7.996   6.669
 1078   3HG1  VAL 139          HG13      VAL 139   9.992   8.260   8.286
 1079   1HG2  VAL 139          HG23      VAL 139  10.356   5.584   6.487
 1080   2HG2  VAL 139          HG22      VAL 139  10.611   4.561   7.900
 1081   3HG2  VAL 139          HG21      VAL 139   9.334   5.777   7.912
 1082    H    SER 140           HN       SER 140  12.365   3.964   6.622
 1083    HA   SER 140           HA       SER 140  14.282   2.645   8.453
 1084   1HB   SER 140           HB2      SER 140  12.113   2.560   9.643
 1085   2HB   SER 140           HB1      SER 140  11.374   1.804   8.234
 1086    HG   SER 140           HG       SER 140  12.224   0.413  10.026
 1087    H    SER 141           HN       SER 141  15.108   0.710   7.580
 1088    HA   SER 141           HA       SER 141  13.963  -0.273   5.026
 1089   1HB   SER 141           HB2      SER 141  16.200  -0.222   3.949
 1090   2HB   SER 141           HB1      SER 141  15.632   1.397   4.350
 1091    HG   SER 141           HG       SER 141  17.395   1.565   5.467
 1092    H    ARG 142           HN       ARG 142  13.627  -2.382   5.546
 1093    HA   ARG 142           HA       ARG 142  15.570  -3.784   7.297
 1094   1HB   ARG 142           HB2      ARG 142  13.005  -3.907   7.575
 1095   2HB   ARG 142           HB1      ARG 142  13.029  -4.952   6.154
 1096   1HG   ARG 142           HG2      ARG 142  13.173  -6.452   7.981
 1097   2HG   ARG 142           HG1      ARG 142  14.835  -6.304   7.409
 1098   1HD   ARG 142           HD2      ARG 142  15.412  -4.798   9.170
 1099   2HD   ARG 142           HD1      ARG 142  13.722  -4.559   9.613
 1100    HE   ARG 142           HE       ARG 142  14.400  -7.337   9.865
 1101   1HH1  ARG 142          HH21      ARG 142  14.911  -4.234  11.343
 1102   2HH1  ARG 142          HH22      ARG 142  15.151  -4.895  12.926
 1103   1HH2  ARG 142          HH11      ARG 142  14.714  -8.182  11.924
 1104   2HH2  ARG 142          HH12      ARG 142  15.039  -7.120  13.252
 1105    H    THR 143           HN       THR 143  17.316  -4.401   6.061
 1106    HA   THR 143           HA       THR 143  16.926  -5.461   3.341
 1107    HB   THR 143           HB       THR 143  19.505  -5.436   4.919
 1108    HG1  THR 143           HG1      THR 143  18.114  -3.361   4.566
 1109   1HG2  THR 143          HG21      THR 143  18.713  -5.559   2.017
 1110   2HG2  THR 143          HG23      THR 143  20.311  -4.980   2.488
 1111   3HG2  THR 143          HG22      THR 143  19.806  -6.616   2.910
 1112    H    VAL 144           HN       VAL 144  17.342  -7.628   2.743
 1113    HA   VAL 144           HA       VAL 144  18.059  -9.588   4.818
 1114    HB   VAL 144           HB       VAL 144  15.622  -9.333   5.119
 1115   1HG1  VAL 144          HG12      VAL 144  15.139  -8.567   2.796
 1116   2HG1  VAL 144          HG11      VAL 144  15.424 -10.209   2.222
 1117   3HG1  VAL 144          HG13      VAL 144  14.077  -9.876   3.310
 1118   1HG2  VAL 144          HG23      VAL 144  16.749 -11.583   5.337
 1119   2HG2  VAL 144          HG22      VAL 144  15.032 -11.671   4.944
 1120   3HG2  VAL 144          HG21      VAL 144  16.239 -11.933   3.685
 1121    H    GLU 145           HN       GLU 145  19.189 -11.253   3.897
 1122    HA   GLU 145           HA       GLU 145  19.229 -11.379   0.913
 1123   1HB   GLU 145           HB2      GLU 145  21.287 -12.367   2.912
 1124   2HB   GLU 145           HB1      GLU 145  21.453 -12.394   1.156
 1125   1HG   GLU 145           HG2      GLU 145  21.207  -9.906   1.138
 1126   2HG   GLU 145           HG1      GLU 145  21.191  -9.929   2.902
 1127    H    ASP 146           HN       ASP 146  18.286 -13.136   0.011
 1128    HA   ASP 146           HA       ASP 146  17.364 -15.347   1.692
 1129   1HB   ASP 146           HB2      ASP 146  16.215 -14.279  -0.414
 1130   2HB   ASP 146           HB1      ASP 146  17.270 -15.371  -1.313
 1131    H    THR 147           HN       THR 147  17.680 -17.546   0.006
 1132    HA   THR 147           HA       THR 147  20.397 -18.337   0.613
 1133    HB   THR 147           HB       THR 147  19.754 -20.411  -0.695
 1134    HG1  THR 147           HG1      THR 147  18.055 -20.299  -1.895
 1135   1HG2  THR 147          HG23      THR 147  19.350 -20.111   1.762
 1136   2HG2  THR 147          HG22      THR 147  17.730 -19.528   1.379
 1137   3HG2  THR 147          HG21      THR 147  18.188 -21.186   0.985
 1138    H    ASN 148           HN       ASN 148  18.691 -17.380  -2.351
 1139    HA   ASN 148           HA       ASN 148  21.265 -17.577  -3.841
 1140   1HB   ASN 148           HB2      ASN 148  19.132 -18.695  -4.713
 1141   2HB   ASN 148           HB1      ASN 148  18.528 -17.066  -5.022
 1142   1HD2  ASN 148          HD22      ASN 148  21.045 -18.723  -7.661
 1143   2HD2  ASN 148          HD21      ASN 148  20.284 -19.601  -6.424
 1144    HA   PRO 149           HA       PRO 149  21.968 -13.180  -3.621
 1145   1HB   PRO 149           HB2      PRO 149  22.804 -13.098  -6.401
 1146   2HB   PRO 149           HB1      PRO 149  23.786 -12.930  -4.941
 1147   1HG   PRO 149           HG2      PRO 149  23.568 -15.189  -6.694
 1148   2HG   PRO 149           HG1      PRO 149  24.608 -14.988  -5.276
 1149   1HD   PRO 149           HD2      PRO 149  22.403 -16.714  -5.486
 1150   2HD   PRO 149           HD1      PRO 149  23.252 -16.271  -3.998
 1151    H    ALA 150           HN       ALA 150  20.488 -14.416  -6.631
 1152    HA   ALA 150           HA       ALA 150  19.213 -11.963  -7.375
 1153   1HB   ALA 150           HB3      ALA 150  19.533 -13.944  -8.884
 1154   2HB   ALA 150           HB2      ALA 150  18.271 -14.781  -7.980
 1155   3HB   ALA 150           HB1      ALA 150  17.883 -13.320  -8.888
 1156    H    LEU 151           HN       LEU 151  18.366 -14.468  -5.085
 1157    HA   LEU 151           HA       LEU 151  15.585 -13.581  -4.814
 1158   1HB   LEU 151           HB2      LEU 151  17.325 -15.569  -3.358
 1159   2HB   LEU 151           HB1      LEU 151  15.734 -15.127  -2.739
 1160    HG   LEU 151           HG       LEU 151  16.182 -16.070  -5.579
 1161   1HD1  LEU 151          HD11      LEU 151  16.814 -17.749  -3.724
 1162   2HD1  LEU 151          HD13      LEU 151  15.098 -17.756  -3.318
 1163   3HD1  LEU 151          HD12      LEU 151  15.628 -18.279  -4.917
 1164   1HD2  LEU 151          HD22      LEU 151  13.761 -15.705  -3.791
 1165   2HD2  LEU 151          HD21      LEU 151  14.117 -14.859  -5.296
 1166   3HD2  LEU 151          HD23      LEU 151  13.705 -16.573  -5.324
 1167    H    THR 152           HN       THR 152  18.035 -11.781  -4.247
 1168    HA   THR 152           HA       THR 152  17.683 -11.173  -1.383
 1169    HB   THR 152           HB       THR 152  19.315  -9.710  -3.482
 1170    HG1  THR 152           HG1      THR 152  19.852 -11.965  -3.075
 1171   1HG2  THR 152          HG23      THR 152  19.178  -9.613  -0.466
 1172   2HG2  THR 152          HG22      THR 152  20.588  -9.037  -1.356
 1173   3HG2  THR 152          HG21      THR 152  19.016  -8.279  -1.609
 1174    H    HIS 153           HN       HIS 153  16.576  -9.384  -0.597
 1175    HA   HIS 153           HA       HIS 153  15.523  -7.362  -2.467
 1176   1HB   HIS 153           HB2      HIS 153  13.172  -7.729  -1.664
 1177   2HB   HIS 153           HB1      HIS 153  13.796  -9.063  -2.635
 1178    HD1  HIS 153           HD1      HIS 153  14.880 -11.101  -1.135
 1179    HD2  HIS 153           HD2      HIS 153  12.242  -8.529   0.817
 1180    HE1  HIS 153           HE1      HIS 153  14.134 -12.300   0.969
 1181    H    THR 154           HN       THR 154  14.299  -5.643  -1.198
 1182    HA   THR 154           HA       THR 154  15.075  -5.546   1.673
 1183    HB   THR 154           HB       THR 154  15.561  -3.236  -0.223
 1184    HG1  THR 154           HG1      THR 154  17.808  -3.871   0.207
 1185   1HG2  THR 154          HG22      THR 154  15.961  -3.771   2.691
 1186   2HG2  THR 154          HG21      THR 154  17.129  -2.743   1.862
 1187   3HG2  THR 154          HG23      THR 154  15.422  -2.297   1.886
 1188    H    TYR 155           HN       TYR 155  13.413  -4.774   2.894
 1189    HA   TYR 155           HA       TYR 155  10.977  -3.842   1.531
 1190   1HB   TYR 155           HB2      TYR 155  11.597  -4.328   4.461
 1191   2HB   TYR 155           HB1      TYR 155  10.010  -3.881   3.834
 1192    HD1  TYR 155           HD2      TYR 155   8.738  -5.428   2.392
 1193    HD2  TYR 155           HD1      TYR 155  12.511  -6.547   4.113
 1194    HE1  TYR 155           HE2      TYR 155   8.274  -7.806   1.864
 1195    HE2  TYR 155           HE1      TYR 155  12.048  -8.925   3.585
 1196    HH   TYR 155           HH       TYR 155   8.963  -9.907   2.098
 1197    H    GLU 156           HN       GLU 156  11.489  -1.754   0.779
 1198    HA   GLU 156           HA       GLU 156  12.667   0.248   2.548
 1199   1HB   GLU 156           HB2      GLU 156  11.455   0.345  -0.220
 1200   2HB   GLU 156           HB1      GLU 156  11.993   1.802   0.617
 1201   1HG   GLU 156           HG2      GLU 156  14.229   0.577   0.960
 1202   2HG   GLU 156           HG1      GLU 156  13.649  -0.571  -0.247
 1203    H    VAL 157           HN       VAL 157  11.581   1.835   3.692
 1204    HA   VAL 157           HA       VAL 157   8.598   1.862   3.486
 1205    HB   VAL 157           HB       VAL 157  10.197   2.108   6.051
 1206   1HG1  VAL 157          HG13      VAL 157   7.229   1.875   5.466
 1207   2HG1  VAL 157          HG12      VAL 157   7.938   1.816   7.080
 1208   3HG1  VAL 157          HG11      VAL 157   8.061   3.288   6.116
 1209   1HG2  VAL 157          HG21      VAL 157   8.848  -0.223   4.701
 1210   2HG2  VAL 157          HG23      VAL 157  10.426  -0.162   5.488
 1211   3HG2  VAL 157          HG22      VAL 157   8.954  -0.159   6.460
 1212    H    TRP 158           HN       TRP 158   8.074   3.849   2.722
 1213    HA   TRP 158           HA       TRP 158   9.697   6.189   3.638
 1214   1HB   TRP 158           HB2      TRP 158   8.002   5.827   1.147
 1215   2HB   TRP 158           HB1      TRP 158   8.817   7.325   1.596
 1216    HD1  TRP 158           HD1      TRP 158   9.814   3.605   1.147
 1217    HE1  TRP 158           HE1      TRP 158  12.131   3.533   0.018
 1218    HE3  TRP 158           HE3      TRP 158  10.770   8.607   0.776
 1219    HZ2  TRP 158           HZ2      TRP 158  14.126   5.357  -0.918
 1220    HZ3  TRP 158           HZ3      TRP 158  12.883   9.411  -0.238
 1221    HH2  TRP 158           HH2      TRP 158  14.562   7.794  -1.085
 1222    H    GLN 159           HN       GLN 159   8.373   8.250   3.815
 1223    HA   GLN 159           HA       GLN 159   5.528   7.779   4.530
 1224   1HB   GLN 159           HB2      GLN 159   7.649   8.901   6.375
 1225   2HB   GLN 159           HB1      GLN 159   5.923   9.147   6.643
 1226   1HG   GLN 159           HG2      GLN 159   5.722   6.578   6.435
 1227   2HG   GLN 159           HG1      GLN 159   7.471   6.558   6.661
 1228   1HE2  GLN 159          HE21      GLN 159   7.997   8.383   8.597
 1229   2HE2  GLN 159          HE22      GLN 159   7.122   8.068  10.017
 1230    H    LYS 160           HN       LYS 160   4.236   9.597   4.190
 1231    HA   LYS 160           HA       LYS 160   5.254  11.640   2.434
 1232   1HB   LYS 160           HB2      LYS 160   2.821  10.740   2.707
 1233   2HB   LYS 160           HB1      LYS 160   2.702  11.923   4.009
 1234   1HG   LYS 160           HG2      LYS 160   3.515  13.671   2.367
 1235   2HG   LYS 160           HG1      LYS 160   3.338  12.459   1.097
 1236   1HD   LYS 160           HD2      LYS 160   1.013  12.396   1.293
 1237   2HD   LYS 160           HD1      LYS 160   1.037  12.999   2.951
 1238   1HE   LYS 160           HE2      LYS 160   1.898  15.198   2.039
 1239   2HE   LYS 160           HE1      LYS 160   1.580  14.573   0.421
 1240   1HZ   LYS 160           HZ2      LYS 160  -0.451  14.764   2.578
 1241   2HZ   LYS 160           HZ1      LYS 160  -0.262  15.903   1.331
 1242   3HZ   LYS 160           HZ3      LYS 160  -0.722  14.314   0.962
 1243    H    LYS 161           HN       LYS 161   6.250  13.521   2.965
 1244    HA   LYS 161           HA       LYS 161   5.685  14.822   5.556
 1245   1HB   LYS 161           HB2      LYS 161   7.609  13.180   5.887
 1246   2HB   LYS 161           HB1      LYS 161   8.540  14.184   4.776
 1247   1HG   LYS 161           HG2      LYS 161   7.851  16.156   6.321
 1248   2HG   LYS 161           HG1      LYS 161   7.460  14.899   7.496
 1249   1HD   LYS 161           HD2      LYS 161  10.138  15.046   6.095
 1250   2HD   LYS 161           HD1      LYS 161   9.826  15.837   7.642
 1251   1HE   LYS 161           HE2      LYS 161   9.359  12.885   7.147
 1252   2HE   LYS 161           HE1      LYS 161  10.843  13.534   7.845
 1253   1HZ   LYS 161           HZ1      LYS 161   8.613  14.635   9.168
 1254   2HZ   LYS 161           HZ3      LYS 161   8.465  12.946   9.155
 1255   3HZ   LYS 161           HZ2      LYS 161   9.858  13.670   9.805
 1256    H    ALA 162           HN       ALA 162   6.156  17.055   5.508
 1257    HA   ALA 162           HA       ALA 162   6.494  18.177   2.803
 1258   1HB   ALA 162           HB1      ALA 162   5.995  19.531   5.473
 1259   2HB   ALA 162           HB3      ALA 162   5.968  20.332   3.901
 1260   3HB   ALA 162           HB2      ALA 162   4.760  19.106   4.287
 1261   1H9   TMQ 170           H91      TMQ 170  -0.781  -9.756  -6.480
 1262   2H9   TMQ 170           H92      TMQ 170  -1.585 -10.490  -5.084
 1263    HN1  TMQ 170           H1N      TMQ 170  -0.318 -11.873  -7.183
 1264   1H17  TMQ 170           HM1      TMQ 170  -1.713  -8.577  -4.586
 1265   2H17  TMQ 170           HM2      TMQ 170  -1.484  -8.155  -2.890
 1266   3H17  TMQ 170           HM3      TMQ 170  -0.895  -7.076  -4.162
 1267   1H21  TMQ 170          HW11      TMQ 170  -1.873 -12.896  -0.350
 1268   2H21  TMQ 170          HW12      TMQ 170  -2.360 -12.262  -1.930
 1269   3H21  TMQ 170          HW13      TMQ 170  -0.651 -12.264  -1.464
 1270   1H22  TMQ 170           HI1      TMQ 170   1.175 -17.249  -1.711
 1271   2H22  TMQ 170           HI2      TMQ 170   1.890 -16.322  -3.040
 1272   3H22  TMQ 170           HI3      TMQ 170   1.138 -15.480  -1.676
 1273   1H23  TMQ 170          HW21      TMQ 170   1.387 -15.937  -7.496
 1274   2H23  TMQ 170          HW22      TMQ 170   2.506 -17.095  -6.761
 1275   3H23  TMQ 170          HW23      TMQ 170   2.575 -15.386  -6.305
 1276   1HN2  TMQ 170          HN21      TMQ 170   5.617  -8.036  -0.807
 1277   2HN2  TMQ 170          HN22      TMQ 170   4.763  -6.714  -0.085
 1278   1HN5  TMQ 170          HN41      TMQ 170  -0.446  -6.559  -2.304
 1279   2HN5  TMQ 170          HN42      TMQ 170   0.506  -5.711  -1.165
 1280    HN   TMQ 170           H1       TMQ 170   4.579  -9.344  -2.370
 1281    H7   TMQ 170           H7       TMQ 170   1.806 -11.521  -5.439
 1282    H8   TMQ 170           H8       TMQ 170   3.698 -10.853  -4.029
 1283    H12  TMQ 170           HP2      TMQ 170  -1.432 -12.003  -3.739
 1284    H16  TMQ 170           HP6      TMQ 170   0.694 -14.061  -6.888
   
  No H/Q in entry =        1284
  Start of MODEL    9
    1   1H    THR   1           HT2      THR   1  -3.215   5.930   4.838
    2   2H    THR   1           HT1      THR   1  -3.160   6.920   3.457
    3   3H    THR   1           HT3      THR   1  -4.654   6.382   4.054
    4    HA   THR   1           HA       THR   1  -4.282   4.183   3.387
    5    HB   THR   1           HB       THR   1  -3.030   5.842   1.189
    6    HG1  THR   1           HG1      THR   1  -5.539   5.875   0.789
    7   1HG2  THR   1          HG22      THR   1  -4.716   3.347   1.343
    8   2HG2  THR   1          HG21      THR   1  -4.614   4.295  -0.141
    9   3HG2  THR   1          HG23      THR   1  -3.158   3.573   0.546
   10    H    ALA   2           HN       ALA   2  -2.776   2.558   2.496
   11    HA   ALA   2           HA       ALA   2   0.101   3.200   2.975
   12   1HB   ALA   2           HB2      ALA   2  -0.967   1.976   4.930
   13   2HB   ALA   2           HB1      ALA   2  -1.218   0.613   3.839
   14   3HB   ALA   2           HB3      ALA   2   0.419   1.160   4.207
   15    H    PHE   3           HN       PHE   3   0.811   3.080   0.870
   16    HA   PHE   3           HA       PHE   3  -0.216   1.120  -1.020
   17   1HB   PHE   3           HB2      PHE   3   1.933   3.212  -1.044
   18   2HB   PHE   3           HB1      PHE   3   1.949   1.963  -2.288
   19    HD1  PHE   3           HD2      PHE   3  -0.770   3.900  -0.556
   20    HD2  PHE   3           HD1      PHE   3   1.023   2.721  -4.278
   21    HE1  PHE   3           HE2      PHE   3  -2.551   5.102  -1.796
   22    HE2  PHE   3           HE1      PHE   3  -0.757   3.925  -5.516
   23    HZ   PHE   3           HZ       PHE   3  -2.543   5.115  -4.275
   24    H    LEU   4           HN       LEU   4   0.740  -0.817  -1.643
   25    HA   LEU   4           HA       LEU   4   3.394  -1.565  -0.603
   26   1HB   LEU   4           HB2      LEU   4   1.798  -2.129   1.242
   27   2HB   LEU   4           HB1      LEU   4   0.929  -3.180   0.124
   28    HG   LEU   4           HG       LEU   4   3.316  -4.233  -0.271
   29   1HD1  LEU   4          HD12      LEU   4   3.585  -2.644   2.261
   30   2HD1  LEU   4          HD11      LEU   4   4.412  -4.197   2.132
   31   3HD1  LEU   4          HD13      LEU   4   4.767  -2.911   0.979
   32   1HD2  LEU   4          HD22      LEU   4   1.518  -4.652   2.127
   33   2HD2  LEU   4          HD21      LEU   4   1.547  -5.567   0.620
   34   3HD2  LEU   4          HD23      LEU   4   2.874  -5.722   1.771
   35    H    TRP   5           HN       TRP   5   4.303  -2.313  -2.464
   36    HA   TRP   5           HA       TRP   5   2.871  -4.430  -3.962
   37   1HB   TRP   5           HB2      TRP   5   3.264  -3.344  -6.124
   38   2HB   TRP   5           HB1      TRP   5   2.294  -2.295  -5.093
   39    HD1  TRP   5           HD1      TRP   5   5.332  -2.308  -7.161
   40    HE1  TRP   5           HE1      TRP   5   6.731  -0.182  -6.764
   41    HE3  TRP   5           HE3      TRP   5   3.062  -0.527  -2.941
   42    HZ2  TRP   5           HZ2      TRP   5   6.872   1.986  -4.906
   43    HZ3  TRP   5           HZ3      TRP   5   3.854   1.567  -1.881
   44    HH2  TRP   5           HH2      TRP   5   5.752   2.826  -2.858
   45    H    ALA   6           HN       ALA   6   4.282  -5.870  -5.027
   46    HA   ALA   6           HA       ALA   6   7.132  -5.625  -4.206
   47   1HB   ALA   6           HB3      ALA   6   5.615  -7.722  -3.803
   48   2HB   ALA   6           HB2      ALA   6   5.929  -8.059  -5.506
   49   3HB   ALA   6           HB1      ALA   6   7.271  -7.960  -4.364
   50    H    GLN   7           HN       GLN   7   8.450  -4.747  -5.722
   51    HA   GLN   7           HA       GLN   7   8.033  -5.532  -8.572
   52   1HB   GLN   7           HB2      GLN   7   8.687  -3.197  -9.216
   53   2HB   GLN   7           HB1      GLN   7   7.148  -3.277  -8.358
   54   1HG   GLN   7           HG2      GLN   7   8.114  -2.492  -6.333
   55   2HG   GLN   7           HG1      GLN   7   9.755  -2.782  -6.913
   56   1HE2  GLN   7          HE22      GLN   7   9.982   0.539  -8.035
   57   2HE2  GLN   7          HE21      GLN   7  10.727  -0.782  -7.270
   58    H    ASP   8           HN       ASP   8  10.034  -5.269  -9.877
   59    HA   ASP   8           HA       ASP   8  12.460  -5.692  -8.185
   60   1HB   ASP   8           HB2      ASP   8  13.382  -6.812 -10.256
   61   2HB   ASP   8           HB1      ASP   8  11.993  -7.632  -9.545
   62    H    ARG   9           HN       ARG   9  14.539  -4.971  -9.351
   63    HA   ARG   9           HA       ARG   9  14.447  -2.164  -9.827
   64   1HB   ARG   9           HB2      ARG   9  16.795  -2.470 -10.664
   65   2HB   ARG   9           HB1      ARG   9  16.505  -3.219  -9.094
   66   1HG   ARG   9           HG2      ARG   9  16.271  -5.403 -10.101
   67   2HG   ARG   9           HG1      ARG   9  16.312  -4.712 -11.724
   68   1HD   ARG   9           HD2      ARG   9  18.647  -3.900 -10.185
   69   2HD   ARG   9           HD1      ARG   9  18.509  -5.656 -10.259
   70    HE   ARG   9           HE       ARG   9  18.857  -5.555 -12.610
   71   1HH1  ARG   9          HH21      ARG   9  18.408  -2.403 -11.219
   72   2HH1  ARG   9          HH22      ARG   9  18.911  -1.570 -12.652
   73   1HH2  ARG   9          HH11      ARG   9  19.507  -4.462 -14.461
   74   2HH2  ARG   9          HH12      ARG   9  19.530  -2.730 -14.478
   75    H    ASP  10           HN       ASP  10  13.724  -4.793 -11.909
   76    HA   ASP  10           HA       ASP  10  14.383  -3.451 -14.413
   77   1HB   ASP  10           HB2      ASP  10  12.975  -5.972 -13.622
   78   2HB   ASP  10           HB1      ASP  10  12.702  -5.334 -15.244
   79    H    GLY  11           HN       GLY  11  12.366  -2.363 -12.253
   80   1HA   GLY  11           HA2      GLY  11  10.449  -1.014 -12.321
   81   2HA   GLY  11           HA1      GLY  11  10.708  -0.903 -14.062
   82    H    LEU  12           HN       LEU  12  10.213  -3.933 -12.325
   83    HA   LEU  12           HA       LEU  12   7.602  -4.226 -13.760
   84   1HB   LEU  12           HB2      LEU  12   9.620  -5.741 -14.394
   85   2HB   LEU  12           HB1      LEU  12   9.299  -6.548 -12.857
   86    HG   LEU  12           HG       LEU  12   6.841  -6.671 -13.680
   87   1HD1  LEU  12          HD12      LEU  12   7.428  -5.081 -15.627
   88   2HD1  LEU  12          HD11      LEU  12   8.177  -6.489 -16.382
   89   3HD1  LEU  12          HD13      LEU  12   6.452  -6.499 -16.012
   90   1HD2  LEU  12          HD21      LEU  12   8.610  -8.541 -13.533
   91   2HD2  LEU  12          HD23      LEU  12   7.253  -8.811 -14.628
   92   3HD2  LEU  12          HD22      LEU  12   8.818  -8.314 -15.270
   93    H    ILE  13           HN       ILE  13   5.903  -5.296 -12.597
   94    HA   ILE  13           HA       ILE  13   6.347  -5.421  -9.639
   95    HB   ILE  13           HB       ILE  13   3.947  -4.768  -9.412
   96   1HG1  ILE  13          HG12      ILE  13   3.226  -3.578 -11.742
   97   2HG1  ILE  13          HG11      ILE  13   4.150  -4.940 -12.375
   98   1HG2  ILE  13          HG23      ILE  13   5.990  -3.023 -10.737
   99   2HG2  ILE  13          HG22      ILE  13   4.362  -2.385 -10.502
  100   3HG2  ILE  13          HG21      ILE  13   5.312  -2.915  -9.113
  101   1HD1  ILE  13          HD12      ILE  13   2.704  -6.230 -10.496
  102   2HD1  ILE  13          HD11      ILE  13   1.579  -4.927 -10.882
  103   3HD1  ILE  13          HD13      ILE  13   2.137  -6.016 -12.152
  104    H    GLY  14           HN       GLY  14   4.533  -6.755 -12.393
  105   1HA   GLY  14           HA2      GLY  14   4.664  -9.432 -11.242
  106   2HA   GLY  14           HA1      GLY  14   3.031  -8.761 -11.236
  107    H    LYS  15           HN       LYS  15   2.794 -10.739 -12.735
  108    HA   LYS  15           HA       LYS  15   2.704  -9.773 -15.483
  109   1HB   LYS  15           HB2      LYS  15   5.087 -10.617 -15.175
  110   2HB   LYS  15           HB1      LYS  15   4.398 -12.225 -14.948
  111   1HG   LYS  15           HG2      LYS  15   3.134 -11.687 -17.192
  112   2HG   LYS  15           HG1      LYS  15   4.431 -10.513 -17.414
  113   1HD   LYS  15           HD2      LYS  15   6.116 -12.229 -17.261
  114   2HD   LYS  15           HD1      LYS  15   4.921 -13.431 -16.770
  115   1HE   LYS  15           HE2      LYS  15   3.757 -12.879 -19.025
  116   2HE   LYS  15           HE1      LYS  15   5.301 -12.157 -19.474
  117   1HZ   LYS  15           HZ3      LYS  15   6.244 -14.393 -18.616
  118   2HZ   LYS  15           HZ2      LYS  15   4.666 -14.966 -18.879
  119   3HZ   LYS  15           HZ1      LYS  15   5.563 -14.315 -20.168
  120    H    ASP  16           HN       ASP  16   0.820 -10.570 -16.267
  121    HA   ASP  16           HA       ASP  16  -1.046 -11.957 -16.559
  122   1HB   ASP  16           HB2      ASP  16   1.226 -13.821 -16.100
  123   2HB   ASP  16           HB1      ASP  16  -0.391 -14.499 -15.911
  124    H    GLY  17           HN       GLY  17  -0.579 -10.659 -13.969
  125   1HA   GLY  17           HA2      GLY  17  -1.989 -10.630 -12.038
  126   2HA   GLY  17           HA1      GLY  17  -2.440 -12.303 -12.372
  127    H    HIS  18           HN       HIS  18  -0.361 -13.818 -12.276
  128    HA   HIS  18           HA       HIS  18   0.611 -13.662  -9.546
  129   1HB   HIS  18           HB2      HIS  18   1.936 -15.692 -10.196
  130   2HB   HIS  18           HB1      HIS  18   0.215 -15.842 -10.543
  131    HD1  HIS  18           HD1      HIS  18   3.513 -15.136 -12.274
  132    HD2  HIS  18           HD2      HIS  18  -0.406 -16.164 -13.256
  133    HE1  HIS  18           HE1      HIS  18   3.510 -15.663 -14.751
  134    H    LEU  19           HN       LEU  19   3.095 -13.995  -9.199
  135    HA   LEU  19           HA       LEU  19   4.445 -11.752 -10.582
  136   1HB   LEU  19           HB2      LEU  19   5.290 -13.412  -8.187
  137   2HB   LEU  19           HB1      LEU  19   6.152 -12.003  -8.804
  138    HG   LEU  19           HG       LEU  19   3.244 -11.698  -8.188
  139   1HD1  LEU  19          HD13      LEU  19   5.449 -12.080  -6.171
  140   2HD1  LEU  19          HD12      LEU  19   4.081 -11.027  -5.809
  141   3HD1  LEU  19          HD11      LEU  19   3.811 -12.736  -6.156
  142   1HD2  LEU  19          HD22      LEU  19   4.986  -9.970  -9.152
  143   2HD2  LEU  19          HD21      LEU  19   3.819  -9.449  -7.937
  144   3HD2  LEU  19          HD23      LEU  19   5.477  -9.822  -7.465
  145    HA   PRO  20           HA       PRO  20   7.036 -14.449 -13.003
  146   1HB   PRO  20           HB2      PRO  20   9.204 -12.718 -13.301
  147   2HB   PRO  20           HB1      PRO  20   7.744 -12.721 -14.299
  148   1HG   PRO  20           HG2      PRO  20   8.612 -10.738 -12.407
  149   2HG   PRO  20           HG1      PRO  20   7.208 -10.700 -13.482
  150   1HD   PRO  20           HD2      PRO  20   7.303 -11.245 -10.625
  151   2HD   PRO  20           HD1      PRO  20   5.895 -10.957 -11.661
  152    H    TRP  21           HN       TRP  21   8.246 -13.036 -10.044
  153    HA   TRP  21           HA       TRP  21  10.459 -15.040  -9.969
  154   1HB   TRP  21           HB2      TRP  21  11.338 -13.632  -8.087
  155   2HB   TRP  21           HB1      TRP  21  11.230 -12.762  -9.617
  156    HD1  TRP  21           HD1      TRP  21   9.376 -13.156  -6.273
  157    HE1  TRP  21           HE1      TRP  21   7.960 -11.040  -5.870
  158    HE3  TRP  21           HE3      TRP  21  10.133 -10.731 -10.703
  159    HZ2  TRP  21           HZ2      TRP  21   7.243  -8.636  -7.246
  160    HZ3  TRP  21           HZ3      TRP  21   9.072  -8.532 -11.130
  161    HH2  TRP  21           HH2      TRP  21   7.630  -7.482  -9.409
  162    H    HIS  22           HN       HIS  22  10.822 -16.081  -7.813
  163    HA   HIS  22           HA       HIS  22   8.215 -16.571  -6.426
  164   1HB   HIS  22           HB2      HIS  22   9.242 -18.506  -7.720
  165   2HB   HIS  22           HB1      HIS  22  10.570 -18.470  -6.560
  166    HD1  HIS  22           HD1      HIS  22   6.750 -18.461  -6.317
  167    HD2  HIS  22           HD2      HIS  22  10.065 -20.207  -4.488
  168    HE1  HIS  22           HE1      HIS  22   5.849 -19.990  -4.511
  169    H    LEU  23           HN       LEU  23   8.376 -15.192  -4.672
  170    HA   LEU  23           HA       LEU  23  10.802 -15.506  -2.946
  171   1HB   LEU  23           HB2      LEU  23  10.379 -13.217  -4.049
  172   2HB   LEU  23           HB1      LEU  23   9.000 -13.081  -2.957
  173    HG   LEU  23           HG       LEU  23  10.546 -13.495  -1.031
  174   1HD1  LEU  23          HD11      LEU  23  12.505 -13.609  -3.305
  175   2HD1  LEU  23          HD13      LEU  23  13.036 -12.984  -1.743
  176   3HD1  LEU  23          HD12      LEU  23  12.405 -14.626  -1.868
  177   1HD2  LEU  23          HD23      LEU  23  10.012 -11.168  -2.298
  178   2HD2  LEU  23          HD22      LEU  23  11.041 -11.256  -0.869
  179   3HD2  LEU  23          HD21      LEU  23  11.767 -11.192  -2.474
  180    HA   PRO  24           HA       PRO  24   7.183 -17.554  -0.781
  181   1HB   PRO  24           HB2      PRO  24   9.296 -18.610   0.926
  182   2HB   PRO  24           HB1      PRO  24   8.151 -19.483  -0.100
  183   1HG   PRO  24           HG2      PRO  24  10.923 -18.957  -0.584
  184   2HG   PRO  24           HG1      PRO  24   9.785 -19.864  -1.588
  185   1HD   PRO  24           HD2      PRO  24  10.925 -17.376  -2.210
  186   2HD   PRO  24           HD1      PRO  24   9.560 -18.141  -3.037
  187    H    ASP  25           HN       ASP  25  10.029 -15.863   0.505
  188    HA   ASP  25           HA       ASP  25   9.018 -15.379   3.136
  189   1HB   ASP  25           HB2      ASP  25  11.403 -14.971   2.065
  190   2HB   ASP  25           HB1      ASP  25  10.754 -13.359   1.756
  191    H    ASP  26           HN       ASP  26   8.878 -13.395   0.168
  192    HA   ASP  26           HA       ASP  26   7.428 -11.216   1.318
  193   1HB   ASP  26           HB2      ASP  26   8.585 -11.148  -0.899
  194   2HB   ASP  26           HB1      ASP  26   7.330 -12.202  -1.550
  195    H    LEU  27           HN       LEU  27   6.372 -14.258  -0.163
  196    HA   LEU  27           HA       LEU  27   3.570 -13.658  -0.234
  197   1HB   LEU  27           HB2      LEU  27   5.009 -16.317   0.015
  198   2HB   LEU  27           HB1      LEU  27   3.288 -16.139  -0.330
  199    HG   LEU  27           HG       LEU  27   5.491 -14.928  -2.023
  200   1HD1  LEU  27          HD13      LEU  27   4.118 -17.582  -2.078
  201   2HD1  LEU  27          HD12      LEU  27   4.436 -16.790  -3.621
  202   3HD1  LEU  27          HD11      LEU  27   5.771 -17.165  -2.531
  203   1HD2  LEU  27          HD21      LEU  27   2.484 -15.113  -2.228
  204   2HD2  LEU  27          HD23      LEU  27   3.505 -13.680  -2.351
  205   3HD2  LEU  27          HD22      LEU  27   3.484 -14.863  -3.659
  206    H    HIS  28           HN       HIS  28   5.720 -14.564   2.345
  207    HA   HIS  28           HA       HIS  28   3.525 -15.347   4.151
  208   1HB   HIS  28           HB2      HIS  28   6.523 -15.122   4.440
  209   2HB   HIS  28           HB1      HIS  28   5.481 -15.378   5.841
  210    HD1  HIS  28           HD1      HIS  28   3.414 -17.307   4.655
  211    HD2  HIS  28           HD2      HIS  28   7.516 -17.685   4.017
  212    HE1  HIS  28           HE1      HIS  28   3.824 -19.731   4.048
  213    H    TYR  29           HN       TYR  29   5.533 -12.552   3.461
  214    HA   TYR  29           HA       TYR  29   4.843 -11.090   5.871
  215   1HB   TYR  29           HB2      TYR  29   6.862 -10.649   4.393
  216   2HB   TYR  29           HB1      TYR  29   5.752  -9.929   3.225
  217    HD1  TYR  29           HD1      TYR  29   6.190  -9.809   6.957
  218    HD2  TYR  29           HD2      TYR  29   5.685  -7.609   3.303
  219    HE1  TYR  29           HE1      TYR  29   6.224  -7.681   8.233
  220    HE2  TYR  29           HE2      TYR  29   5.718  -5.483   4.578
  221    HH   TYR  29           HH       TYR  29   5.222  -4.749   6.939
  222    H    PHE  30           HN       PHE  30   3.334 -11.604   2.778
  223    HA   PHE  30           HA       PHE  30   1.634  -9.304   2.703
  224   1HB   PHE  30           HB2      PHE  30   2.031 -10.965   0.821
  225   2HB   PHE  30           HB1      PHE  30   0.938 -12.063   1.664
  226    HD1  PHE  30           HD1      PHE  30   1.150  -8.583   0.302
  227    HD2  PHE  30           HD2      PHE  30  -1.388 -11.880   1.373
  228    HE1  PHE  30           HE1      PHE  30  -0.797  -7.404  -0.681
  229    HE2  PHE  30           HE2      PHE  30  -3.335 -10.700   0.390
  230    HZ   PHE  30           HZ       PHE  30  -3.040  -8.461  -0.636
  231    H    ARG  31           HN       ARG  31   1.138 -12.565   4.066
  232    HA   ARG  31           HA       ARG  31  -1.530 -12.090   5.006
  233   1HB   ARG  31           HB2      ARG  31  -0.359 -14.342   4.779
  234   2HB   ARG  31           HB1      ARG  31   0.491 -13.954   6.276
  235   1HG   ARG  31           HG2      ARG  31  -1.477 -13.987   7.554
  236   2HG   ARG  31           HG1      ARG  31  -2.510 -13.759   6.142
  237   1HD   ARG  31           HD2      ARG  31  -2.815 -16.029   6.529
  238   2HD   ARG  31           HD1      ARG  31  -1.464 -16.070   5.395
  239    HE   ARG  31           HE       ARG  31  -1.318 -16.649   8.289
  240   1HH1  ARG  31          HH11      ARG  31   0.316 -16.053   5.281
  241   2HH1  ARG  31          HH12      ARG  31   1.804 -16.763   5.811
  242   1HH2  ARG  31          HH21      ARG  31   0.618 -17.567   8.966
  243   2HH2  ARG  31          HH22      ARG  31   1.973 -17.617   7.887
  244    H    ALA  32           HN       ALA  32   1.637 -11.336   6.311
  245    HA   ALA  32           HA       ALA  32   0.673 -10.722   8.992
  246   1HB   ALA  32           HB1      ALA  32   3.048 -11.377   8.442
  247   2HB   ALA  32           HB3      ALA  32   3.240  -9.802   7.670
  248   3HB   ALA  32           HB2      ALA  32   2.912  -9.901   9.400
  249    H    GLN  33           HN       GLN  33   1.087  -8.976   5.981
  250    HA   GLN  33           HA       GLN  33   0.422  -6.410   7.338
  251   1HB   GLN  33           HB2      GLN  33   1.522  -7.093   4.608
  252   2HB   GLN  33           HB1      GLN  33   0.897  -5.486   4.981
  253   1HG   GLN  33           HG2      GLN  33   3.014  -6.862   6.652
  254   2HG   GLN  33           HG1      GLN  33   3.396  -5.765   5.325
  255   1HE2  GLN  33          HE22      GLN  33   2.798  -4.095   8.819
  256   2HE2  GLN  33          HE21      GLN  33   3.414  -5.650   8.529
  257    H    THR  34           HN       THR  34  -1.573  -8.506   7.025
  258    HA   THR  34           HA       THR  34  -3.548  -6.965   5.422
  259    HB   THR  34           HB       THR  34  -4.451  -9.221   4.606
  260    HG1  THR  34           HG1      THR  34  -2.134 -10.463   4.557
  261   1HG2  THR  34          HG22      THR  34  -1.766  -8.167   3.690
  262   2HG2  THR  34          HG21      THR  34  -2.703  -9.357   2.786
  263   3HG2  THR  34          HG23      THR  34  -3.356  -7.741   3.055
  264    H    VAL  35           HN       VAL  35  -2.868  -9.409   7.879
  265    HA   VAL  35           HA       VAL  35  -5.594  -9.733   8.765
  266    HB   VAL  35           HB       VAL  35  -4.528 -10.685  10.827
  267   1HG1  VAL  35          HG11      VAL  35  -3.503 -11.559   8.115
  268   2HG1  VAL  35          HG13      VAL  35  -3.276 -12.508   9.583
  269   3HG1  VAL  35          HG12      VAL  35  -4.903 -12.185   8.984
  270   1HG2  VAL  35          HG23      VAL  35  -2.026  -9.725   9.411
  271   2HG2  VAL  35          HG22      VAL  35  -2.576  -9.283  11.027
  272   3HG2  VAL  35          HG21      VAL  35  -2.003 -10.921  10.707
  273    H    GLY  36           HN       GLY  36  -6.799  -8.343   9.955
  274   1HA   GLY  36           HA2      GLY  36  -7.296  -6.707  11.598
  275   2HA   GLY  36           HA1      GLY  36  -5.571  -6.572  11.940
  276    H    LYS  37           HN       LYS  37  -7.020  -6.279   8.733
  277    HA   LYS  37           HA       LYS  37  -6.855  -3.348   8.761
  278   1HB   LYS  37           HB2      LYS  37  -4.868  -5.075   7.288
  279   2HB   LYS  37           HB1      LYS  37  -5.279  -3.462   6.702
  280   1HG   LYS  37           HG2      LYS  37  -4.769  -2.649   9.089
  281   2HG   LYS  37           HG1      LYS  37  -4.013  -4.223   9.337
  282   1HD   LYS  37           HD2      LYS  37  -2.663  -3.749   7.215
  283   2HD   LYS  37           HD1      LYS  37  -3.239  -2.087   7.343
  284   1HE   LYS  37           HE2      LYS  37  -1.054  -2.308   8.439
  285   2HE   LYS  37           HE1      LYS  37  -2.300  -1.953   9.635
  286   1HZ   LYS  37           HZ1      LYS  37  -1.718  -4.758   9.035
  287   2HZ   LYS  37           HZ3      LYS  37  -0.596  -3.900   9.975
  288   3HZ   LYS  37           HZ2      LYS  37  -2.208  -4.041  10.495
  289    H    ILE  38           HN       ILE  38  -7.509  -2.477   6.558
  290    HA   ILE  38           HA       ILE  38  -9.672  -4.179   5.477
  291    HB   ILE  38           HB       ILE  38  -8.953  -1.314   4.783
  292   1HG1  ILE  38          HG12      ILE  38 -11.061  -2.320   6.718
  293   2HG1  ILE  38          HG11      ILE  38  -9.485  -1.710   7.222
  294   1HG2  ILE  38          HG23      ILE  38 -10.374  -2.503   3.135
  295   2HG2  ILE  38          HG22      ILE  38 -11.508  -2.912   4.423
  296   3HG2  ILE  38          HG21      ILE  38 -11.269  -1.227   3.960
  297   1HD1  ILE  38          HD11      ILE  38 -10.124   0.366   5.743
  298   2HD1  ILE  38          HD13      ILE  38 -11.772  -0.224   5.964
  299   3HD1  ILE  38          HD12      ILE  38 -10.797   0.215   7.367
  300    H    MET  39           HN       MET  39  -8.844  -5.638   4.019
  301    HA   MET  39           HA       MET  39  -6.634  -5.036   2.246
  302   1HB   MET  39           HB2      MET  39  -7.408  -7.350   3.069
  303   2HB   MET  39           HB1      MET  39  -8.662  -7.238   1.834
  304   1HG   MET  39           HG2      MET  39  -5.837  -6.660   1.036
  305   2HG   MET  39           HG1      MET  39  -6.307  -8.341   1.286
  306   1HE   MET  39           HE1      MET  39  -8.249  -9.347   0.536
  307   2HE   MET  39           HE3      MET  39  -9.025  -9.131  -1.039
  308   3HE   MET  39           HE2      MET  39  -7.372  -9.731  -0.943
  309    H    VAL  40           HN       VAL  40  -6.706  -4.107   0.249
  310    HA   VAL  40           HA       VAL  40  -9.340  -3.910  -1.138
  311    HB   VAL  40           HB       VAL  40  -7.363  -1.625  -0.876
  312   1HG1  VAL  40          HG12      VAL  40  -8.804  -1.754  -2.950
  313   2HG1  VAL  40          HG11      VAL  40 -10.215  -1.646  -1.898
  314   3HG1  VAL  40          HG13      VAL  40  -9.065  -0.311  -1.971
  315   1HG2  VAL  40          HG21      VAL  40  -9.914  -2.287   0.603
  316   2HG2  VAL  40          HG23      VAL  40  -8.341  -1.864   1.278
  317   3HG2  VAL  40          HG22      VAL  40  -9.318  -0.632   0.479
  318    H    VAL  41           HN       VAL  41  -9.058  -4.903  -3.067
  319    HA   VAL  41           HA       VAL  41  -6.532  -4.381  -4.569
  320    HB   VAL  41           HB       VAL  41  -6.612  -6.761  -5.357
  321   1HG1  VAL  41          HG13      VAL  41  -6.194  -5.992  -2.489
  322   2HG1  VAL  41          HG12      VAL  41  -6.058  -7.691  -2.942
  323   3HG1  VAL  41          HG11      VAL  41  -5.009  -6.491  -3.695
  324   1HG2  VAL  41          HG22      VAL  41  -9.115  -6.917  -4.666
  325   2HG2  VAL  41          HG21      VAL  41  -8.094  -8.329  -4.399
  326   3HG2  VAL  41          HG23      VAL  41  -8.493  -7.263  -3.052
  327    H    GLY  42           HN       GLY  42  -6.984  -5.453  -6.935
  328   1HA   GLY  42           HA2      GLY  42  -9.390  -4.033  -7.906
  329   2HA   GLY  42           HA1      GLY  42  -8.084  -4.661  -8.912
  330    H    ARG  43           HN       ARG  43 -10.227  -5.393 -10.056
  331    HA   ARG  43           HA       ARG  43 -11.588  -7.697  -8.905
  332   1HB   ARG  43           HB2      ARG  43 -12.492  -6.025 -10.666
  333   2HB   ARG  43           HB1      ARG  43 -11.572  -6.974 -11.835
  334   1HG   ARG  43           HG2      ARG  43 -12.757  -9.030 -10.802
  335   2HG   ARG  43           HG1      ARG  43 -13.877  -7.860 -10.103
  336   1HD   ARG  43           HD2      ARG  43 -14.869  -8.482 -12.169
  337   2HD   ARG  43           HD1      ARG  43 -14.117  -6.918 -12.484
  338    HE   ARG  43           HE       ARG  43 -12.286  -9.069 -13.082
  339   1HH1  ARG  43          HH11      ARG  43 -15.088  -7.375 -14.246
  340   2HH1  ARG  43          HH12      ARG  43 -14.753  -7.720 -15.910
  341   1HH2  ARG  43          HH21      ARG  43 -11.862  -9.510 -15.245
  342   2HH2  ARG  43          HH22      ARG  43 -12.935  -8.924 -16.471
  343    H    ARG  44           HN       ARG  44  -8.994  -7.190 -11.271
  344    HA   ARG  44           HA       ARG  44  -8.769  -9.960 -12.050
  345   1HB   ARG  44           HB2      ARG  44  -6.885  -7.599 -12.216
  346   2HB   ARG  44           HB1      ARG  44  -6.438  -9.201 -12.803
  347   1HG   ARG  44           HG2      ARG  44  -8.507  -9.185 -14.229
  348   2HG   ARG  44           HG1      ARG  44  -8.776  -7.513 -13.736
  349   1HD   ARG  44           HD2      ARG  44  -6.748  -6.782 -14.769
  350   2HD   ARG  44           HD1      ARG  44  -6.188  -8.440 -14.997
  351    HE   ARG  44           HE       ARG  44  -7.677  -8.655 -16.859
  352   1HH1  ARG  44          HH11      ARG  44  -8.039  -5.633 -15.182
  353   2HH1  ARG  44          HH12      ARG  44  -8.987  -4.912 -16.441
  354   1HH2  ARG  44          HH21      ARG  44  -8.907  -7.709 -18.485
  355   2HH2  ARG  44          HH22      ARG  44  -9.475  -6.082 -18.301
  356    H    THR  45           HN       THR  45  -7.120  -7.956  -9.614
  357    HA   THR  45           HA       THR  45  -5.323 -10.043  -8.740
  358    HB   THR  45           HB       THR  45  -6.292  -7.691  -7.097
  359    HG1  THR  45           HG1      THR  45  -5.594  -6.810  -8.972
  360   1HG2  THR  45          HG23      THR  45  -3.781  -9.380  -7.132
  361   2HG2  THR  45          HG22      THR  45  -3.920  -7.869  -6.233
  362   3HG2  THR  45          HG21      THR  45  -4.958  -9.237  -5.826
  363    H    TYR  46           HN       TYR  46  -8.630  -9.199  -8.003
  364    HA   TYR  46           HA       TYR  46  -8.879 -10.566  -5.497
  365   1HB   TYR  46           HB2      TYR  46 -10.541  -8.948  -6.657
  366   2HB   TYR  46           HB1      TYR  46 -11.103 -10.375  -7.527
  367    HD1  TYR  46           HD2      TYR  46 -10.226  -9.358  -4.019
  368    HD2  TYR  46           HD1      TYR  46 -12.847 -11.592  -6.586
  369    HE1  TYR  46           HE2      TYR  46 -11.582 -10.026  -2.052
  370    HE2  TYR  46           HE1      TYR  46 -14.202 -12.261  -4.619
  371    HH   TYR  46           HH       TYR  46 -13.172 -11.512  -1.338
  372    H    GLU  47           HN       GLU  47  -9.466 -11.637  -8.852
  373    HA   GLU  47           HA       GLU  47 -10.045 -14.377  -7.986
  374   1HB   GLU  47           HB2      GLU  47  -9.801 -12.998 -10.657
  375   2HB   GLU  47           HB1      GLU  47  -9.903 -14.756 -10.553
  376   1HG   GLU  47           HG2      GLU  47 -12.057 -14.699  -9.598
  377   2HG   GLU  47           HG1      GLU  47 -11.898 -13.008  -9.121
  378    H    SER  48           HN       SER  48  -7.271 -12.536  -8.994
  379    HA   SER  48           HA       SER  48  -5.590 -14.666  -9.896
  380   1HB   SER  48           HB2      SER  48  -4.954 -12.008  -8.594
  381   2HB   SER  48           HB1      SER  48  -3.715 -13.098  -9.207
  382    HG   SER  48           HG       SER  48  -5.547 -12.888 -11.082
  383    H    PHE  49           HN       PHE  49  -6.682 -13.767  -6.733
  384    HA   PHE  49           HA       PHE  49  -4.566 -14.840  -5.144
  385   1HB   PHE  49           HB2      PHE  49  -7.522 -14.448  -4.668
  386   2HB   PHE  49           HB1      PHE  49  -6.488 -15.186  -3.445
  387    HD1  PHE  49           HD1      PHE  49  -4.076 -13.833  -3.290
  388    HD2  PHE  49           HD2      PHE  49  -7.894 -12.176  -4.353
  389    HE1  PHE  49           HE1      PHE  49  -3.296 -11.585  -2.590
  390    HE2  PHE  49           HE2      PHE  49  -7.114  -9.929  -3.654
  391    HZ   PHE  49           HZ       PHE  49  -4.815  -9.633  -2.772
  392    HA   PRO  50           HA       PRO  50  -5.140 -19.233  -5.541
  393   1HB   PRO  50           HB2      PRO  50  -4.349 -19.977  -2.959
  394   2HB   PRO  50           HB1      PRO  50  -3.273 -19.694  -4.334
  395   1HG   PRO  50           HG2      PRO  50  -3.538 -18.135  -1.948
  396   2HG   PRO  50           HG1      PRO  50  -2.446 -17.873  -3.315
  397   1HD   PRO  50           HD2      PRO  50  -4.935 -16.488  -2.658
  398   2HD   PRO  50           HD1      PRO  50  -3.672 -16.034  -3.814
  399    H    LYS  51           HN       LYS  51  -5.926 -18.678  -2.101
  400    HA   LYS  51           HA       LYS  51  -8.507 -20.109  -2.566
  401   1HB   LYS  51           HB2      LYS  51  -6.702 -19.853  -0.161
  402   2HB   LYS  51           HB1      LYS  51  -8.388 -20.340   0.013
  403   1HG   LYS  51           HG2      LYS  51  -6.577 -21.716  -1.966
  404   2HG   LYS  51           HG1      LYS  51  -6.613 -22.210  -0.274
  405   1HD   LYS  51           HD2      LYS  51  -9.129 -22.421  -0.492
  406   2HD   LYS  51           HD1      LYS  51  -8.924 -22.191  -2.228
  407   1HE   LYS  51           HE2      LYS  51  -7.740 -24.205  -2.483
  408   2HE   LYS  51           HE1      LYS  51  -7.334 -24.291  -0.770
  409   1HZ   LYS  51           HZ3      LYS  51  -9.719 -24.612  -0.309
  410   2HZ   LYS  51           HZ2      LYS  51 -10.019 -24.664  -1.981
  411   3HZ   LYS  51           HZ1      LYS  51  -9.058 -25.860  -1.249
  412    H    ARG  52           HN       ARG  52  -9.747 -18.283  -3.179
  413    HA   ARG  52           HA       ARG  52  -9.905 -16.035  -1.236
  414   1HB   ARG  52           HB2      ARG  52 -11.266 -14.938  -3.038
  415   2HB   ARG  52           HB1      ARG  52  -9.633 -15.357  -3.556
  416   1HG   ARG  52           HG2      ARG  52 -10.541 -17.482  -4.523
  417   2HG   ARG  52           HG1      ARG  52 -12.166 -16.924  -4.122
  418   1HD   ARG  52           HD2      ARG  52 -11.734 -14.869  -5.497
  419   2HD   ARG  52           HD1      ARG  52 -10.198 -15.579  -5.995
  420    HE   ARG  52           HE       ARG  52 -12.806 -16.300  -7.024
  421   1HH1  ARG  52          HH11      ARG  52  -9.656 -17.523  -6.215
  422   2HH1  ARG  52          HH12      ARG  52  -9.739 -18.827  -7.353
  423   1HH2  ARG  52          HH21      ARG  52 -12.902 -17.996  -8.496
  424   2HH2  ARG  52          HH22      ARG  52 -11.569 -19.092  -8.637
  425    HA   PRO  53           HA       PRO  53 -11.488 -14.315  -1.154
  426   1HB   PRO  53           HB2      PRO  53 -13.045 -13.528   1.038
  427   2HB   PRO  53           HB1      PRO  53 -13.461 -13.300  -0.667
  428   1HG   PRO  53           HG2      PRO  53 -14.720 -15.019   1.244
  429   2HG   PRO  53           HG1      PRO  53 -15.141 -14.776  -0.457
  430   1HD   PRO  53           HD2      PRO  53 -13.700 -16.999   0.784
  431   2HD   PRO  53           HD1      PRO  53 -14.432 -16.898  -0.825
  432    H    LEU  54           HN       LEU  54 -10.220 -13.119   0.464
  433    HA   LEU  54           HA       LEU  54  -8.785 -14.915   2.270
  434   1HB   LEU  54           HB2      LEU  54  -8.493 -11.926   1.858
  435   2HB   LEU  54           HB1      LEU  54  -7.348 -12.974   2.693
  436    HG   LEU  54           HG       LEU  54  -8.168 -13.320  -0.205
  437   1HD1  LEU  54          HD11      LEU  54  -6.775 -11.214   0.541
  438   2HD1  LEU  54          HD13      LEU  54  -5.463 -12.381   0.703
  439   3HD1  LEU  54          HD12      LEU  54  -6.254 -12.155  -0.857
  440   1HD2  LEU  54          HD23      LEU  54  -6.091 -14.615   1.583
  441   2HD2  LEU  54          HD22      LEU  54  -7.424 -15.403   0.738
  442   3HD2  LEU  54          HD21      LEU  54  -6.063 -14.754  -0.176
  443    HA   PRO  55           HA       PRO  55 -11.599 -13.704   5.638
  444   1HB   PRO  55           HB2      PRO  55 -10.664 -15.739   7.327
  445   2HB   PRO  55           HB1      PRO  55 -12.061 -15.840   6.246
  446   1HG   PRO  55           HG2      PRO  55  -9.566 -17.223   6.041
  447   2HG   PRO  55           HG1      PRO  55 -10.970 -17.330   4.971
  448   1HD   PRO  55           HD2      PRO  55  -8.453 -15.905   4.562
  449   2HD   PRO  55           HD1      PRO  55  -9.719 -16.298   3.390
  450    H    GLU  56           HN       GLU  56 -11.080 -13.541   8.172
  451    HA   GLU  56           HA       GLU  56  -9.850 -12.438   9.833
  452   1HB   GLU  56           HB2      GLU  56  -7.427 -13.333   8.243
  453   2HB   GLU  56           HB1      GLU  56  -7.469 -12.882   9.947
  454   1HG   GLU  56           HG2      GLU  56  -9.121 -15.158   8.832
  455   2HG   GLU  56           HG1      GLU  56  -7.488 -15.390   9.462
  456    H    ARG  57           HN       ARG  57 -10.665 -11.041   7.339
  457    HA   ARG  57           HA       ARG  57  -9.395  -8.526   7.814
  458   1HB   ARG  57           HB2      ARG  57  -8.159  -8.309   5.654
  459   2HB   ARG  57           HB1      ARG  57  -7.451  -9.520   6.723
  460   1HG   ARG  57           HG2      ARG  57  -9.021 -11.184   5.445
  461   2HG   ARG  57           HG1      ARG  57  -9.055  -9.924   4.212
  462   1HD   ARG  57           HD2      ARG  57  -7.211 -11.160   3.518
  463   2HD   ARG  57           HD1      ARG  57  -6.435  -9.952   4.545
  464    HE   ARG  57           HE       ARG  57  -7.052 -12.074   6.257
  465   1HH1  ARG  57          HH21      ARG  57  -5.221 -11.610   3.339
  466   2HH1  ARG  57          HH22      ARG  57  -4.090 -12.869   3.708
  467   1HH2  ARG  57          HH11      ARG  57  -5.577 -13.705   6.723
  468   2HH2  ARG  57          HH12      ARG  57  -4.291 -14.049   5.614
  469    H    THR  58           HN       THR  58  -9.974  -6.955   5.912
  470    HA   THR  58           HA       THR  58 -12.775  -7.556   5.150
  471    HB   THR  58           HB       THR  58 -11.327  -4.953   4.662
  472    HG1  THR  58           HG1      THR  58 -12.085  -4.363   6.748
  473   1HG2  THR  58          HG21      THR  58 -13.617  -5.413   3.704
  474   2HG2  THR  58          HG23      THR  58 -14.212  -5.546   5.358
  475   3HG2  THR  58          HG22      THR  58 -13.544  -4.019   4.782
  476    H    ASN  59           HN       ASN  59 -13.142  -8.385   3.161
  477    HA   ASN  59           HA       ASN  59 -11.072  -8.155   1.066
  478   1HB   ASN  59           HB2      ASN  59 -13.723  -9.633   1.100
  479   2HB   ASN  59           HB1      ASN  59 -12.514  -9.739  -0.181
  480   1HD2  ASN  59          HD22      ASN  59 -10.145 -11.242   2.331
  481   2HD2  ASN  59          HD21      ASN  59 -10.148  -9.794   1.446
  482    H    VAL  60           HN       VAL  60 -11.178  -6.075   0.229
  483    HA   VAL  60           HA       VAL  60 -13.844  -5.114  -0.717
  484    HB   VAL  60           HB       VAL  60 -11.273  -3.537  -0.392
  485   1HG1  VAL  60          HG13      VAL  60 -14.159  -2.765  -0.908
  486   2HG1  VAL  60          HG12      VAL  60 -12.901  -1.612  -0.467
  487   3HG1  VAL  60          HG11      VAL  60 -12.782  -2.509  -1.980
  488   1HG2  VAL  60          HG23      VAL  60 -13.611  -4.027   1.458
  489   2HG2  VAL  60          HG22      VAL  60 -11.888  -4.167   1.811
  490   3HG2  VAL  60          HG21      VAL  60 -12.617  -2.576   1.597
  491    H    VAL  61           HN       VAL  61 -14.119  -4.584  -2.897
  492    HA   VAL  61           HA       VAL  61 -11.790  -5.028  -4.710
  493    HB   VAL  61           HB       VAL  61 -14.587  -6.095  -5.201
  494   1HG1  VAL  61          HG13      VAL  61 -11.955  -6.509  -6.655
  495   2HG1  VAL  61          HG12      VAL  61 -13.489  -7.274  -7.072
  496   3HG1  VAL  61          HG11      VAL  61 -13.302  -5.529  -7.233
  497   1HG2  VAL  61          HG23      VAL  61 -12.056  -7.427  -4.204
  498   2HG2  VAL  61          HG22      VAL  61 -13.644  -7.413  -3.435
  499   3HG2  VAL  61          HG21      VAL  61 -13.390  -8.334  -4.918
  500    H    LEU  62           HN       LEU  62 -11.563  -3.325  -6.066
  501    HA   LEU  62           HA       LEU  62 -13.807  -1.398  -6.319
  502   1HB   LEU  62           HB2      LEU  62 -11.429  -0.685  -5.712
  503   2HB   LEU  62           HB1      LEU  62 -10.988  -1.081  -7.373
  504    HG   LEU  62           HG       LEU  62 -13.002   0.438  -8.023
  505   1HD1  LEU  62          HD13      LEU  62 -12.514   1.145  -5.128
  506   2HD1  LEU  62          HD12      LEU  62 -13.194   2.314  -6.261
  507   3HD1  LEU  62          HD11      LEU  62 -14.049   0.808  -5.929
  508   1HD2  LEU  62          HD23      LEU  62 -10.389   1.449  -6.872
  509   2HD2  LEU  62          HD22      LEU  62 -10.756   1.099  -8.561
  510   3HD2  LEU  62          HD21      LEU  62 -11.505   2.483  -7.765
  511    H    THR  63           HN       THR  63 -15.152  -1.799  -8.004
  512    HA   THR  63           HA       THR  63 -13.940  -2.364 -10.663
  513    HB   THR  63           HB       THR  63 -14.625  -4.550  -9.838
  514    HG1  THR  63           HG1      THR  63 -16.376  -4.920 -11.380
  515   1HG2  THR  63          HG22      THR  63 -17.187  -3.096  -9.177
  516   2HG2  THR  63          HG21      THR  63 -17.119  -4.854  -9.318
  517   3HG2  THR  63          HG23      THR  63 -16.152  -4.029  -8.096
  518    H    HIS  64           HN       HIS  64 -15.239  -1.613 -12.422
  519    HA   HIS  64           HA       HIS  64 -17.136   0.520 -11.649
  520   1HB   HIS  64           HB2      HIS  64 -15.852  -0.246 -14.284
  521   2HB   HIS  64           HB1      HIS  64 -17.036   1.051 -14.126
  522    HD1  HIS  64           HD1      HIS  64 -13.481   0.451 -13.956
  523    HD2  HIS  64           HD2      HIS  64 -16.117   3.057 -12.048
  524    HE1  HIS  64           HE1      HIS  64 -12.067   2.307 -12.974
  525    H    GLN  65           HN       GLN  65 -17.072  -2.567 -13.359
  526    HA   GLN  65           HA       GLN  65 -19.818  -2.364 -14.308
  527   1HB   GLN  65           HB2      GLN  65 -17.933  -4.727 -14.047
  528   2HB   GLN  65           HB1      GLN  65 -19.519  -4.803 -14.815
  529   1HG   GLN  65           HG2      GLN  65 -17.477  -2.761 -15.681
  530   2HG   GLN  65           HG1      GLN  65 -17.456  -4.399 -16.336
  531   1HE2  GLN  65          HE22      GLN  65 -20.839  -3.922 -17.769
  532   2HE2  GLN  65          HE21      GLN  65 -20.080  -5.041 -16.743
  533    H    GLU  66           HN       GLU  66 -21.596  -2.676 -13.073
  534    HA   GLU  66           HA       GLU  66 -21.321  -3.688 -10.330
  535   1HB   GLU  66           HB2      GLU  66 -22.851  -1.759 -11.117
  536   2HB   GLU  66           HB1      GLU  66 -23.918  -3.028 -11.720
  537   1HG   GLU  66           HG2      GLU  66 -24.339  -3.874  -9.573
  538   2HG   GLU  66           HG1      GLU  66 -22.889  -3.135  -8.894
  539    H    ASP  67           HN       ASP  67 -20.855  -5.524 -12.623
  540    HA   ASP  67           HA       ASP  67 -23.142  -7.410 -12.344
  541   1HB   ASP  67           HB2      ASP  67 -20.807  -7.267 -14.265
  542   2HB   ASP  67           HB1      ASP  67 -21.881  -8.664 -14.179
  543    H    TYR  68           HN       TYR  68 -19.678  -7.090 -11.727
  544    HA   TYR  68           HA       TYR  68 -19.260  -9.821 -10.891
  545   1HB   TYR  68           HB2      TYR  68 -17.491  -8.060 -11.547
  546   2HB   TYR  68           HB1      TYR  68 -17.673  -7.450  -9.902
  547    HD1  TYR  68           HD2      TYR  68 -16.642 -10.347 -11.958
  548    HD2  TYR  68           HD1      TYR  68 -16.883  -8.711  -7.993
  549    HE1  TYR  68           HE2      TYR  68 -15.149 -12.144 -11.126
  550    HE2  TYR  68           HE1      TYR  68 -15.389 -10.507  -7.161
  551    HH   TYR  68           HH       TYR  68 -14.062 -12.207  -7.739
  552    H    GLN  69           HN       GLN  69 -19.565 -10.748  -8.894
  553    HA   GLN  69           HA       GLN  69 -20.228  -8.993  -6.586
  554   1HB   GLN  69           HB2      GLN  69 -21.930 -11.332  -7.505
  555   2HB   GLN  69           HB1      GLN  69 -22.184 -10.397  -6.031
  556   1HG   GLN  69           HG2      GLN  69 -22.514  -8.356  -7.373
  557   2HG   GLN  69           HG1      GLN  69 -22.252  -9.283  -8.851
  558   1HE2  GLN  69          HE22      GLN  69 -25.766  -9.802  -6.778
  559   2HE2  GLN  69          HE21      GLN  69 -24.415  -9.162  -5.975
  560    H    ALA  70           HN       ALA  70 -18.513  -9.579  -5.305
  561    HA   ALA  70           HA       ALA  70 -17.636 -12.386  -5.164
  562   1HB   ALA  70           HB1      ALA  70 -16.673  -9.809  -3.920
  563   2HB   ALA  70           HB3      ALA  70 -16.035 -11.372  -3.413
  564   3HB   ALA  70           HB2      ALA  70 -15.839 -10.840  -5.083
  565    H    GLN  71           HN       GLN  71 -18.603 -13.783  -3.789
  566    HA   GLN  71           HA       GLN  71 -20.478 -12.920  -1.762
  567   1HB   GLN  71           HB2      GLN  71 -19.198 -15.613  -2.315
  568   2HB   GLN  71           HB1      GLN  71 -20.475 -15.354  -1.126
  569   1HG   GLN  71           HG2      GLN  71 -21.917 -14.423  -2.945
  570   2HG   GLN  71           HG1      GLN  71 -20.658 -14.841  -4.108
  571   1HE2  GLN  71          HE22      GLN  71 -22.446 -18.015  -2.183
  572   2HE2  GLN  71          HE21      GLN  71 -22.101 -16.607  -1.301
  573    H    GLY  72           HN       GLY  72 -20.037 -12.336   0.305
  574   1HA   GLY  72           HA2      GLY  72 -18.935 -12.284   2.396
  575   2HA   GLY  72           HA1      GLY  72 -17.814 -13.507   1.796
  576    H    ALA  73           HN       ALA  73 -18.534 -10.375   0.295
  577    HA   ALA  73           HA       ALA  73 -16.009  -9.200   1.215
  578   1HB   ALA  73           HB2      ALA  73 -16.409 -10.140  -1.629
  579   2HB   ALA  73           HB1      ALA  73 -15.278  -8.847  -1.228
  580   3HB   ALA  73           HB3      ALA  73 -15.047 -10.460  -0.556
  581    H    VAL  74           HN       VAL  74 -15.976  -6.943   0.879
  582    HA   VAL  74           HA       VAL  74 -18.595  -5.760   0.232
  583    HB   VAL  74           HB       VAL  74 -16.024  -4.384   1.064
  584   1HG1  VAL  74          HG12      VAL  74 -18.937  -3.537   1.105
  585   2HG1  VAL  74          HG11      VAL  74 -17.611  -2.610   1.809
  586   3HG1  VAL  74          HG13      VAL  74 -17.673  -2.879   0.067
  587   1HG2  VAL  74          HG21      VAL  74 -18.331  -5.470   2.711
  588   2HG2  VAL  74          HG23      VAL  74 -16.652  -6.009   2.767
  589   3HG2  VAL  74          HG22      VAL  74 -17.081  -4.397   3.341
  590    H    VAL  75           HN       VAL  75 -18.851  -5.840  -2.003
  591    HA   VAL  75           HA       VAL  75 -16.695  -5.119  -3.830
  592    HB   VAL  75           HB       VAL  75 -19.664  -5.369  -4.400
  593   1HG1  VAL  75          HG13      VAL  75 -18.140  -4.240  -6.101
  594   2HG1  VAL  75          HG12      VAL  75 -17.297  -5.784  -6.242
  595   3HG1  VAL  75          HG11      VAL  75 -19.000  -5.665  -6.685
  596   1HG2  VAL  75          HG23      VAL  75 -17.442  -7.413  -4.238
  597   2HG2  VAL  75          HG22      VAL  75 -19.026  -7.458  -3.462
  598   3HG2  VAL  75          HG21      VAL  75 -18.891  -7.695  -5.204
  599    H    VAL  76           HN       VAL  76 -16.057  -2.989  -3.472
  600    HA   VAL  76           HA       VAL  76 -18.067  -0.852  -3.255
  601    HB   VAL  76           HB       VAL  76 -16.047   0.632  -3.136
  602   1HG1  VAL  76          HG12      VAL  76 -16.125  -1.797  -1.322
  603   2HG1  VAL  76          HG11      VAL  76 -15.201  -0.335  -0.976
  604   3HG1  VAL  76          HG13      VAL  76 -16.961  -0.263  -1.073
  605   1HG2  VAL  76          HG22      VAL  76 -14.613  -2.026  -3.430
  606   2HG2  VAL  76          HG21      VAL  76 -14.535  -0.663  -4.547
  607   3HG2  VAL  76          HG23      VAL  76 -13.834  -0.523  -2.934
  608    H    HIS  77           HN       HIS  77 -18.126   0.952  -4.780
  609    HA   HIS  77           HA       HIS  77 -17.008   0.347  -7.478
  610   1HB   HIS  77           HB2      HIS  77 -19.876   1.150  -6.892
  611   2HB   HIS  77           HB1      HIS  77 -19.170   0.998  -8.502
  612    HD1  HIS  77           HD1      HIS  77 -19.037  -1.322  -9.500
  613    HD2  HIS  77           HD2      HIS  77 -20.013  -1.400  -5.448
  614    HE1  HIS  77           HE1      HIS  77 -19.633  -3.722  -8.953
  615    H    ASP  78           HN       ASP  78 -16.286   2.267  -5.330
  616    HA   ASP  78           HA       ASP  78 -15.970   4.619  -6.979
  617   1HB   ASP  78           HB2      ASP  78 -18.408   4.728  -6.107
  618   2HB   ASP  78           HB1      ASP  78 -17.682   5.073  -4.537
  619    H    VAL  79           HN       VAL  79 -14.453   6.068  -6.047
  620    HA   VAL  79           HA       VAL  79 -12.685   4.925  -4.078
  621    HB   VAL  79           HB       VAL  79 -12.813   7.803  -5.024
  622   1HG1  VAL  79          HG13      VAL  79 -11.397   7.301  -3.014
  623   2HG1  VAL  79          HG12      VAL  79 -10.493   6.146  -3.993
  624   3HG1  VAL  79          HG11      VAL  79 -10.464   7.861  -4.402
  625   1HG2  VAL  79          HG22      VAL  79 -11.485   5.349  -6.206
  626   2HG2  VAL  79          HG21      VAL  79 -12.670   6.402  -6.978
  627   3HG2  VAL  79          HG23      VAL  79 -11.041   6.995  -6.653
  628    H    ALA  80           HN       ALA  80 -15.280   7.314  -3.947
  629    HA   ALA  80           HA       ALA  80 -14.733   8.198  -1.248
  630   1HB   ALA  80           HB3      ALA  80 -16.141   9.424  -2.976
  631   2HB   ALA  80           HB2      ALA  80 -17.411   8.241  -2.661
  632   3HB   ALA  80           HB1      ALA  80 -16.860   9.308  -1.369
  633    H    ALA  81           HN       ALA  81 -16.573   5.556  -2.660
  634    HA   ALA  81           HA       ALA  81 -18.061   4.849  -0.301
  635   1HB   ALA  81           HB3      ALA  81 -18.441   4.061  -2.725
  636   2HB   ALA  81           HB2      ALA  81 -17.154   2.895  -2.421
  637   3HB   ALA  81           HB1      ALA  81 -18.630   2.852  -1.455
  638    H    VAL  82           HN       VAL  82 -14.866   3.937  -1.533
  639    HA   VAL  82           HA       VAL  82 -14.362   1.899   0.450
  640    HB   VAL  82           HB       VAL  82 -12.340   3.575  -1.068
  641   1HG1  VAL  82          HG11      VAL  82 -12.208   0.831   0.221
  642   2HG1  VAL  82          HG13      VAL  82 -10.931   1.539  -0.767
  643   3HG1  VAL  82          HG12      VAL  82 -11.373   2.284   0.770
  644   1HG2  VAL  82          HG22      VAL  82 -14.040   1.224  -1.847
  645   2HG2  VAL  82          HG21      VAL  82 -13.603   2.644  -2.797
  646   3HG2  VAL  82          HG23      VAL  82 -12.416   1.370  -2.517
  647    H    PHE  83           HN       PHE  83 -13.635   5.373   0.250
  648    HA   PHE  83           HA       PHE  83 -12.165   5.448   2.747
  649   1HB   PHE  83           HB2      PHE  83 -13.393   7.537   0.951
  650   2HB   PHE  83           HB1      PHE  83 -12.709   7.978   2.516
  651    HD1  PHE  83           HD1      PHE  83 -10.338   6.639   2.955
  652    HD2  PHE  83           HD2      PHE  83 -11.951   7.815  -0.849
  653    HE1  PHE  83           HE1      PHE  83  -8.061   6.593   1.975
  654    HE2  PHE  83           HE2      PHE  83  -9.673   7.768  -1.829
  655    HZ   PHE  83           HZ       PHE  83  -7.728   7.158  -0.417
  656    H    ALA  84           HN       ALA  84 -15.541   5.738   1.836
  657    HA   ALA  84           HA       ALA  84 -16.501   6.916   4.274
  658   1HB   ALA  84           HB3      ALA  84 -17.744   6.632   2.035
  659   2HB   ALA  84           HB2      ALA  84 -18.074   4.983   2.567
  660   3HB   ALA  84           HB1      ALA  84 -18.674   6.349   3.506
  661    H    TYR  85           HN       TYR  85 -15.908   3.572   3.270
  662    HA   TYR  85           HA       TYR  85 -17.116   2.339   5.577
  663   1HB   TYR  85           HB2      TYR  85 -16.503   1.208   3.370
  664   2HB   TYR  85           HB1      TYR  85 -14.835   1.202   3.945
  665    HD1  TYR  85           HD1      TYR  85 -18.252  -0.077   4.567
  666    HD2  TYR  85           HD2      TYR  85 -14.121  -0.257   5.734
  667    HE1  TYR  85           HE1      TYR  85 -18.719  -2.109   5.908
  668    HE2  TYR  85           HE2      TYR  85 -14.589  -2.290   7.075
  669    HH   TYR  85           HH       TYR  85 -16.655  -4.225   6.819
  670    H    ALA  86           HN       ALA  86 -13.811   3.406   4.825
  671    HA   ALA  86           HA       ALA  86 -12.629   2.400   7.253
  672   1HB   ALA  86           HB1      ALA  86 -11.431   3.146   5.103
  673   2HB   ALA  86           HB3      ALA  86 -11.639   4.794   5.698
  674   3HB   ALA  86           HB2      ALA  86 -10.693   3.633   6.630
  675    H    LYS  87           HN       LYS  87 -14.348   5.341   6.415
  676    HA   LYS  87           HA       LYS  87 -13.560   6.906   8.694
  677   1HB   LYS  87           HB2      LYS  87 -14.740   7.721   6.571
  678   2HB   LYS  87           HB1      LYS  87 -16.228   7.088   7.279
  679   1HG   LYS  87           HG2      LYS  87 -15.830   8.498   9.295
  680   2HG   LYS  87           HG1      LYS  87 -14.411   9.185   8.505
  681   1HD   LYS  87           HD2      LYS  87 -16.054  10.754   7.966
  682   2HD   LYS  87           HD1      LYS  87 -16.090   9.699   6.552
  683   1HE   LYS  87           HE2      LYS  87 -17.920   8.381   7.723
  684   2HE   LYS  87           HE1      LYS  87 -17.983   9.680   8.913
  685   1HZ   LYS  87           HZ2      LYS  87 -18.273  11.214   6.948
  686   2HZ   LYS  87           HZ1      LYS  87 -18.568   9.824   6.017
  687   3HZ   LYS  87           HZ3      LYS  87 -19.592  10.207   7.314
  688    H    GLN  88           HN       GLN  88 -16.147   4.553   8.143
  689    HA   GLN  88           HA       GLN  88 -17.450   5.023  10.695
  690   1HB   GLN  88           HB2      GLN  88 -18.516   3.972   8.632
  691   2HB   GLN  88           HB1      GLN  88 -17.606   2.509   9.016
  692   1HG   GLN  88           HG2      GLN  88 -18.779   2.142  11.008
  693   2HG   GLN  88           HG1      GLN  88 -19.287   3.826  11.133
  694   1HE2  GLN  88          HE22      GLN  88 -21.805   3.346   8.477
  695   2HE2  GLN  88          HE21      GLN  88 -20.541   4.425   8.818
  696    H    HIS  89           HN       HIS  89 -14.811   3.020   9.570
  697    HA   HIS  89           HA       HIS  89 -14.584   1.865  12.323
  698   1HB   HIS  89           HB2      HIS  89 -13.946   0.686   9.617
  699   2HB   HIS  89           HB1      HIS  89 -13.225   0.045  11.092
  700    HD1  HIS  89           HD1      HIS  89 -14.538  -1.828  12.062
  701    HD2  HIS  89           HD2      HIS  89 -17.001   0.884  10.071
  702    HE1  HIS  89           HE1      HIS  89 -16.898  -2.726  12.257
  703    HA   PRO  90           HA       PRO  90 -10.831   4.481  11.745
  704   1HB   PRO  90           HB2      PRO  90 -10.948   5.431  14.375
  705   2HB   PRO  90           HB1      PRO  90 -11.562   6.268  12.942
  706   1HG   PRO  90           HG2      PRO  90 -13.056   5.134  15.107
  707   2HG   PRO  90           HG1      PRO  90 -13.664   5.997  13.688
  708   1HD   PRO  90           HD2      PRO  90 -13.641   3.124  14.223
  709   2HD   PRO  90           HD1      PRO  90 -14.529   4.024  12.982
  710    H    ASP  91           HN       ASP  91 -11.291   1.609  12.834
  711    HA   ASP  91           HA       ASP  91  -9.003   1.521  14.750
  712   1HB   ASP  91           HB2      ASP  91 -11.268  -0.401  14.176
  713   2HB   ASP  91           HB1      ASP  91  -9.851  -0.870  15.117
  714    H    GLN  92           HN       GLN  92 -10.176   0.355  11.645
  715    HA   GLN  92           HA       GLN  92  -7.732  -1.282  11.261
  716   1HB   GLN  92           HB2      GLN  92 -10.164  -0.871   9.492
  717   2HB   GLN  92           HB1      GLN  92  -8.834  -1.975   9.144
  718   1HG   GLN  92           HG2      GLN  92  -9.303  -3.232  11.195
  719   2HG   GLN  92           HG1      GLN  92 -10.592  -2.102  11.612
  720   1HE2  GLN  92          HE22      GLN  92 -11.258  -4.463   8.299
  721   2HE2  GLN  92          HE21      GLN  92  -9.700  -3.847   8.570
  722    H    GLU  93           HN       GLU  93  -6.895  -1.027   8.822
  723    HA   GLU  93           HA       GLU  93  -6.682   1.883   8.186
  724   1HB   GLU  93           HB2      GLU  93  -4.447  -0.127   8.514
  725   2HB   GLU  93           HB1      GLU  93  -4.238   1.370   7.604
  726   1HG   GLU  93           HG2      GLU  93  -5.329   1.374  10.419
  727   2HG   GLU  93           HG1      GLU  93  -3.595   1.417  10.101
  728    H    LEU  94           HN       LEU  94  -6.212   2.311   5.938
  729    HA   LEU  94           HA       LEU  94  -7.293   0.250   4.142
  730   1HB   LEU  94           HB2      LEU  94  -7.757   2.803   4.053
  731   2HB   LEU  94           HB1      LEU  94  -6.179   2.913   3.272
  732    HG   LEU  94           HG       LEU  94  -7.035   1.071   1.685
  733   1HD1  LEU  94          HD12      LEU  94  -9.599   1.967   3.022
  734   2HD1  LEU  94          HD11      LEU  94  -9.568   1.174   1.447
  735   3HD1  LEU  94          HD13      LEU  94  -8.978   0.323   2.874
  736   1HD2  LEU  94          HD21      LEU  94  -8.009   3.921   1.768
  737   2HD2  LEU  94          HD23      LEU  94  -6.776   3.204   0.730
  738   3HD2  LEU  94          HD22      LEU  94  -8.481   2.856   0.443
  739    H    VAL  95           HN       VAL  95  -6.081  -1.007   2.784
  740    HA   VAL  95           HA       VAL  95  -3.203  -0.310   2.406
  741    HB   VAL  95           HB       VAL  95  -4.238  -3.100   2.991
  742   1HG1  VAL  95          HG11      VAL  95  -2.201  -2.950   1.571
  743   2HG1  VAL  95          HG13      VAL  95  -1.423  -1.982   2.823
  744   3HG1  VAL  95          HG12      VAL  95  -1.857  -3.659   3.148
  745   1HG2  VAL  95          HG21      VAL  95  -2.772  -1.113   4.756
  746   2HG2  VAL  95          HG23      VAL  95  -4.411  -1.716   4.998
  747   3HG2  VAL  95          HG22      VAL  95  -3.036  -2.807   5.165
  748    H    ILE  96           HN       ILE  96  -2.972  -0.034   0.246
  749    HA   ILE  96           HA       ILE  96  -4.740  -1.492  -1.625
  750    HB   ILE  96           HB       ILE  96  -2.589   0.553  -2.234
  751   1HG1  ILE  96          HG12      ILE  96  -4.289   1.498  -0.709
  752   2HG1  ILE  96          HG11      ILE  96  -4.434   2.198  -2.320
  753   1HG2  ILE  96          HG23      ILE  96  -4.965  -0.469  -3.819
  754   2HG2  ILE  96          HG22      ILE  96  -3.893   0.835  -4.329
  755   3HG2  ILE  96          HG21      ILE  96  -3.267  -0.804  -4.157
  756   1HD1  ILE  96          HD13      ILE  96  -6.262   0.592  -2.832
  757   2HD1  ILE  96          HD12      ILE  96  -6.138  -0.048  -1.193
  758   3HD1  ILE  96          HD11      ILE  96  -6.656   1.618  -1.453
  759    H    ALA  97           HN       ALA  97  -4.072  -3.303  -2.669
  760    HA   ALA  97           HA       ALA  97  -1.162  -3.978  -2.566
  761   1HB   ALA  97           HB2      ALA  97  -3.664  -5.591  -2.387
  762   2HB   ALA  97           HB1      ALA  97  -2.287  -6.330  -3.205
  763   3HB   ALA  97           HB3      ALA  97  -2.134  -5.792  -1.532
  764    H    GLY  98           HN       GLY  98  -3.891  -3.422  -4.655
  765   1HA   GLY  98           HA2      GLY  98  -2.537  -2.853  -6.983
  766   2HA   GLY  98           HA1      GLY  98  -2.670  -4.612  -7.027
  767    H    GLY  99           HN       GLY  99  -5.707  -3.474  -8.777
  768   1HA   GLY  99           HA2      GLY  99  -2.903  -4.287  -9.094
  769   2HA   GLY  99           HA1      GLY  99  -4.049  -3.973 -10.398
  770    H    ALA 100           HN       ALA 100  -2.403  -2.680 -11.462
  771    HA   ALA 100           HA       ALA 100  -1.181  -0.386 -10.237
  772   1HB   ALA 100           HB2      ALA 100  -0.391  -1.506 -12.350
  773   2HB   ALA 100           HB1      ALA 100  -1.776  -0.798 -13.181
  774   3HB   ALA 100           HB3      ALA 100  -0.537   0.246 -12.486
  775    H    GLN 101           HN       GLN 101  -4.252  -0.901 -11.873
  776    HA   GLN 101           HA       GLN 101  -4.907   1.891 -12.222
  777   1HB   GLN 101           HB2      GLN 101  -6.521  -0.659 -12.191
  778   2HB   GLN 101           HB1      GLN 101  -7.304   0.915 -12.329
  779   1HG   GLN 101           HG2      GLN 101  -6.972   0.338 -14.573
  780   2HG   GLN 101           HG1      GLN 101  -5.552   1.328 -14.233
  781   1HE2  GLN 101          HE22      GLN 101  -5.004  -2.755 -14.391
  782   2HE2  GLN 101          HE21      GLN 101  -6.479  -2.147 -13.810
  783    H    ILE 102           HN       ILE 102  -5.268  -0.411  -9.590
  784    HA   ILE 102           HA       ILE 102  -7.081   1.235  -8.028
  785    HB   ILE 102           HB       ILE 102  -5.232  -0.967  -7.072
  786   1HG1  ILE 102          HG12      ILE 102  -6.652  -1.749  -8.936
  787   2HG1  ILE 102          HG11      ILE 102  -7.162  -2.474  -7.414
  788   1HG2  ILE 102          HG22      ILE 102  -7.785   0.222  -5.949
  789   2HG2  ILE 102          HG21      ILE 102  -6.979  -1.208  -5.303
  790   3HG2  ILE 102          HG23      ILE 102  -6.168   0.359  -5.256
  791   1HD1  ILE 102          HD13      ILE 102  -8.916  -0.687  -7.216
  792   2HD1  ILE 102          HD12      ILE 102  -8.462  -0.125  -8.825
  793   3HD1  ILE 102          HD11      ILE 102  -9.142  -1.739  -8.614
  794    H    PHE 103           HN       PHE 103  -3.567   0.783  -8.160
  795    HA   PHE 103           HA       PHE 103  -2.908   2.323  -5.843
  796   1HB   PHE 103           HB2      PHE 103  -1.402   1.681  -8.384
  797   2HB   PHE 103           HB1      PHE 103  -0.690   2.662  -7.103
  798    HD1  PHE 103           HD1      PHE 103  -1.427   1.521  -4.626
  799    HD2  PHE 103           HD2      PHE 103  -0.627  -0.512  -8.324
  800    HE1  PHE 103           HE1      PHE 103  -0.847  -0.537  -3.370
  801    HE2  PHE 103           HE2      PHE 103  -0.048  -2.570  -7.068
  802    HZ   PHE 103           HZ       PHE 103  -0.158  -2.583  -4.591
  803    H    THR 104           HN       THR 104  -3.206   3.252  -9.277
  804    HA   THR 104           HA       THR 104  -2.595   6.032  -8.845
  805    HB   THR 104           HB       THR 104  -4.043   6.131 -11.102
  806    HG1  THR 104           HG1      THR 104  -3.851   4.095 -12.127
  807   1HG2  THR 104          HG21      THR 104  -1.458   6.278 -10.571
  808   2HG2  THR 104          HG23      THR 104  -1.440   4.663 -11.277
  809   3HG2  THR 104          HG22      THR 104  -2.016   6.033 -12.226
  810    H    ALA 105           HN       ALA 105  -5.445   4.120  -8.360
  811    HA   ALA 105           HA       ALA 105  -7.350   6.314  -8.484
  812   1HB   ALA 105           HB2      ALA 105  -7.869   3.820  -8.738
  813   2HB   ALA 105           HB1      ALA 105  -7.709   3.712  -6.985
  814   3HB   ALA 105           HB3      ALA 105  -8.957   4.736  -7.695
  815    H    PHE 106           HN       PHE 106  -5.480   4.732  -5.922
  816    HA   PHE 106           HA       PHE 106  -6.592   6.692  -3.962
  817   1HB   PHE 106           HB2      PHE 106  -5.152   4.054  -3.585
  818   2HB   PHE 106           HB1      PHE 106  -5.537   5.149  -2.258
  819    HD1  PHE 106           HD1      PHE 106  -8.012   5.888  -2.015
  820    HD2  PHE 106           HD2      PHE 106  -6.751   2.504  -4.341
  821    HE1  PHE 106           HE1      PHE 106 -10.312   4.965  -1.920
  822    HE2  PHE 106           HE2      PHE 106  -9.050   1.582  -4.246
  823    HZ   PHE 106           HZ       PHE 106 -10.831   2.812  -3.034
  824    H    LYS 107           HN       LYS 107  -4.245   6.844  -6.062
  825    HA   LYS 107           HA       LYS 107  -1.852   7.220  -4.486
  826   1HB   LYS 107           HB2      LYS 107  -2.200   6.907  -7.096
  827   2HB   LYS 107           HB1      LYS 107  -2.274   8.669  -7.075
  828   1HG   LYS 107           HG2      LYS 107  -0.066   7.352  -5.553
  829   2HG   LYS 107           HG1      LYS 107   0.052   7.382  -7.312
  830   1HD   LYS 107           HD2      LYS 107  -0.604   9.923  -7.004
  831   2HD   LYS 107           HD1      LYS 107   0.030   9.672  -5.377
  832   1HE   LYS 107           HE2      LYS 107   1.891  10.407  -6.676
  833   2HE   LYS 107           HE1      LYS 107   2.101   8.665  -6.497
  834   1HZ   LYS 107           HZ2      LYS 107   0.969   8.413  -8.670
  835   2HZ   LYS 107           HZ1      LYS 107   0.997  10.103  -8.847
  836   3HZ   LYS 107           HZ3      LYS 107   2.453   9.235  -8.768
  837    H    ASP 108           HN       ASP 108  -4.553   9.273  -5.388
  838    HA   ASP 108           HA       ASP 108  -3.367  11.811  -4.806
  839   1HB   ASP 108           HB2      ASP 108  -5.638  11.282  -5.937
  840   2HB   ASP 108           HB1      ASP 108  -6.271  11.169  -4.294
  841    H    ASP 109           HN       ASP 109  -4.649   9.280  -2.763
  842    HA   ASP 109           HA       ASP 109  -4.071  10.995  -0.380
  843   1HB   ASP 109           HB2      ASP 109  -6.233   8.909  -0.777
  844   2HB   ASP 109           HB1      ASP 109  -5.803   9.569   0.802
  845    H    VAL 110           HN       VAL 110  -1.916   9.770  -1.216
  846    HA   VAL 110           HA       VAL 110  -1.756   7.124   0.153
  847    HB   VAL 110           HB       VAL 110  -1.031   7.158  -2.206
  848   1HG1  VAL 110          HG11      VAL 110  -0.341   9.533  -2.289
  849   2HG1  VAL 110          HG13      VAL 110   1.038   9.163  -1.256
  850   3HG1  VAL 110          HG12      VAL 110   0.938   8.471  -2.874
  851   1HG2  VAL 110          HG21      VAL 110   0.177   5.827  -0.298
  852   2HG2  VAL 110          HG23      VAL 110   0.931   5.915  -1.889
  853   3HG2  VAL 110          HG22      VAL 110   1.498   6.959  -0.585
  854    H    ASP 111           HN       ASP 111  -0.028   6.758   1.663
  855    HA   ASP 111           HA       ASP 111   1.391   9.201   2.620
  856   1HB   ASP 111           HB2      ASP 111  -0.030   7.185   4.388
  857   2HB   ASP 111           HB1      ASP 111   0.911   8.568   4.949
  858    H    THR 112           HN       THR 112   1.153   5.774   3.627
  859    HA   THR 112           HA       THR 112   4.081   5.637   3.858
  860    HB   THR 112           HB       THR 112   2.176   3.314   4.158
  861    HG1  THR 112           HG1      THR 112   2.557   5.560   5.779
  862   1HG2  THR 112          HG21      THR 112   4.890   4.080   5.233
  863   2HG2  THR 112          HG23      THR 112   3.916   2.821   5.991
  864   3HG2  THR 112          HG22      THR 112   4.441   2.641   4.317
  865    H    LEU 113           HN       LEU 113   5.392   4.896   2.261
  866    HA   LEU 113           HA       LEU 113   4.117   3.488  -0.049
  867   1HB   LEU 113           HB2      LEU 113   6.508   5.325   0.140
  868   2HB   LEU 113           HB1      LEU 113   6.258   4.271  -1.252
  869    HG   LEU 113           HG       LEU 113   4.087   6.120  -0.261
  870   1HD1  LEU 113          HD12      LEU 113   6.442   6.692  -2.048
  871   2HD1  LEU 113          HD11      LEU 113   4.914   7.538  -2.288
  872   3HD1  LEU 113          HD13      LEU 113   5.770   7.684  -0.753
  873   1HD2  LEU 113          HD23      LEU 113   3.572   4.212  -1.829
  874   2HD2  LEU 113          HD22      LEU 113   3.203   5.801  -2.496
  875   3HD2  LEU 113          HD21      LEU 113   4.663   4.952  -3.000
  876    H    LEU 114           HN       LEU 114   4.343   1.393   0.928
  877    HA   LEU 114           HA       LEU 114   7.058   0.473   1.641
  878   1HB   LEU 114           HB2      LEU 114   4.356  -0.902   1.663
  879   2HB   LEU 114           HB1      LEU 114   5.860  -1.683   2.149
  880    HG   LEU 114           HG       LEU 114   5.011   0.935   3.378
  881   1HD1  LEU 114          HD11      LEU 114   4.219  -1.868   4.226
  882   2HD1  LEU 114          HD13      LEU 114   4.050  -0.438   5.245
  883   3HD1  LEU 114          HD12      LEU 114   3.132  -0.564   3.744
  884   1HD2  LEU 114          HD22      LEU 114   6.873  -1.339   4.088
  885   2HD2  LEU 114          HD21      LEU 114   7.265   0.368   3.877
  886   3HD2  LEU 114          HD23      LEU 114   6.352  -0.158   5.291
  887    H    VAL 115           HN       VAL 115   8.376  -0.375   0.111
  888    HA   VAL 115           HA       VAL 115   7.137  -1.822  -2.184
  889    HB   VAL 115           HB       VAL 115   7.734   0.457  -2.928
  890   1HG1  VAL 115          HG12      VAL 115   9.521   0.880  -1.275
  891   2HG1  VAL 115          HG11      VAL 115  10.545  -0.307  -2.082
  892   3HG1  VAL 115          HG13      VAL 115  10.087   1.177  -2.919
  893   1HG2  VAL 115          HG22      VAL 115   7.988  -1.479  -4.481
  894   2HG2  VAL 115          HG21      VAL 115   9.130  -0.181  -4.833
  895   3HG2  VAL 115          HG23      VAL 115   9.674  -1.626  -3.981
  896    H    THR 116           HN       THR 116   8.344  -3.594  -2.925
  897    HA   THR 116           HA       THR 116  10.694  -4.323  -1.223
  898    HB   THR 116           HB       THR 116   8.939  -6.214  -2.810
  899    HG1  THR 116           HG1      THR 116   8.482  -6.493  -0.268
  900   1HG2  THR 116          HG23      THR 116  11.347  -6.775  -1.960
  901   2HG2  THR 116          HG22      THR 116  10.579  -6.855  -0.374
  902   3HG2  THR 116          HG21      THR 116  10.047  -7.929  -1.668
  903    H    ARG 117           HN       ARG 117  12.508  -3.805  -2.368
  904    HA   ARG 117           HA       ARG 117  12.538  -4.061  -5.308
  905   1HB   ARG 117           HB2      ARG 117  14.686  -3.163  -3.363
  906   2HB   ARG 117           HB1      ARG 117  14.803  -3.077  -5.121
  907   1HG   ARG 117           HG2      ARG 117  12.462  -1.811  -3.724
  908   2HG   ARG 117           HG1      ARG 117  14.008  -0.963  -3.781
  909   1HD   ARG 117           HD2      ARG 117  13.943  -1.515  -6.331
  910   2HD   ARG 117           HD1      ARG 117  12.220  -1.777  -6.063
  911    HE   ARG 117           HE       ARG 117  12.560   0.669  -4.925
  912   1HH1  ARG 117          HH11      ARG 117  13.655  -0.666  -7.941
  913   2HH1  ARG 117          HH12      ARG 117  13.646   0.862  -8.757
  914   1HH2  ARG 117          HH21      ARG 117  12.551   2.645  -5.995
  915   2HH2  ARG 117          HH22      ARG 117  13.023   2.727  -7.660
  916    H    LEU 118           HN       LEU 118  13.350  -5.816  -6.348
  917    HA   LEU 118           HA       LEU 118  14.775  -7.867  -4.715
  918   1HB   LEU 118           HB2      LEU 118  12.899  -7.966  -7.018
  919   2HB   LEU 118           HB1      LEU 118  14.207  -9.149  -7.036
  920    HG   LEU 118           HG       LEU 118  13.571  -9.693  -4.626
  921   1HD1  LEU 118          HD13      LEU 118  12.207  -7.520  -4.448
  922   2HD1  LEU 118          HD12      LEU 118  10.961  -8.363  -5.368
  923   3HD1  LEU 118          HD11      LEU 118  11.461  -8.978  -3.793
  924   1HD2  LEU 118          HD22      LEU 118  12.969 -11.134  -6.547
  925   2HD2  LEU 118          HD21      LEU 118  11.698 -11.139  -5.326
  926   3HD2  LEU 118          HD23      LEU 118  11.504 -10.183  -6.796
  927    H    ALA 119           HN       ALA 119  16.814  -8.575  -5.346
  928    HA   ALA 119           HA       ALA 119  18.354  -6.815  -7.071
  929   1HB   ALA 119           HB1      ALA 119  19.207  -8.078  -5.010
  930   2HB   ALA 119           HB3      ALA 119  19.232  -9.516  -6.030
  931   3HB   ALA 119           HB2      ALA 119  20.242  -8.129  -6.437
  932    H    GLY 120           HN       GLY 120  16.863  -9.992  -7.393
  933   1HA   GLY 120           HA2      GLY 120  18.161 -10.656  -9.900
  934   2HA   GLY 120           HA1      GLY 120  16.740 -11.459  -9.231
  935    H    SER 121           HN       SER 121  17.489 -10.189 -11.972
  936    HA   SER 121           HA       SER 121  15.368  -8.165 -12.272
  937   1HB   SER 121           HB2      SER 121  16.153  -8.427 -14.763
  938   2HB   SER 121           HB1      SER 121  17.207  -7.620 -13.606
  939    HG   SER 121           HG       SER 121  17.367 -10.403 -13.895
  940    H    PHE 122           HN       PHE 122  13.441  -8.501 -13.406
  941    HA   PHE 122           HA       PHE 122  12.934 -11.193 -14.554
  942   1HB   PHE 122           HB2      PHE 122  11.210  -9.883 -12.428
  943   2HB   PHE 122           HB1      PHE 122  10.772 -11.336 -13.327
  944    HD1  PHE 122           HD2      PHE 122  12.268 -13.382 -13.159
  945    HD2  PHE 122           HD1      PHE 122  12.657  -9.994 -10.549
  946    HE1  PHE 122           HE2      PHE 122  13.557 -14.766 -11.556
  947    HE2  PHE 122           HE1      PHE 122  13.948 -11.377  -8.946
  948    HZ   PHE 122           HZ       PHE 122  14.397 -13.764  -9.450
  949    H    GLU 123           HN       GLU 123  11.988 -10.915 -16.507
  950    HA   GLU 123           HA       GLU 123  10.817  -8.279 -17.175
  951   1HB   GLU 123           HB2      GLU 123  12.469  -9.608 -18.665
  952   2HB   GLU 123           HB1      GLU 123  11.081 -10.624 -19.055
  953   1HG   GLU 123           HG2      GLU 123  11.119  -8.944 -20.743
  954   2HG   GLU 123           HG1      GLU 123   9.844  -8.455 -19.628
  955    H    GLY 124           HN       GLY 124   8.646  -7.984 -17.645
  956   1HA   GLY 124           HA2      GLY 124   6.866 -10.352 -17.771
  957   2HA   GLY 124           HA1      GLY 124   6.561  -9.179 -16.489
  958    H    ASP 125           HN       ASP 125   4.774  -8.053 -17.109
  959    HA   ASP 125           HA       ASP 125   4.884  -6.616 -19.706
  960   1HB   ASP 125           HB2      ASP 125   2.483  -7.210 -20.132
  961   2HB   ASP 125           HB1      ASP 125   3.570  -8.597 -20.224
  962    H    THR 126           HN       THR 126   3.651  -6.968 -16.453
  963    HA   THR 126           HA       THR 126   2.235  -4.367 -16.604
  964    HB   THR 126           HB       THR 126   2.538  -6.105 -14.152
  965    HG1  THR 126           HG1      THR 126   0.402  -6.883 -14.943
  966   1HG2  THR 126          HG22      THR 126   0.580  -4.012 -15.109
  967   2HG2  THR 126          HG21      THR 126   0.223  -5.091 -13.760
  968   3HG2  THR 126          HG23      THR 126   1.586  -3.977 -13.661
  969    H    LYS 127           HN       LYS 127   3.386  -2.554 -16.193
  970    HA   LYS 127           HA       LYS 127   5.859  -2.775 -14.541
  971   1HB   LYS 127           HB2      LYS 127   4.907  -0.699 -16.531
  972   2HB   LYS 127           HB1      LYS 127   6.324  -0.468 -15.506
  973   1HG   LYS 127           HG2      LYS 127   7.222  -2.652 -16.419
  974   2HG   LYS 127           HG1      LYS 127   5.898  -2.629 -17.584
  975   1HD   LYS 127           HD2      LYS 127   7.726  -0.251 -17.276
  976   2HD   LYS 127           HD1      LYS 127   8.172  -1.608 -18.311
  977   1HE   LYS 127           HE2      LYS 127   5.546  -0.114 -18.538
  978   2HE   LYS 127           HE1      LYS 127   6.966   0.244 -19.521
  979   1HZ   LYS 127           HZ3      LYS 127   5.755  -2.456 -19.358
  980   2HZ   LYS 127           HZ2      LYS 127   5.313  -1.315 -20.537
  981   3HZ   LYS 127           HZ1      LYS 127   6.907  -1.899 -20.472
  982    H    MET 128           HN       MET 128   6.275  -0.834 -13.094
  983    HA   MET 128           HA       MET 128   3.800  -0.239 -11.579
  984   1HB   MET 128           HB2      MET 128   6.248  -0.963 -10.700
  985   2HB   MET 128           HB1      MET 128   6.437   0.790 -10.661
  986   1HG   MET 128           HG2      MET 128   3.982  -0.499  -9.488
  987   2HG   MET 128           HG1      MET 128   5.473  -0.401  -8.552
  988   1HE   MET 128           HE2      MET 128   3.018   0.701  -7.449
  989   2HE   MET 128           HE1      MET 128   2.606   2.397  -7.692
  990   3HE   MET 128           HE3      MET 128   2.215   1.201  -8.935
  991    H    ILE 129           HN       ILE 129   3.055   1.873 -11.231
  992    HA   ILE 129           HA       ILE 129   3.582   3.809 -13.287
  993    HB   ILE 129           HB       ILE 129   2.201   5.330 -11.850
  994   1HG1  ILE 129          HG12      ILE 129   1.947   2.964  -9.984
  995   2HG1  ILE 129          HG11      ILE 129   3.129   4.244  -9.703
  996   1HG2  ILE 129          HG21      ILE 129   1.352   3.351 -13.382
  997   2HG2  ILE 129          HG23      ILE 129   0.855   2.649 -11.843
  998   3HG2  ILE 129          HG22      ILE 129   0.219   4.215 -12.343
  999   1HD1  ILE 129          HD11      ILE 129   0.244   4.932 -10.211
 1000   2HD1  ILE 129          HD13      ILE 129   0.775   4.456  -8.598
 1001   3HD1  ILE 129          HD12      ILE 129   1.476   5.876  -9.374
 1002    HA   PRO 130           HA       PRO 130   6.944   6.139 -11.538
 1003   1HB   PRO 130           HB2      PRO 130   6.210   8.689 -12.426
 1004   2HB   PRO 130           HB1      PRO 130   7.102   7.483 -13.362
 1005   1HG   PRO 130           HG2      PRO 130   4.439   8.445 -13.795
 1006   2HG   PRO 130           HG1      PRO 130   5.348   7.262 -14.746
 1007   1HD   PRO 130           HD2      PRO 130   3.221   6.807 -12.792
 1008   2HD   PRO 130           HD1      PRO 130   3.906   5.688 -13.983
 1009    H    LEU 131           HN       LEU 131   6.829   6.269  -9.305
 1010    HA   LEU 131           HA       LEU 131   4.827   8.069  -8.058
 1011   1HB   LEU 131           HB2      LEU 131   6.830   6.150  -6.826
 1012   2HB   LEU 131           HB1      LEU 131   5.624   7.075  -5.928
 1013    HG   LEU 131           HG       LEU 131   4.838   5.250  -8.201
 1014   1HD1  LEU 131          HD11      LEU 131   6.121   3.962  -6.482
 1015   2HD1  LEU 131          HD13      LEU 131   4.983   4.526  -5.259
 1016   3HD1  LEU 131          HD12      LEU 131   4.425   3.487  -6.571
 1017   1HD2  LEU 131          HD21      LEU 131   3.223   6.956  -7.360
 1018   2HD2  LEU 131          HD23      LEU 131   2.670   5.308  -7.059
 1019   3HD2  LEU 131          HD22      LEU 131   3.364   6.259  -5.746
 1020    H    ASN 132           HN       ASN 132   5.402   9.960  -7.008
 1021    HA   ASN 132           HA       ASN 132   8.053  11.057  -7.608
 1022   1HB   ASN 132           HB2      ASN 132   5.731  12.286  -7.553
 1023   2HB   ASN 132           HB1      ASN 132   6.049  12.409  -5.823
 1024   1HD2  ASN 132          HD22      ASN 132   8.937  14.139  -8.187
 1025   2HD2  ASN 132          HD21      ASN 132   8.373  12.582  -8.566
 1026    H    TRP 133           HN       TRP 133   9.402   9.665  -6.313
 1027    HA   TRP 133           HA       TRP 133   9.021   9.322  -3.477
 1028   1HB   TRP 133           HB2      TRP 133  11.532   9.082  -5.162
 1029   2HB   TRP 133           HB1      TRP 133  11.369   8.514  -3.501
 1030    HD1  TRP 133           HD1      TRP 133  10.451   7.665  -7.064
 1031    HE1  TRP 133           HE1      TRP 133   9.328   5.345  -7.128
 1032    HE3  TRP 133           HE3      TRP 133   9.842   6.840  -2.061
 1033    HZ2  TRP 133           HZ2      TRP 133   8.306   3.397  -5.300
 1034    HZ3  TRP 133           HZ3      TRP 133   8.791   4.747  -1.251
 1035    HH2  TRP 133           HH2      TRP 133   8.023   3.026  -2.862
 1036    H    ASP 134           HN       ASP 134  10.218  11.929  -5.380
 1037    HA   ASP 134           HA       ASP 134  12.057  13.121  -3.547
 1038   1HB   ASP 134           HB2      ASP 134  11.630  13.774  -5.984
 1039   2HB   ASP 134           HB1      ASP 134  10.215  14.649  -5.398
 1040    H    ASP 135           HN       ASP 135   8.552  13.082  -3.686
 1041    HA   ASP 135           HA       ASP 135   8.345  15.123  -1.551
 1042   1HB   ASP 135           HB2      ASP 135   6.411  13.724  -3.366
 1043   2HB   ASP 135           HB1      ASP 135   5.814  14.413  -1.856
 1044    H    PHE 136           HN       PHE 136   9.607  12.470  -1.074
 1045    HA   PHE 136           HA       PHE 136   7.906  11.678   1.235
 1046   1HB   PHE 136           HB2      PHE 136   8.902   9.894  -0.977
 1047   2HB   PHE 136           HB1      PHE 136   8.656   9.246   0.645
 1048    HD1  PHE 136           HD1      PHE 136   6.377   9.546   1.749
 1049    HD2  PHE 136           HD2      PHE 136   7.067  10.281  -2.427
 1050    HE1  PHE 136           HE1      PHE 136   3.940   9.389   1.319
 1051    HE2  PHE 136           HE2      PHE 136   4.629  10.124  -2.857
 1052    HZ   PHE 136           HZ       PHE 136   3.067   9.678  -0.984
 1053    H    THR 137           HN       THR 137   9.270  10.088   2.661
 1054    HA   THR 137           HA       THR 137  12.178  10.636   2.497
 1055    HB   THR 137           HB       THR 137  10.715  11.124   5.091
 1056    HG1  THR 137           HG1      THR 137  10.107  12.521   3.191
 1057   1HG2  THR 137          HG23      THR 137  13.281  10.734   4.798
 1058   2HG2  THR 137          HG22      THR 137  13.282  12.372   4.144
 1059   3HG2  THR 137          HG21      THR 137  12.734  12.082   5.795
 1060    H    LYS 138           HN       LYS 138  13.356   8.898   3.223
 1061    HA   LYS 138           HA       LYS 138  11.970   6.437   3.868
 1062   1HB   LYS 138           HB2      LYS 138  14.236   6.718   2.663
 1063   2HB   LYS 138           HB1      LYS 138  14.922   6.927   4.275
 1064   1HG   LYS 138           HG2      LYS 138  14.389   4.745   4.930
 1065   2HG   LYS 138           HG1      LYS 138  13.129   4.582   3.705
 1066   1HD   LYS 138           HD2      LYS 138  14.954   3.269   2.911
 1067   2HD   LYS 138           HD1      LYS 138  15.002   4.759   1.967
 1068   1HE   LYS 138           HE2      LYS 138  17.255   4.200   2.750
 1069   2HE   LYS 138           HE1      LYS 138  16.695   5.675   3.539
 1070   1HZ   LYS 138           HZ1      LYS 138  16.098   3.150   4.869
 1071   2HZ   LYS 138           HZ3      LYS 138  17.719   3.650   4.877
 1072   3HZ   LYS 138           HZ2      LYS 138  16.518   4.658   5.532
 1073    H    VAL 139           HN       VAL 139  12.220   5.226   5.875
 1074    HA   VAL 139           HA       VAL 139  13.124   6.758   8.245
 1075    HB   VAL 139           HB       VAL 139  10.984   6.219   9.436
 1076   1HG1  VAL 139          HG11      VAL 139  11.463   8.436   8.305
 1077   2HG1  VAL 139          HG13      VAL 139  10.530   7.853   6.926
 1078   3HG1  VAL 139          HG12      VAL 139   9.750   8.059   8.493
 1079   1HG2  VAL 139          HG23      VAL 139  10.117   5.444   6.632
 1080   2HG2  VAL 139          HG22      VAL 139  10.229   4.369   8.025
 1081   3HG2  VAL 139          HG21      VAL 139   9.019   5.653   7.997
 1082    H    SER 140           HN       SER 140  12.060   3.743   6.773
 1083    HA   SER 140           HA       SER 140  13.790   2.262   8.668
 1084   1HB   SER 140           HB2      SER 140  11.296   2.343   9.446
 1085   2HB   SER 140           HB1      SER 140  11.019   1.215   8.122
 1086    HG   SER 140           HG       SER 140  11.505   0.144  10.086
 1087    H    SER 141           HN       SER 141  14.409   0.169   7.831
 1088    HA   SER 141           HA       SER 141  13.484  -0.648   5.171
 1089   1HB   SER 141           HB2      SER 141  15.169   1.135   4.680
 1090   2HB   SER 141           HB1      SER 141  16.372   0.196   5.559
 1091    HG   SER 141           HG       SER 141  16.581  -1.016   3.863
 1092    H    ARG 142           HN       ARG 142  13.187  -2.774   5.648
 1093    HA   ARG 142           HA       ARG 142  15.116  -4.171   7.410
 1094   1HB   ARG 142           HB2      ARG 142  12.515  -4.377   7.506
 1095   2HB   ARG 142           HB1      ARG 142  12.714  -5.450   6.119
 1096   1HG   ARG 142           HG2      ARG 142  12.794  -6.896   7.995
 1097   2HG   ARG 142           HG1      ARG 142  14.484  -6.670   7.542
 1098   1HD   ARG 142           HD2      ARG 142  14.884  -5.168   9.320
 1099   2HD   ARG 142           HD1      ARG 142  13.164  -4.873   9.573
 1100    HE   ARG 142           HE       ARG 142  13.026  -6.912  10.802
 1101   1HH1  ARG 142          HH21      ARG 142  16.119  -6.495   9.276
 1102   2HH1  ARG 142          HH22      ARG 142  16.861  -7.789  10.158
 1103   1HH2  ARG 142          HH11      ARG 142  14.000  -8.588  11.940
 1104   2HH2  ARG 142          HH12      ARG 142  15.666  -8.967  11.658
 1105    H    THR 143           HN       THR 143  16.920  -4.818   6.314
 1106    HA   THR 143           HA       THR 143  16.748  -5.674   3.502
 1107    HB   THR 143           HB       THR 143  19.182  -5.865   5.281
 1108    HG1  THR 143           HG1      THR 143  18.515  -3.610   3.734
 1109   1HG2  THR 143          HG23      THR 143  18.786  -5.368   2.317
 1110   2HG2  THR 143          HG22      THR 143  20.343  -5.470   3.138
 1111   3HG2  THR 143          HG21      THR 143  19.301  -6.890   3.046
 1112    H    VAL 144           HN       VAL 144  17.263  -7.806   2.786
 1113    HA   VAL 144           HA       VAL 144  17.660  -9.925   4.792
 1114    HB   VAL 144           HB       VAL 144  15.207  -9.639   4.765
 1115   1HG1  VAL 144          HG11      VAL 144  15.175  -8.728   2.392
 1116   2HG1  VAL 144          HG13      VAL 144  15.320 -10.394   1.836
 1117   3HG1  VAL 144          HG12      VAL 144  13.908  -9.896   2.766
 1118   1HG2  VAL 144          HG22      VAL 144  16.336 -11.935   4.910
 1119   2HG2  VAL 144          HG21      VAL 144  14.640 -11.936   4.426
 1120   3HG2  VAL 144          HG23      VAL 144  15.903 -12.143   3.213
 1121    H    GLU 145           HN       GLU 145  19.066 -11.363   3.921
 1122    HA   GLU 145           HA       GLU 145  19.415 -11.371   0.960
 1123   1HB   GLU 145           HB2      GLU 145  21.243 -12.319   3.189
 1124   2HB   GLU 145           HB1      GLU 145  21.614 -12.441   1.469
 1125   1HG   GLU 145           HG2      GLU 145  21.157  -9.892   1.397
 1126   2HG   GLU 145           HG1      GLU 145  21.320  -9.957   3.153
 1127    H    ASP 146           HN       ASP 146  18.460 -13.041  -0.076
 1128    HA   ASP 146           HA       ASP 146  17.561 -15.412   1.383
 1129   1HB   ASP 146           HB2      ASP 146  16.441 -14.206  -0.660
 1130   2HB   ASP 146           HB1      ASP 146  17.555 -15.184  -1.615
 1131    H    THR 147           HN       THR 147  17.989 -17.465  -0.436
 1132    HA   THR 147           HA       THR 147  20.740 -18.181   0.151
 1133    HB   THR 147           HB       THR 147  20.153 -20.204  -1.305
 1134    HG1  THR 147           HG1      THR 147  18.331 -18.686  -2.182
 1135   1HG2  THR 147          HG21      THR 147  18.672 -19.356   1.167
 1136   2HG2  THR 147          HG23      THR 147  18.291 -20.900   0.405
 1137   3HG2  THR 147          HG22      THR 147  19.925 -20.584   0.988
 1138    H    ASN 148           HN       ASN 148  18.958 -17.316  -2.812
 1139    HA   ASN 148           HA       ASN 148  21.546 -17.239  -4.282
 1140   1HB   ASN 148           HB2      ASN 148  19.565 -18.523  -5.219
 1141   2HB   ASN 148           HB1      ASN 148  18.757 -16.970  -5.431
 1142   1HD2  ASN 148          HD22      ASN 148  21.539 -18.137  -8.112
 1143   2HD2  ASN 148          HD21      ASN 148  21.012 -19.152  -6.858
 1144    HA   PRO 149           HA       PRO 149  21.913 -12.809  -3.959
 1145   1HB   PRO 149           HB2      PRO 149  22.660 -12.611  -6.764
 1146   2HB   PRO 149           HB1      PRO 149  23.659 -12.365  -5.327
 1147   1HG   PRO 149           HG2      PRO 149  23.612 -14.618  -7.097
 1148   2HG   PRO 149           HG1      PRO 149  24.649 -14.343  -5.692
 1149   1HD   PRO 149           HD2      PRO 149  22.609 -16.257  -5.890
 1150   2HD   PRO 149           HD1      PRO 149  23.429 -15.748  -4.406
 1151    H    ALA 150           HN       ALA 150  20.368 -14.147  -6.881
 1152    HA   ALA 150           HA       ALA 150  18.949 -11.784  -7.634
 1153   1HB   ALA 150           HB2      ALA 150  18.197 -14.692  -8.065
 1154   2HB   ALA 150           HB1      ALA 150  17.497 -13.319  -8.922
 1155   3HB   ALA 150           HB3      ALA 150  19.201 -13.718  -9.140
 1156    H    LEU 151           HN       LEU 151  18.158 -14.417  -5.399
 1157    HA   LEU 151           HA       LEU 151  15.454 -13.461  -4.896
 1158