*HEADER    ANTIMICROBIAL PROTEIN                   11-APR-09   2KHT              
*TITLE     NMR STRUCTURE OF HUMAN ALPHA DEFENSIN HNP-1                           
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: NEUTROPHIL DEFENSIN 1;                                     
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: RESIDUES 65-94;                                            
*COMPND   5 SYNONYM: HNP-1, HP-1, HP1, DEFENSIN, ALPHA 1, HP 1-56,               
*COMPND   6 NEUTROPHIL DEFENSIN 2, HNP-2, HP-2, HP2;                             
*COMPND   7 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: DEF1, DEFA1, DEFA2, MRS;                                       
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PGEX-2T                                   
*KEYWDS    MICROCRYSTALLINE PROTEIN, HUMAN ALPHA DEFENSIN,                       
*KEYWDS   2 ANTIMICROBIAL, DEFENSIN, SECRETED, ANTIBIOTIC, ANTIVIRAL             
*KEYWDS   3 DEFENSE, DISULFIDE BOND, FUNGICIDE, PHOSPHOPROTEIN,                  
*KEYWDS   4 ANTIMICROBIAL PROTEIN                                                
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    Y.ZHANG, S.LI, T.F.DOHERTY, J.LUBKOWSKI, W.LU, J.LI,                  
*AUTHOR   2 C.BARINKA, M.HONG                                                    
*REVDAT   1   09-FEB-10 2KHT    0                                                


#HNP1_noe_080809.sat
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       ( resid 30 and name SG ) 1.9 1 1 !
assign ( resid 4  and name SG ) 
       ( resid 19 and name SG ) 1.9 1 1 !
assign ( resid 9  and name SG ) 
       ( resid 29 and name SG ) 1.9 1 1 !
assign ( resid 1  and name CA ) 
       ( resid 2  and name CA ) 3.8 1 1 ! 
assign ( resid 2  and name CA ) 
       ( resid 3  and name CA ) 3.8 1 1 ! 
assign ( resid 3  and name CA ) 
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assign ( resid 4  and name CA ) 
       ( resid 5  and name CA ) 3.8 1 1 ! 
assign ( resid 5  and name CA ) 
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assign ( resid 6  and name CA ) 
       ( resid 7  and name CA ) 3.8 1 1 ! 
assign ( resid 8  and name CA ) 
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assign ( resid 9  and name CA ) 
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assign ( resid 10 and name CA ) 
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assign ( resid 11 and name CA ) 
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assign ( resid 12 and name CA ) 
       ( resid 13 and name CA ) 3.8 1 1 ! 
assign ( resid 13 and name CA ) 
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assign ( resid 14 and name CA ) 
       ( resid 15 and name CA ) 3.8 1 1 ! 
assign ( resid 17 and name CA ) 
       ( resid 18 and name CA ) 3.8 1 1 ! 
assign ( resid 18 and name CA ) 
       ( resid 19 and name CA ) 3.8 1 1 ! 
assign ( resid 20 and name CA ) 
       ( resid 21 and name CA ) 3.8 1 1 ! 
assign ( resid 22 and name CA ) 
       ( resid 23 and name CA ) 3.8 1 1 ! 
assign ( resid 28 and name CA ) 
       ( resid 29 and name CA ) 3.8 1 1 ! 
assign ( resid 29 and name CA ) 
       ( resid 30 and name CA ) 3.8 1 1 ! 
assign ( resid 1 and name CB ) 
       ( resid 2 and name CA ) 5.0 2.5 2.5 ! 
assign ( resid 1 and name CB ) 
       ( resid 2 and name CB ) 5.0 2.5 2.5 !
assign ( resid 1 and name CA ) 
       ( resid 2 and name CB ) 5.0 2.5 2.5 !        
assign ( resid 2 and name CA ) 
       ( resid 3 and name CB ) 5.0 2.5 2.5 ! 
assign ( resid 3 and name CA ) 
       ( resid 4 and name CB ) 5.0 2.5 2.5 ! 
assign ( resid 3 and name CB ) 
       ( resid 4 and name CB ) 5.0 2.5 2.5 ! 
assign ( resid 3 and name CB ) 
       ( resid 4 and name CA ) 5.0 2.5 2.5 !          
assign ( resid 4 and name CA ) 
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assign ( resid 4 and name CA ) 
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assign ( resid 4 and name CB ) 
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assign ( resid 4 and name CB ) 
       ( resid 5 and name CB ) 5.0 2.5 2.5 ! 
assign ( resid 4 and name CA ) 
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assign ( resid 4 and name CB ) 
       ( resid 5 and name CA ) 5.0 2.5 2.5 !          
assign ( resid 5 and name CB ) 
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assign ( resid 5 and name CB ) 
       ( resid 6 and name CD1 ) 5.0 2.5 2.5 ! 
assign ( resid 5 and name CB ) 
       ( resid 6 and name CA ) 5.0 2.5 2.5 !    
assign ( resid 5 and name CD ) 
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assign ( resid 5 and name CB ) 
       ( resid 6 and name CG1 ) 5.0 2.5 2.5 ! 
assign ( resid 5 and name CG ) 
       ( resid 6 and name CG1 ) 5.0 2.5 2.5 !   
assign ( resid 5 and name CB ) 
       ( resid 6 and name CD1 ) 5.0 2.5 2.5 ! 
assign ( resid 5 and name CA ) 
       ( resid 6 and name CD1 ) 5.0 2.5 2.5 ! 
assign ( resid 5 and name CD ) 
       ( resid 6 and name CD1 ) 5.0 2.5 2.5 !          
assign ( resid 6 and name CA ) 
       ( resid 7 and name CG ) 5.0 2.5 2.5 ! 
assign ( resid 6 and name CB ) 
       ( resid 7 and name CD ) 5.0 2.5 2.5 ! 
assign ( resid 6 and name CG1 ) 
       ( resid 7 and name CB ) 5.0 2.5 2.5 ! 
assign ( resid 6 and name CG1 ) 
       ( resid 7 and name CD ) 5.0 2.5 2.5 ! 
assign ( resid 6 and name CG1 ) 
       ( resid 7 and name CG ) 5.0 2.5 2.5 ! 
assign ( resid 6 and name CD1 ) 
       ( resid 7 and name CA ) 5.0 2.5 2.5 !  
assign ( resid 6 and name CD1 ) 
       ( resid 7 and name CB ) 5.0 2.5 2.5 ! 
assign ( resid 6 and name CA ) 
       ( resid 7 and name CB ) 5.0 2.5 2.5 ! 
assign ( resid 7 and name CD ) 
       ( resid 8 and name CA ) 5.0 2.5 2.5 ! 
assign ( resid 7 and name CD ) 
       ( resid 8 and name CB ) 5.0 2.5 2.5 ! 
assign ( resid 7 and name CA ) 
       ( resid 8 and name CB ) 5.0 2.5 2.5 ! 
assign ( resid 7 and name CB ) 
       ( resid 8 and name CA ) 5.0 2.5 2.5 ! 
assign ( resid 7 and name CG ) 
       ( resid 8 and name CB ) 5.0 2.5 2.5 ! 
assign ( resid 8 and name CA ) 
       ( resid 9 and name CB ) 5.0 2.5 2.5 ! 
assign ( resid 8 and name CB ) 
       ( resid 9 and name CB ) 5.0 2.5 2.5 !  
assign ( resid 8 and name CB ) 
       ( resid 9 and name CA ) 5.0 2.5 2.5 !         
assign ( resid 9  and name CB ) 
       ( resid 10 and name CG1 ) 5.0 2.5 2.5 ! 
assign ( resid 9  and name CA ) 
       ( resid 10 and name CB ) 5.0 2.5 2.5 ! 
assign ( resid 9  and name CB ) 
       ( resid 10 and name CD1 ) 5.0 2.5 2.5 ! 
assign ( resid 9  and name CA ) 
       ( resid 10 and name CD1 ) 5.0 2.5 2.5 ! 
assign ( resid 9  and name CA ) 
       ( resid 10 and name CG1 ) 5.0 2.5 2.5 ! 
assign ( resid 9  and name CB ) 
       ( resid 10 and name CD1 ) 5.0 2.5 2.5 !        
assign ( resid 9  and name CB ) 
       ( resid 10 and name CB ) 5.0 2.5 2.5 !    
assign ( resid 10 and name CB ) 
       ( resid 11 and name CB ) 5.0 2.5 2.5 !        
assign ( resid 10 and name CB ) 
       ( resid 11 and name CA ) 5.0 2.5 2.5 ! 
assign ( resid 10 and name CA ) 
       ( resid 11 and name CB ) 5.0 2.5 2.5 !        
assign ( resid 10 and name CD1 ) 
       ( resid 11 and name CA ) 5.0 2.5 2.5 !
assign ( resid 10 and name CG2 ) 
       ( resid 11 and name CA ) 5.0 2.5 2.5 !        
assign ( resid 10 and name CG1 ) 
       ( resid 11 and name CB ) 5.0 2.5 2.5 !
assign ( resid 11 and name CB ) 
       ( resid 12 and name CA ) 5.0 2.5 2.5 !        
assign ( resid 12 and name CA ) 
       ( resid 13 and name CG ) 5.0 2.5 2.5 !        
assign ( resid 12 and name CA ) 
       ( resid 13 and name CB ) 5.0 2.5 2.5 !        
assign ( resid 13 and name CA ) 
       ( resid 14 and name CG ) 5.0 2.5 2.5 !        
assign ( resid 13 and name CB ) 
       ( resid 14 and name CA ) 5.0 2.5 2.5 !  
assign ( resid 13 and name CG ) 
       ( resid 14 and name CD ) 5.0 2.5 2.5 !        
assign ( resid 13 and name CG ) 
       ( resid 14 and name CB ) 5.0 2.5 2.5 !         
assign ( resid 13 and name CG ) 
       ( resid 14 and name CG ) 5.0 2.5 2.5 !        
assign ( resid 13 and name CG ) 
       ( resid 14 and name CA ) 5.0 2.5 2.5 !   
assign ( resid 13 and name CB ) 
       ( resid 14 and name CG ) 5.0 2.5 2.5 !        
assign ( resid 15 and name CB ) 
       ( resid 16 and name CA ) 5.0 2.5 2.5 !   
assign ( resid 15 and name CD ) 
       ( resid 16 and name CB ) 5.0 2.5 2.5 !
assign ( resid 15 and name CB ) 
       ( resid 16 and name CB ) 5.0 2.5 2.5 ! 
assign ( resid 15 and name CA ) 
       ( resid 16 and name CB ) 5.0 2.5 2.5 !   
assign ( resid 15 and name CD ) 
       ( resid 16 and name CB ) 5.0 2.5 2.5 !
assign ( resid 15 and name CG ) 
       ( resid 16 and name CB ) 5.0 2.5 2.5 !        
assign ( resid 17 and name CA ) 
       ( resid 18 and name CB ) 5.0 2.5 2.5 !
assign ( resid 17 and name CA ) 
       ( resid 18 and name CG2 ) 5.0 2.5 2.5 !       
assign ( resid 18 and name CA ) 
       ( resid 19 and name CB ) 5.0 2.5 2.5 !        
assign ( resid 18 and name CB ) 
       ( resid 19 and name CB ) 5.0 2.5 2.5 !          
assign ( resid 18 and name CB ) 
       ( resid 19 and name CA ) 5.0 2.5 2.5 !  
assign ( resid 18 and name CG2 ) 
       ( resid 19 and name CB ) 5.0 2.5 2.5 !          
assign ( resid 18 and name CG2 ) 
       ( resid 19 and name CA ) 5.0 2.5 2.5 !         
assign ( resid 19 and name CA ) 
       ( resid 20 and name CB ) 5.0 2.5 2.5 !                
assign ( resid 19 and name CB ) 
       ( resid 20 and name CG1 ) 5.0 2.5 2.5 ! 
assign ( resid 19 and name CA ) 
       ( resid 20 and name CD1 ) 5.0 2.5 2.5 !                
assign ( resid 19 and name CB ) 
       ( resid 20 and name CG1 ) 5.0 2.5 2.5 ! 
assign ( resid 19 and name CB ) 
       ( resid 20 and name CG2 ) 5.0 2.5 2.5 !                
assign ( resid 19 and name CB ) 
       ( resid 20 and name CA ) 5.0 2.5 2.5 ! 
assign ( resid 19 and name CB ) 
       ( resid 20 and name CD1 ) 5.0 2.5 2.5 !                
assign ( resid 19 and name CA ) 
       ( resid 20 and name CG2 ) 5.0 2.5 2.5 !                     
assign ( resid 20 and name CA ) 
       ( resid 21 and name CB ) 5.0 2.5 2.5 !    
assign ( resid 20 and name CB ) 
       ( resid 21 and name CA ) 5.0 2.5 2.5 !    
assign ( resid 20 and name CB ) 
       ( resid 21 and name CB ) 5.0 2.5 2.5 !    
assign ( resid 20 and name CG1 ) 
       ( resid 21 and name CA ) 5.0 2.5 2.5 ! 
assign ( resid 20 and name CD1 ) 
       ( resid 21 and name CA ) 5.0 2.5 2.5 ! 
assign ( resid 20 and name CG2 ) 
       ( resid 21 and name CB ) 5.0 2.5 2.5 !    
assign ( resid 20 and name CD1 ) 
       ( resid 21 and name CB ) 5.0 2.5 2.5 ! 
assign ( resid 20 and name CG1 ) 
       ( resid 21 and name CB ) 5.0 2.5 2.5 !           
assign ( resid 21 and name CB ) 
       ( resid 22 and name CB ) 5.0 2.5 2.5 !                 
assign ( resid 21 and name CA ) 
       ( resid 22 and name CG ) 5.0 2.5 2.5 !    
assign ( resid 21 and name CA ) 
       ( resid 22 and name CB ) 5.0 2.5 2.5 !     
assign ( resid 22 and name CB ) 
       ( resid 23 and name CA ) 5.0 2.5 2.5 ! 
assign ( resid 22 and name CG ) 
       ( resid 23 and name CA ) 5.0 2.5 2.5 !            
assign ( resid 23 and name CA ) 
       ( resid 24 and name CD ) 5.0 2.5 2.5 !    
assign ( resid 23 and name CA ) 
       ( resid 24 and name CB ) 5.0 2.5 2.5 !    
assign ( resid 23 and name CA ) 
       ( resid 24 and name CG ) 5.0 2.5 2.5 !        
assign ( resid 25 and name CB ) 
       ( resid 26 and name CB ) 5.0 2.5 2.5 ! 
assign ( resid 25 and name CB ) 
       ( resid 26 and name CA ) 5.0 2.5 2.5 !                       
assign ( resid 26 and name CA ) 
       ( resid 27 and name CB ) 5.0 2.5 2.5 !    
assign ( resid 26 and name CB ) 
       ( resid 27 and name CB ) 5.0 2.5 2.5 !    
assign ( resid 26 and name CB ) 
       ( resid 27 and name CA ) 5.0 2.5 2.5 !     
assign ( resid 27 and name CA ) 
       ( resid 28 and name CB ) 5.0 2.5 2.5 !    
assign ( resid 27 and name CB ) 
       ( resid 28 and name CA ) 5.0 2.5 2.5 !
assign ( resid 27 and name CB ) 
       ( resid 28 and name CB ) 5.0 2.5 2.5 !   
assign ( resid 28 and name CB ) 
       ( resid 29 and name CA ) 5.0 2.5 2.5 !                  
assign ( resid 29 and name CB ) 
       ( resid 30 and name CB ) 5.0 2.5 2.5 !    
assign ( resid 29 and name CB ) 
       ( resid 30 and name CA ) 5.0 2.5 2.5 !
assign ( resid 29 and name CA ) 
       ( resid 30 and name CB ) 5.0 2.5 2.5 !     
assign ( resid 26 and name CB ) 
       (( resid 18 and name CA )OR ( resid 20 and name CA ))5.0 2.5 2.5 !         
assign ( resid 26 and name CB ) 
       ( resid 28 and name CB )  5.0 2.5 2.5 ! 
assign ( resid 26 and name CA ) 
       (( resid 18 and name CA )OR ( resid 20 and name CA ))5.0 2.5 2.5 !  
assign ( resid 7 and name CG ) 
       (( resid 6 and name CA )OR ( resid 10 and name CA ))5.0 2.5 2.5 !          
assign ( resid 25 and name CA ) 
       ( resid 20 and name CB ) 5.0 2.5 2.5 !     
assign ( resid 21 and name CA ) 
       (( resid 24 and name CA )OR ( resid 25 and name CA ))5.0 2.5 2.5 !            
assign ( resid 27 and name CB ) 
       ( resid 15 and name CA )  5.0 2.5 2.5 !   
assign ( resid 27 and name CA ) 
       ( resid 15 and name CA ) 5.0 2.5 2.5 !   
assign ( resid 30 and name CA ) 
       (( resid 2 and name CA )OR ( resid 29 and name CA ))5.0 2.5 2.5 !              
assign ( resid 19 and name CB ) 
       ( resid 4 and name CB ) 5.0 2.5 2.5 !   
assign ( resid 29 and name CB ) 
       (( resid 13 and name CA )OR ( resid 14 and name CA ))5.0 2.5 2.5 !           
assign ( resid 30 and name CB ) 
       (( resid 2 and name CA )OR ( resid 29 and name CA ))5.0 2.5 2.5 !         
assign ( resid 27 and name CB ) 
       (( resid 5 and name CA )OR ( resid 15 and name CA ))5.0 2.5 2.5 !       
assign ( resid 27 and name CA ) 
       ( resid 5 and name CA ) 5.0 2.5 2.5 !   
assign ( resid 4 and name CB ) 
       ( resid 27 and name CA) 5.0 2.5 2.5 !   
assign ( resid 27 and name CB ) 
       ( resid 5 and name CA ) 5.0 2.5 2.5 !  
assign ( resid 21 and name CB ) 
       (( resid 24 and name CA )OR ( resid 25 and name CA ))5.0 2.5 2.5 !           
assign ( resid 5 and name CA ) 
       ( resid 8 and name CA ) 5.0 2.5 2.5 !         
assign ( resid 13 and name CB ) 
       (resid 30 and name CA ) 5.0 2.5 2.5 !  
assign ( resid 29 and name CB ) 
       ( resid 9 and name CB ) 5.0 2.5 2.5 !  
assign ( resid 8 and name CB ) 
       ( resid 5 and name CA ) 5.0 2.5 2.5 !         
assign ( resid 12 and name CA ) 
       (( resid 30 and name CA )OR ( resid 5 and name CA ) OR ( resid 15 and name CA ) OR ( resid 22 and name CA ))5.0 2.5 2.5 !          
assign ( resid 5 and name CA ) 
       ( resid 7 and name CD) 5.0 2.5 2.5 !     
assign ( resid 5 and name CA ) 
       ( resid 10 and name CA) 5.0 2.5 2.5 !      
assign ( resid 5 and name CA ) 
       ( resid 7 and name CA) 5.0 2.5 2.5 !            
assign ( resid 3 and name CA ) 
       ( resid 29 and name CB ) 5.0 2.5 2.5 !  
assign ( resid 5 and name CB ) 
       ( resid 7 and name CB ) 5.0 2.5 2.5 ! 
assign ( resid 5 and name CA ) 
       ( resid 7 and name CG ) 5.0 2.5 2.5 ! 
assign ( resid 4 and name CB ) 
       (( resid 29 and name CB )OR ( resid 28 and name CB ))5.0 2.5 2.5 !            
assign ( resid 9 and name CB ) 
       ( resid 29 and name CA ) 5.0 2.5 2.5 !     
assign (( resid 26 and name CA )OR ( resid 29 and name CA ))
       (( resid 18 and name CA )OR ( resid 20 and name CA ))5.0 2.5 2.5 !                
assign ( resid 2 and name CB ) 
       ( resid 30 and name CA ) 5.0 2.5 2.5 ! 
assign ( resid 3 and name CB ) 
       ( resid 29 and name CB ) 5.0 2.5 2.5 ! 
assign ( resid 5 and name CB ) 
       ( resid 27 and name CA ) 5.0 2.5 2.5 !
assign ( resid 15 and name CA ) 
       ( resid 13 and name CG ) 5.0 2.5 2.5 ! 
assign ( resid 8 and name CB ) 
       ( resid 29 and name CA ) 5.0 2.5 2.5 !      
assign ( resid 5 and name CA ) 
       ( resid 26 and name CB ) 5.0 2.5 2.5 ! 
assign ( resid 27 and name CB ) 
       (( resid 29 and name CB )OR ( resid 16 and name CB ))5.0 2.5 2.5 !         
assign ( resid 13 and name CG ) 
       ( resid 30 and name CA ) 5.0 2.5 2.5 !   
assign ( resid 13 and name CG ) 
       (( resid 14 and name CD )OR ( resid 27 and name CB ) OR ( resid 29 and name CB ))5.0 2.5 2.5 !          
assign ( resid 14 and name CB ) 
       ( resid 28 and name CB ) 5.0 2.5 2.5 ! 
assign ( resid 26 and name CB ) 
       (( resid 8 and name CB )OR ( resid 18 and name CB ))5.0 2.5 2.5 !            
assign ( resid 26 and name CB ) 
       (( resid 29 and name CB )OR ( resid 17 and name CB ))5.0 2.5 2.5 !      
assign ( resid 26 and name CA ) 
       (( resid 15 and name CG )OR ( resid 5 and name CG ))5.0 2.5 2.5 !    
assign ( resid 9 and name CA ) 
       ( resid 29 and name CB ) 5.0 2.5 2.5 ! 
assign ( resid 21 and name CB ) 
       (( resid 25 and name CB )OR ( resid 24 and name CD ))5.0 2.5 2.5 !          
assign ( resid 4 and name CB ) 
       ( resid 19 and name CA ) 5.0 2.5 2.5 !
assign ( resid 9 and name CA ) 
       ( resid 29 and name CB ) 5.0 2.5 2.5 ! 
assign ( resid 27 and name CA ) 
       ( resid 15 and name CB ) 5.0 2.5 2.5 ! 
assign ( resid 27 and name CB ) 
       (( resid 16 and name CB )OR ( resid 29 and name CB ))5.0 2.5 2.5 !           
assign ( resid 27 and name CB ) 
       (( resid 15 and name CD )OR ( resid 5 and name CD ))5.0 2.5 2.5 !                 
assign ( resid 27 and name CB ) 
       ( resid 25 and name CB ) 5.0 2.5 2.5 !
assign ( resid 27 and name CB ) 
       ( resid 6 and name CD1 ) 5.0 2.5 2.5 ! 
assign ( resid 8 and name CA ) 
       (( resid 16 and name CB )OR ( resid 29 and name CB ) OR ( resid 10 and name CB ))5.0 2.5 2.5 !          
assign ( resid 8 and name CB ) 
       ( resid 6 and name CB ) 5.0 2.5 2.5 ! 
assign ( resid 8 and name CA ) 
       (( resid 25 and name CA )OR ( resid 24 and name CA ) OR ( resid 29 and name CA ))5.0 2.5 2.5 !         
assign ( resid 8 and name CB ) 
       ( resid 6 and name CD1 ) 5.0 2.5 2.5 !
assign ( resid 7 and name CG ) 
       ( resid 5 and name CB ) 5.0 2.5 2.5 ! 
assign ( resid 2 and name CA ) 
       ( resid 30 and name CA ) 5.0 2.5 2.5 !
assign ( resid 2 and name CA ) 
       ( resid 4 and name CB ) 5.0 2.5 2.5 !        
assign ( resid 2 and name CB ) 
       (( resid 3 and name CA )OR ( resid 30 and name CA ))5.0 2.5 2.5 !         
assign ( resid 20 and name CA ) 
       (( resid 24 and name CD )OR ( resid 25 and name CB ))5.0 2.5 2.5 !          
assign ( resid 21 and name CA ) 
       (( resid 24 and name CD )OR ( resid 25 and name CB ))5.0 2.5 2.5 !        
assign ( resid 17 and name CA ) 
       (( resid 15 and name CB )OR ( resid 28 and name CB ))5.0 2.5 2.5 !          
assign ( resid 2 and name CB ) 
       ( resid 4 and name CB ) 5.0 2.5 2.5 !
assign ( resid 4 and name CA ) 
       (( resid 3 and name CA )OR ( resid 30 and name CA ))5.0 2.5 2.5 !         
assign ( resid 5 and name CA ) 
       (( resid 10 and name CB )OR ( resid 21 and name CB ))5.0 2.5 2.5 !         
assign ( resid 4 and name CB ) 
       (( resid 10 and name CB )OR ( resid 21 and name CB ) OR ( resid 21 and name CB ))5.0 2.5 2.5 !                  
assign ( resid 23 and name CA ) 
       ( resid 21 and name CB ) 5.0 2.5 2.5 ! 
assign ( resid 19 and name CB ) 
       ( resid 21 and name CB ) 5.0 2.5 2.5 !
assign ( resid 4 and name CA ) 
       ( resid 19 and name CA ) 5.0 2.5 2.5 ! 
assign ( resid 5 and name CB ) 
       (( resid 19 and name CB )OR ( resid 4 and name CB ))5.0 2.5 2.5 !        
assign ( resid 5 and name CB ) 
       ( resid 18 and name CB ) 5.0 2.5 2.5 !
assign ( resid 9 and name CB ) 
       (( resid 4 and name CB )OR ( resid 12 and name CA ))5.0 2.5 2.5 !  
assign ( resid 19 and name CB ) 
       ( resid 21 and name CB ) 5.0 2.5 2.5 !        
assign ( resid 19 and name CA ) 
       ( resid 26 and name CB ) 5.0 2.5 2.5 !          
assign ( resid 18 and name CB ) 
       (( resid 5 and name CG )OR ( resid 15 and name CG ))5.0 2.5 2.5 !    
assign ( resid 4 and name CB ) 
       ( resid 19 and name CB ) 5.0 2.5 2.5 ! 
assign ( resid 3 and name CB ) 
       ( resid 29 and name CB ) 5.0 2.5 2.5 !
assign ( resid 27 and name CA ) 
       (( resid 5 and name CD )OR ( resid 15 and name CD ))5.0 2.5 2.5 !   
assign ( resid 20 and name CD1 ) 
       ( resid 25 and name CA ) 5.0 2.5 2.5 ! 
assign ( resid 20 and name CD1 ) 
       ( resid 25 and name CG ) 5.0 2.5 2.5 !       
assign ( resid 21 and name CB ) 
       (( resid 24 and name CD )OR ( resid 25 and name CB ))5.0 2.5 2.5 !         
assign ( resid 27 and name CB ) 
       (( resid 5 and name CD )OR ( resid 15 and name CD ))5.0 2.5 2.5 !          
assign ( resid 1 and name CB ) 
       (( resid 3 and name CB )OR ( resid 29 and name CB ))5.0 2.5 2.5 !             
assign ( resid 21 and name CA ) 
       ( resid 24 and name CA ) 5.0 2.5 2.5 !
assign ( resid 3 and name CB ) 
       ( resid 29 and name CA ) 5.0 2.5 2.5 ! 
assign ( resid 5 and name CB ) 
       (( resid 3 and name CB )OR ( resid 29 and name CB ))5.0 2.5 2.5 !        
assign ( resid 9 and name CA ) 
       ( resid 29 and name CA ) 5.0 2.5 2.5 !
assign ( resid 4 and name CB ) 
       ( resid 29 and name CB ) 5.0 2.5 2.5 !    
assign ( resid 3 and name CB ) 
       ( resid 29 and name CA ) 5.0 2.5 2.5 !      
assign ( resid 15 and name CD ) 
       ( resid 27 and name CA ) 5.0 2.5 2.5 !    
assign ( resid 3 and name CB ) 
       ( resid 29 and name CB ) 5.0 2.5 2.5 !   
assign ( resid 29 and name CA ) 
       (( resid 5 and name CG )OR ( resid 15 and name CG ))5.0 2.5 2.5 !    
assign ( resid 21 and name CB ) 
       (( resid 25 and name CB )OR ( resid 24 and name CD ))5.0 2.5 2.5 !    
assign ( resid 10 and name CA ) 
       ( resid 7 and name CA ) 5.0 2.5 2.5 !   
assign ( resid 21 and name CA ) 
       (( resid 22 and name CA )OR ( resid 25 and name CA ))5.0 2.5 2.5 !  
assign ( resid 20 and name CG2 ) 
       ( resid 25 and name CB ) 5.0 2.5 2.5 !  
assign ( resid 5 and name CB ) 
       ( resid 27 and name CA ) 5.0 2.5 2.5 !         
assign ( resid 5 and name CB ) 
       (( resid 4 and name CB )OR ( resid 19 and name CB ))5.0 2.5 2.5 !        
assign ( resid 9 and name CA ) 
       (( resid 5 and name CA ) OR ( resid 15 and name CA ) OR ( resid 30 and name CA ) OR ( resid 22 and name CA ))5.0 2.5 2.5 !              
assign ( resid 13 and name CG ) 
       ( resid 30 and name CA ) 5.0 2.5 2.5 !  
assign ( resid 13 and name CB ) 
       ( resid 30 and name CA ) 5.0 2.5 2.5 !                
assign ( resid 26 and name CA ) 
       ( resid 5 and name CB ) 5.0 2.5 2.5 !      
assign ( resid 26 and name CB ) 
       ( resid 28 and name CB ) 5.0 2.5 2.5 !        
assign ( resid 26 and name CB ) 
       (( resid 5 and name CG )OR ( resid 15 and name CG ))5.0 2.5 2.5 !       
assign ( resid 15 and name CA ) 
       ( resid 26 and name CB ) 5.0 2.5 2.5 !  
assign ( resid 26 and name CB ) 
       ( resid 5 and name CB ) 5.0 2.5 2.5 !                    
assign ( resid 5 and name CG ) 
       ( resid 27 and name CA ) 5.0 2.5 2.5 !     
assign ( resid 27 and name CA ) 
       (( resid 5 and name CG )OR ( resid 15 and name CG ))5.0 2.5 2.5 !          
assign ( resid 5 and name CB ) 
       ( resid 27 and name CB ) 5.0 2.5 2.5 !        
assign ( resid 21 and name CB ) 
       (( resid 24 and name CG )OR ( resid 25 and name CB ))5.0 2.5 2.5 !          
assign ( resid 25 and name CB ) 
       ( resid 27 and name CB ) 5.0 2.5 2.5 !    
assign ( resid 25 and name CB ) 
       (( resid 16 and name CA )OR ( resid 6 and name CA ))5.0 2.5 2.5 !         
assign ( resid 20 and name CG1 ) 
       ( resid 25 and name CB ) 5.0 2.5 2.5 !    
assign ( resid 5 and name CB ) 
       ( resid 7 and name CB ) 5.0 2.5 2.5 !         
assign ( resid 5 and name CA ) 
       ( resid 7 and name CG ) 5.0 2.5 2.5 !           
assign ( resid 6 and name CA ) 
       ( resid 8 and name CB ) 5.0 2.5 2.5 !         
assign ( resid 6 and name CB ) 
       ( resid 8 and name CB ) 5.0 2.5 2.5 !           
assign ( resid 9 and name CB ) 
       (( resid 30 and name CA )OR ( resid 5 and name CA ))5.0 2.5 2.5 !    
assign ( resid 1 and name CA ) 
       ( resid 30 and name CA ) 5.0 2.5 2.5 !       
assign ( resid 8 and name CB ) 
       (( resid 6 and name CG2 )OR ( resid 10 and name CG2 ) OR ( resid 11 and name CB ))5.0 2.5 2.5 !     
assign ( resid 15 and name CD ) 
       ( resid 27 and name CB ) 5.0 2.5 2.5 ! 
assign ( resid 27 and name CB ) 
       (( resid 29 and name CB )OR ( resid 16 and name CB ))5.0 2.5 2.5 !            
assign ( resid 26 and name CD2 ) 
       ( resid 28 and name CB ) 5.0 2.5 2.5 ! 
assign ( resid 9 and name CB ) 
       ( resid 11 and name CB ) 5.0 2.5 2.5 !
assign ( resid 15 and name CG ) 
       ( resid 27 and name CB ) 5.0 2.5 2.5 ! 
assign ( resid 20 and name CG2 ) 
       ( resid 25 and name CD2 ) 5.0 2.5 2.5 !          
assign ( resid 27 and name CB ) 
       (( resid 7 and name CB )OR ( resid 14 and name CB ))5.0 2.5 2.5 !       
assign ( resid 8 and name CB ) 
       (( resid 6 and name CG2 )OR ( resid 10 and name CG2 ))5.0 2.5 2.5 !       
assign ( resid 10 and name CD1 ) 
       ( resid 5 and name CA ) 5.0 2.5 2.5 !        
assign ( resid 10 and name CG1 ) 
       (( resid 6 and name CB )OR ( resid 5 and name CD ))5.0 2.5 2.5 !      
assign ( resid 8 and name CB ) 
       (( resid 9 and name CB )OR ( resid 5 and name CB ))5.0 2.5 2.5 !      
assign ( resid 10 and name CD1 ) 
       ( resid 7 and name CD ) 5.0 2.5 2.5 !
assign ( resid 20 and name CD1 ) 
       ( resid 18 and name CG2 ) 5.0 2.5 2.5 !       
assign ( resid 6 and name CD1 ) 
       ( resid 26 and name CA ) 5.0 2.5 2.5 !       
assign ( resid 6 and name CD1 ) 
       ( resid 8 and name CA ) 5.0 2.5 2.5 !        
assign ( resid 6 and name CD1 ) 
       (( resid 4 and name CA )OR ( resid 26 and name CA ))5.0 2.5 2.5 !             
assign ( resid 20 and name CB ) 
       (( resid 24 and name CG )OR ( resid 25 and name CG ))5.0 2.5 2.5 !             
assign ( resid 20 and name CB ) 
       (( resid 24 and name CA )OR ( resid 25 and name CA ))5.0 2.5 2.5 !             
assign ( resid 6 and name CG1 ) 
       (( resid 11 and name CA )OR ( resid 25 and name CA ) OR ( resid 26 and name CA ))5.0 2.5 2.5 !


#HNP1_dih_080809.tbl
!!
!! Phi restraints: minimum deviation = 30 degrees

  !!    2
 assign (resid   1 and name c )   (resid   2 and name n ) 
        (resid   2 and name ca)   (resid   2 and name c )  1.0 -131.0 30 2
  !!    3 
 assign (resid   2 and name c )   (resid   3 and name n ) 
        (resid   3 and name ca)   (resid   3 and name c )  1.0 -123.2 30 2
  !!    4 
 assign (resid   3 and name c )   (resid   4 and name n ) 
        (resid   4 and name ca)   (resid   4 and name c )  1.0 -119.7 30 2
  !!    5 
 assign (resid   4 and name c )   (resid   5 and name n ) 
        (resid   5 and name ca)   (resid   5 and name c )  1.0 -131.9 30 2
  !!    6 
 assign (resid   5 and name c )   (resid   6 and name n ) 
        (resid   6 and name ca)   (resid   6 and name c )  1.0 -135.0 30 2
  !!    7 
 assign (resid   6 and name c )   (resid   7 and name n ) 
        (resid   7 and name ca)   (resid   7 and name c )  1.0 -135.0 83.9 2
  !!    8 
 assign (resid   7 and name c )   (resid   8 and name n ) 
        (resid   8 and name ca)   (resid   8 and name c )  1.0 -141.1 30 2
  !!    9
 assign (resid   8 and name c )   (resid   9 and name n ) 
        (resid   9 and name ca)   (resid   9 and name c )  1.0 -127.1 72.6 2
  !!    10 
 assign (resid   9 and name c )   (resid   10 and name n ) 
        (resid  10 and name ca)   (resid   10 and name c )  1.0 -120.4 50 2
  !!    11 
 assign (resid  10 and name c )   (resid   11 and name n ) 
        (resid  11 and name ca)   (resid   11 and name c )  1.0 -71.8 30 2
  !!    12 
 assign (resid  11 and name c )   (resid   12 and name n ) 
        (resid  12 and name ca)   (resid   12 and name c )  1.0 83.2 30 2
  !!    13 
 assign (resid  12 and name c )   (resid   13 and name n ) 
        (resid  13 and name ca)   (resid   13 and name c )  1.0 -132.1 30 2
  !!    14
 assign (resid   13 and name c )   (resid   14 and name n ) 
        (resid   14 and name ca)   (resid   14 and name c )  1.0 -134.0 30 2
  !!    15
 assign (resid   14 and name c )   (resid   15 and name n ) 
        (resid   15 and name ca)   (resid   15 and name c )  1.0 -99.0 30 2
  !!    16
 assign (resid   15 and name c )   (resid   16 and name n ) 
        (resid   16 and name ca)   (resid   16 and name c )  1.0 -116.2 30 2
  !!    17 
 assign (resid   16 and name c )   (resid   17 and name n ) 
        (resid   17 and name ca)   (resid   17 and name c )  1.0 -120.6 85.2 2
  !!    18
 assign (resid   17 and name c )   (resid   18 and name n ) 
        (resid   18 and name ca)   (resid   18 and name c )  1.0 -109.5 30 2
  !!    19 
 assign (resid   18 and name c )   (resid   19 and name n ) 
        (resid   19 and name ca)   (resid   19 and name c )  1.0 -131.6 30 2
  !!    20 
 assign (resid   19 and name c )   (resid   20 and name n ) 
        (resid   20 and name ca)   (resid   20 and name c )  1.0 -98.8 30 2
  !!    21 
 assign (resid   20 and name c )   (resid   21 and name n ) 
        (resid   21 and name ca)   (resid   21 and name c )  1.0 -109.4 77.3 2
  !!    22
 assign (resid   21 and name c )   (resid   22 and name n ) 
        (resid   22 and name ca)   (resid   22 and name c )  1.0 50.8 30 2
  !!    23
 assign (resid   22 and name c )   (resid   23 and name n ) 
        (resid   23 and name ca)   (resid   23 and name c )  1.0 79.3 30 2
  !!    24 
 assign (resid   23 and name c )   (resid   24 and name n ) 
        (resid   24 and name ca)   (resid   24 and name c )  1.0 -123.2 30 2
  !!    25 
 assign (resid   24 and name c )   (resid   25 and name n ) 
        (resid   25 and name ca)   (resid   25 and name c )  1.0 -107.6 30 2
  !!    26 
 assign (resid   25 and name c )   (resid   26 and name n ) 
        (resid   26 and name ca)   (resid   26 and name c )  1.0 -106.0 30 2
  !!    27 
 assign (resid   26 and name c )   (resid   27 and name n ) 
        (resid   27 and name ca)   (resid   27 and name c )  1.0 -89.8 30 2
  !!    28 
 assign (resid   27 and name c )   (resid   28 and name n ) 
        (resid   28 and name ca)   (resid   28 and name c )  1.0 -111.7 30 2
  !!    29
 assign (resid   28 and name c )   (resid   29 and name n ) 
        (resid   29 and name ca)   (resid   29 and name c )  1.0 -126.1 30 2
  

!!psi restraints
!!2
assign  (resid 2 and name n)   (resid 2 and name ca)
        (resid 2 and name c)   (resid 3 and name n)    1.0 154.9 30 2
!!3
assign  (resid 3 and name n)   (resid 3 and name ca)
        (resid 3 and name c)   (resid 4 and name n)    1.0 129.8 58.7 2
!!4
assign  (resid 4 and name n)   (resid 4 and name ca)
        (resid 4 and name c)   (resid 5 and name n)    1.0 142.7 30 2
!!5
assign  (resid 5 and name n)   (resid 5 and name ca)
        (resid 5 and name c)   (resid 6 and name n)    1.0 141.6 30 2
!!6
assign  (resid 6 and name n)   (resid 6 and name ca)
        (resid 6 and name c)   (resid 7 and name n)    1.0 147.7 30 2
!!7
assign  (resid 7 and name n)   (resid 7 and name ca)
        (resid 7 and name c)   (resid 8 and name n)    1.0 144.4 180.0 2
!!8
assign  (resid 8 and name n)   (resid 8 and name ca)
        (resid 8 and name c)   (resid 9 and name n)    1.0 151.6 40.9 2
!!9
!assign  (resid 9 and name n)   (resid 9 and name ca)
!        (resid 9 and name c)   (resid 10 and name n)    1.0 150.2 30 2
!!10
!assign  (resid 10 and name n)   (resid 10 and name ca)
!        (resid 10 and name c)   (resid 11 and name n)    1.0 158.9 40 2
!!11
!assign  (resid 11 and name n)   (resid 11 and name ca)
!        (resid 11 and name c)   (resid 12 and name n)    1.0 147.0 30 2
!!12
!assign  (resid 12 and name n)   (resid 12 and name ca)
!        (resid 12 and name c)   (resid 13 and name n)    1.0 22.6 30 2
!!13
assign  (resid 13 and name n)   (resid 13 and name ca)
        (resid 13 and name c)   (resid 14 and name n)    1.0 152.3 30 2
!!14
assign  (resid 14 and name n)   (resid 14 and name ca)
        (resid 14 and name c)   (resid 15 and name n)    1.0 147.2 30 2
!!15
assign  (resid 15 and name n)   (resid 15 and name ca)
        (resid 15 and name c)   (resid 16 and name n)    1.0 124.2 30 2
!!16
assign  (resid 16 and name n)   (resid 16 and name ca)
        (resid 16 and name c)   (resid 17 and name n)    1.0 143.2 180.0 2
!!17
assign  (resid 17 and name n)   (resid 17 and name ca)
        (resid 17 and name c)   (resid 18 and name n)    1.0 134.9 180.0 2
!!18
assign  (resid 18 and name n)   (resid 18 and name ca)
        (resid 18 and name c)   (resid 19 and name n)    1.0 133.8 30 2
!!19
assign  (resid 19 and name n)   (resid 19 and name ca)
        (resid 19 and name c)   (resid 20 and name n)    1.0 149.1 30 2
!!20
assign  (resid 20 and name n)   (resid 20 and name ca)
        (resid 20 and name c)   (resid 21 and name n)    1.0 127.5 30 2
!!21
assign  (resid 21 and name n)   (resid 21 and name ca)
        (resid 21 and name c)   (resid 22 and name n)    1.0 116.6 30 2
!!22
assign  (resid 22 and name n)   (resid 22 and name ca)
        (resid 22 and name c)   (resid 23 and name n)    1.0 43.0 30 2
!!23
assign  (resid 23 and name n)   (resid 23 and name ca)
        (resid 23 and name c)   (resid 24 and name n)    1.0 3.3 30 2
!!24
assign  (resid 24 and name n)   (resid 24 and name ca)
        (resid 24 and name c)   (resid 25 and name n)    1.0 151.4 30 2
!!25
assign  (resid 25 and name n)   (resid 25 and name ca)
        (resid 25 and name c)   (resid 26 and name n)    1.0 131.4 30 2
!!26
assign  (resid 26 and name n)   (resid 26 and name ca)
        (resid 26 and name c)   (resid 27 and name n)    1.0 139.2 30 2
!!27
assign  (resid 27 and name n)   (resid 27 and name ca)
        (resid 27 and name c)   (resid 28 and name n)    1.0 125.9 30 2
!!28
assign  (resid 28 and name n)   (resid 28 and name ca)
        (resid 28 and name c)   (resid 29 and name n)    1.0 134.7 30 2
!!29
assign  (resid 29 and name n)   (resid 29 and name ca)
        (resid 29 and name c)   (resid 30 and name n)    1.0 154.4 30 2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ALA   1           HT1      ALA   1  -1.436  -0.051   0.828
    2    H2   ALA   1           HT2      ALA   1  -0.568  -0.712   2.131
    3    H3   ALA   1           HT3      ALA   1  -2.162  -0.169   2.358
    4    HA   ALA   1           HA       ALA   1  -1.819  -2.661   2.164
    5    HB1  ALA   1           HB1      ALA   1  -3.880  -2.860   0.733
    6    HB2  ALA   1           HB2      ALA   1  -3.737  -1.140   0.374
    7    HB3  ALA   1           HB3      ALA   1  -4.032  -1.674   2.029
    8    H    CYS   2           HN       CYS   2  -1.296  -4.362   0.798
    9    HA   CYS   2           HA       CYS   2   0.119  -3.641  -1.691
   10    HB2  CYS   2           HB2      CYS   2   0.332  -5.895   0.268
   11    HB3  CYS   2           HB1      CYS   2   0.863  -6.158  -1.395
   12    HG   CYS   2           HG       CYS   2   2.146  -4.135   0.595
   13    H    TYR   3           HN       TYR   3  -0.407  -4.466  -3.612
   14    HA   TYR   3           HA       TYR   3  -3.034  -5.738  -3.844
   15    HB2  TYR   3           HB2      TYR   3  -1.181  -4.598  -5.955
   16    HB3  TYR   3           HB1      TYR   3  -2.796  -5.243  -6.249
   17    HD1  TYR   3           HD1      TYR   3  -0.870  -2.518  -4.673
   18    HD2  TYR   3           HD2      TYR   3  -4.787  -4.025  -5.583
   19    HE1  TYR   3           HE1      TYR   3  -1.853  -0.321  -4.077
   20    HE2  TYR   3           HE2      TYR   3  -5.771  -1.827  -4.988
   21    HH   TYR   3           HH       TYR   3  -4.185   0.917  -4.852
   22    H    CYS   4           HN       CYS   4  -2.769  -7.083  -6.163
   23    HA   CYS   4           HA       CYS   4  -1.352  -9.441  -5.275
   24    HB2  CYS   4           HB2      CYS   4  -3.713  -9.178  -6.486
   25    HB3  CYS   4           HB1      CYS   4  -2.704  -9.409  -7.916
   26    HG   CYS   4           HG       CYS   4  -1.864 -11.691  -6.844
   27    H    ARG   5           HN       ARG   5  -0.430 -10.703  -7.495
   28    HA   ARG   5           HA       ARG   5   1.856  -9.022  -8.290
   29    HB2  ARG   5           HB2      ARG   5   2.198 -11.365  -7.456
   30    HB3  ARG   5           HB1      ARG   5   1.313 -11.936  -8.867
   31    HG2  ARG   5           HG2      ARG   5   2.953 -10.973 -10.360
   32    HG3  ARG   5           HG1      ARG   5   3.828 -10.270  -9.001
   33    HD2  ARG   5           HD2      ARG   5   4.092 -12.594  -8.072
   34    HD3  ARG   5           HD1      ARG   5   3.401 -13.208  -9.572
   35    HE   ARG   5           HE       ARG   5   5.608 -11.434 -10.040
   36   HH11  ARG   5          1HH2      ARG   5   4.713 -14.674  -9.182
   37   HH12  ARG   5          2HH2      ARG   5   6.172 -15.377  -9.796
   38   HH21  ARG   5          1HH1      ARG   5   7.513 -12.358 -10.838
   39   HH22  ARG   5          2HH1      ARG   5   7.755 -14.070 -10.731
   40    H    ILE   6           HN       ILE   6   1.544  -7.862 -10.021
   41    HA   ILE   6           HA       ILE   6   0.449  -9.165 -12.400
   42    HB   ILE   6           HB       ILE   6  -0.556  -6.847 -12.938
   43   HG12  ILE   6          2HG1      ILE   6   0.670  -5.958 -10.727
   44   HG13  ILE   6          1HG1      ILE   6  -0.874  -5.288 -11.242
   45   HG21  ILE   6          1HG2      ILE   6  -1.649  -8.813 -10.925
   46   HG22  ILE   6          2HG2      ILE   6  -2.029  -8.665 -12.638
   47   HG23  ILE   6          3HG2      ILE   6  -2.618  -7.451 -11.506
   48   HD11  ILE   6          3HD1      ILE   6  -2.077  -6.478  -9.619
   49   HD12  ILE   6          1HD1      ILE   6  -0.609  -5.993  -8.761
   50   HD13  ILE   6          2HD1      ILE   6  -0.779  -7.633  -9.373
   51    HA   PRO   7           HA       PRO   7   4.267  -7.803 -14.262
   52    HB2  PRO   7           HB2      PRO   7   2.463  -6.995 -16.511
   53    HB3  PRO   7           HB1      PRO   7   3.934  -7.978 -16.552
   54    HG2  PRO   7           HG2      PRO   7   1.464  -9.021 -16.741
   55    HG3  PRO   7           HG1      PRO   7   2.816  -9.893 -15.996
   56    HD2  PRO   7           HD2      PRO   7   0.435  -8.701 -14.710
   57    HD3  PRO   7           HD1      PRO   7   1.561  -9.939 -14.102
   58    H    ALA   8           HN       ALA   8   4.029  -6.000 -12.578
   59    HA   ALA   8           HA       ALA   8   4.036  -3.396 -13.930
   60    HB1  ALA   8           HB1      ALA   8   2.620  -3.763 -11.296
   61    HB2  ALA   8           HB2      ALA   8   1.776  -3.860 -12.841
   62    HB3  ALA   8           HB3      ALA   8   2.591  -2.367 -12.375
   63    H    CYS   9           HN       CYS   9   4.375  -1.854 -11.654
   64    HA   CYS   9           HA       CYS   9   7.131  -2.051 -11.209
   65    HB2  CYS   9           HB2      CYS   9   6.781  -0.375  -9.463
   66    HB3  CYS   9           HB1      CYS   9   5.805   0.012 -10.880
   67    HG   CYS   9           HG       CYS   9   3.737  -0.318  -9.541
   68    H    ILE  10           HN       ILE  10   7.038  -4.470 -10.738
   69    HA   ILE  10           HA       ILE  10   6.187  -5.278  -8.107
   70    HB   ILE  10           HB       ILE  10   7.820  -6.671 -10.242
   71   HG12  ILE  10          2HG1      ILE  10   5.022  -7.277  -9.261
   72   HG13  ILE  10          1HG1      ILE  10   5.321  -6.156 -10.583
   73   HG21  ILE  10          1HG2      ILE  10   7.269  -8.723  -8.828
   74   HG22  ILE  10          2HG2      ILE  10   6.829  -7.603  -7.538
   75   HG23  ILE  10          3HG2      ILE  10   8.482  -7.638  -8.148
   76   HD11  ILE  10          3HD1      ILE  10   6.378  -7.866 -11.904
   77   HD12  ILE  10          1HD1      ILE  10   4.859  -8.535 -11.307
   78   HD13  ILE  10          2HD1      ILE  10   6.383  -8.986 -10.542
   79    H    ALA  11           HN       ALA  11   9.012  -3.908  -9.504
   80    HA   ALA  11           HA       ALA  11  11.049  -4.860  -7.875
   81    HB1  ALA  11           HB1      ALA  11  12.269  -2.878  -8.446
   82    HB2  ALA  11           HB2      ALA  11  10.783  -1.988  -8.779
   83    HB3  ALA  11           HB3      ALA  11  11.285  -3.299  -9.848
   84    H    GLY  12           HN       GLY  12  12.125  -2.705  -6.512
   85    HA2  GLY  12           HA2      GLY  12  12.010  -1.496  -4.546
   86    HA3  GLY  12           HA1      GLY  12  10.254  -1.591  -4.640
   87    H    GLU  13           HN       GLU  13   9.523  -4.064  -4.412
   88    HA   GLU  13           HA       GLU  13  11.032  -5.409  -2.273
   89    HB2  GLU  13           HB2      GLU  13   8.158  -4.491  -2.057
   90    HB3  GLU  13           HB1      GLU  13   8.902  -5.660  -0.969
   91    HG2  GLU  13           HG2      GLU  13   9.184  -3.645   0.190
   92    HG3  GLU  13           HG1      GLU  13  10.730  -3.825  -0.628
   93    H    ARG  14           HN       ARG  14  10.574  -7.599  -2.067
   94    HA   ARG  14           HA       ARG  14   8.841  -8.777  -4.163
   95    HB2  ARG  14           HB2      ARG  14  11.531  -9.805  -3.228
   96    HB3  ARG  14           HB1      ARG  14  10.506 -10.544  -4.456
   97    HG2  ARG  14           HG2      ARG  14  11.480  -7.694  -4.720
   98    HG3  ARG  14           HG1      ARG  14  12.451  -9.051  -5.278
   99    HD2  ARG  14           HD2      ARG  14  10.474  -9.792  -6.659
  100    HD3  ARG  14           HD1      ARG  14   9.674  -8.288  -6.219
  101    HE   ARG  14           HE       ARG  14  12.046  -7.428  -7.222
  102   HH11  ARG  14          1HH2      ARG  14   9.621  -9.647  -8.296
  103   HH12  ARG  14          2HH2      ARG  14   9.882  -9.338  -9.981
  104   HH21  ARG  14          1HH1      ARG  14  12.400  -7.017  -9.427
  105   HH22  ARG  14          2HH1      ARG  14  11.459  -7.847 -10.620
  106    H    ARG  15           HN       ARG  15   7.239  -9.808  -3.243
  107    HA   ARG  15           HA       ARG  15   7.345 -10.655  -0.490
  108    HB2  ARG  15           HB2      ARG  15   5.269  -9.782  -1.744
  109    HB3  ARG  15           HB1      ARG  15   5.195 -11.372  -2.483
  110    HG2  ARG  15           HG2      ARG  15   3.839 -11.706  -0.626
  111    HG3  ARG  15           HG1      ARG  15   5.395 -12.213   0.023
  112    HD2  ARG  15           HD2      ARG  15   5.705  -9.871   0.902
  113    HD3  ARG  15           HD1      ARG  15   4.067  -9.511   0.377
  114    HE   ARG  15           HE       ARG  15   3.778 -11.736   1.938
  115   HH11  ARG  15          1HH2      ARG  15   5.275  -8.637   2.288
  116   HH12  ARG  15          2HH2      ARG  15   5.004  -8.545   3.996
  117   HH21  ARG  15          1HH1      ARG  15   3.422 -11.626   4.173
  118   HH22  ARG  15          2HH1      ARG  15   3.953 -10.240   5.065
  119    H    TYR  16           HN       TYR  16   7.592 -12.694   0.294
  120    HA   TYR  16           HA       TYR  16   8.633 -14.716  -1.524
  121    HB2  TYR  16           HB2      TYR  16   8.262 -14.708   1.482
  122    HB3  TYR  16           HB1      TYR  16   9.053 -15.991   0.566
  123    HD1  TYR  16           HD2      TYR  16   9.284 -12.473   1.664
  124    HD2  TYR  16           HD1      TYR  16  11.249 -15.673  -0.422
  125    HE1  TYR  16           HE2      TYR  16  11.408 -11.193   1.702
  126    HE2  TYR  16           HE1      TYR  16  13.373 -14.392  -0.384
  127    HH   TYR  16           HH       TYR  16  14.308 -12.397   0.048
  128    H    GLY  17           HN       GLY  17   5.843 -14.268   0.615
  129    HA2  GLY  17           HA2      GLY  17   4.735 -16.864   0.162
  130    HA3  GLY  17           HA1      GLY  17   3.892 -15.480   0.857
  131    H    THR  18           HN       THR  18   2.819 -17.357  -1.059
  132    HA   THR  18           HA       THR  18   2.275 -15.510  -3.314
  133    HB   THR  18           HB       THR  18   2.062 -17.451  -4.780
  134    HG1  THR  18           HG1      THR  18   1.826 -19.315  -3.885
  135   HG21  THR  18          3HG2      THR  18   4.677 -17.525  -3.259
  136   HG22  THR  18          1HG2      THR  18   4.263 -16.300  -4.459
  137   HG23  THR  18          2HG2      THR  18   4.415 -17.990  -4.941
  138    H    CYS  19           HN       CYS  19   0.149 -15.313  -3.941
  139    HA   CYS  19           HA       CYS  19  -1.856 -16.545  -2.156
  140    HB2  CYS  19           HB2      CYS  19  -3.266 -14.702  -2.590
  141    HB3  CYS  19           HB1      CYS  19  -1.659 -13.998  -2.419
  142    HG   CYS  19           HG       CYS  19  -3.334 -13.980  -4.968
  143    H    ILE  20           HN       ILE  20  -2.977 -18.222  -2.920
  144    HA   ILE  20           HA       ILE  20  -2.979 -18.712  -5.806
  145    HB   ILE  20           HB       ILE  20  -4.322 -20.453  -3.754
  146   HG12  ILE  20          2HG1      ILE  20  -2.138 -19.983  -2.800
  147   HG13  ILE  20          1HG1      ILE  20  -2.117 -21.604  -3.488
  148   HG21  ILE  20          1HG2      ILE  20  -4.548 -20.956  -6.171
  149   HG22  ILE  20          2HG2      ILE  20  -3.645 -22.209  -5.321
  150   HG23  ILE  20          3HG2      ILE  20  -2.791 -21.022  -6.308
  151   HD11  ILE  20          3HD1      ILE  20  -0.938 -19.082  -4.675
  152   HD12  ILE  20          1HD1      ILE  20  -1.127 -20.573  -5.597
  153   HD13  ILE  20          2HD1      ILE  20  -0.081 -20.541  -4.180
  154    H    TYR  21           HN       TYR  21  -4.415 -17.279  -6.701
  155    HA   TYR  21           HA       TYR  21  -7.248 -17.792  -6.167
  156    HB2  TYR  21           HB2      TYR  21  -6.776 -15.881  -4.730
  157    HB3  TYR  21           HB1      TYR  21  -6.009 -15.027  -6.069
  158    HD1  TYR  21           HD2      TYR  21  -9.239 -16.538  -4.958
  159    HD2  TYR  21           HD1      TYR  21  -7.297 -13.756  -7.594
  160    HE1  TYR  21           HE2      TYR  21 -11.451 -15.670  -5.673
  161    HE2  TYR  21           HE1      TYR  21  -9.507 -12.889  -8.307
  162    HH   TYR  21           HH       TYR  21 -12.103 -14.200  -8.238
  163    H    GLN  22           HN       GLN  22  -7.777 -18.539  -8.112
  164    HA   GLN  22           HA       GLN  22  -8.220 -18.579 -10.361
  165    HB2  GLN  22           HB2      GLN  22  -8.904 -16.130  -9.722
  166    HB3  GLN  22           HB1      GLN  22  -7.428 -15.677 -10.571
  167    HG2  GLN  22           HG2      GLN  22  -9.209 -15.596 -12.185
  168    HG3  GLN  22           HG1      GLN  22  -8.274 -17.047 -12.540
  169   HE21  GLN  22          1HE2      GLN  22  -9.901 -18.458 -13.312
  170   HE22  GLN  22          2HE2      GLN  22 -11.279 -18.882 -12.417
  171    H    GLY  23           HN       GLY  23  -5.358 -18.594  -9.100
  172    HA2  GLY  23           HA2      GLY  23  -3.361 -19.348 -10.047
  173    HA3  GLY  23           HA1      GLY  23  -4.001 -18.975 -11.644
  174    H    ARG  24           HN       ARG  24  -3.947 -16.711  -8.942
  175    HA   ARG  24           HA       ARG  24  -1.794 -15.165 -10.268
  176    HB2  ARG  24           HB2      ARG  24  -4.435 -14.143  -9.217
  177    HB3  ARG  24           HB1      ARG  24  -3.073 -13.100  -9.628
  178    HG2  ARG  24           HG2      ARG  24  -3.086 -13.996 -11.933
  179    HG3  ARG  24           HG1      ARG  24  -4.459 -15.023 -11.521
  180    HD2  ARG  24           HD2      ARG  24  -5.787 -13.009 -10.966
  181    HD3  ARG  24           HD1      ARG  24  -4.420 -11.993 -11.422
  182    HE   ARG  24           HE       ARG  24  -6.209 -13.412 -13.226
  183   HH11  ARG  24          1HH2      ARG  24  -3.160 -11.848 -12.744
  184   HH12  ARG  24          2HH2      ARG  24  -2.918 -11.499 -14.423
  185   HH21  ARG  24          1HH1      ARG  24  -5.900 -12.956 -15.429
  186   HH22  ARG  24          2HH1      ARG  24  -4.469 -12.126 -15.943
  187    H    LEU  25           HN       LEU  25  -0.181 -14.854  -8.942
  188    HA   LEU  25           HA       LEU  25  -0.481 -15.186  -6.065
  189    HB2  LEU  25           HB2      LEU  25   2.104 -14.444  -7.388
  190    HB3  LEU  25           HB1      LEU  25   1.826 -15.442  -5.961
  191    HG   LEU  25           HG       LEU  25   1.265 -16.161  -8.844
  192   HD11  LEU  25          1HD1      LEU  25   3.559 -16.473  -8.383
  193   HD12  LEU  25          2HD1      LEU  25   2.849 -18.073  -8.173
  194   HD13  LEU  25          3HD1      LEU  25   3.244 -17.093  -6.764
  195   HD21  LEU  25          3HD2      LEU  25  -0.522 -17.232  -7.810
  196   HD22  LEU  25          1HD2      LEU  25   0.318 -17.402  -6.273
  197   HD23  LEU  25          2HD2      LEU  25   0.727 -18.461  -7.620
  198    H    TRP  26           HN       TRP  26   0.701 -13.621  -4.630
  199    HA   TRP  26           HA       TRP  26   0.183 -10.849  -5.525
  200    HB2  TRP  26           HB2      TRP  26  -0.415 -10.205  -3.317
  201    HB3  TRP  26           HB1      TRP  26  -1.269 -11.719  -3.624
  202    HD1  TRP  26           HD1      TRP  26   0.794 -13.851  -3.055
  203    HE1  TRP  26           HE1      TRP  26   1.865 -14.181  -0.745
  204    HE3  TRP  26           HE3      TRP  26  -0.151  -9.298  -1.067
  205    HZ2  TRP  26           HZ2      TRP  26   2.264 -12.684   1.651
  206    HZ3  TRP  26           HZ3      TRP  26   0.574  -8.754   1.233
  207    HH2  TRP  26           HH2      TRP  26   1.778 -10.441   2.598
  208    H    ALA  27           HN       ALA  27   1.995  -9.895  -6.052
  209    HA   ALA  27           HA       ALA  27   4.426 -10.474  -4.501
  210    HB1  ALA  27           HB1      ALA  27   4.747 -10.544  -6.887
  211    HB2  ALA  27           HB2      ALA  27   5.551  -9.104  -6.270
  212    HB3  ALA  27           HB3      ALA  27   3.995  -8.962  -7.089
  213    H    PHE  28           HN       PHE  28   5.723  -8.630  -3.756
  214    HA   PHE  28           HA       PHE  28   4.034  -6.769  -2.369
  215    HB2  PHE  28           HB2      PHE  28   6.372  -7.830  -1.740
  216    HB3  PHE  28           HB1      PHE  28   7.009  -6.458  -2.618
  217    HD1  PHE  28           HD2      PHE  28   5.823  -4.119  -1.988
  218    HD2  PHE  28           HD1      PHE  28   6.025  -7.581   0.551
  219    HE1  PHE  28           HE2      PHE  28   5.447  -2.687   0.007
  220    HE2  PHE  28           HE1      PHE  28   5.650  -6.150   2.536
  221    HZ   PHE  28           HZ       PHE  28   5.354  -3.705   2.265
  222    H    CYS  29           HN       CYS  29   3.042  -5.337  -3.682
  223    HA   CYS  29           HA       CYS  29   4.715  -3.649  -5.451
  224    HB2  CYS  29           HB2      CYS  29   3.006  -5.251  -6.539
  225    HB3  CYS  29           HB1      CYS  29   1.776  -4.171  -5.880
  226    HG   CYS  29           HG       CYS  29   3.833  -3.409  -8.083
  227    H    CYS  30           HN       CYS  30   4.809  -1.594  -4.793
  228    HA   CYS  30           HA       CYS  30   2.477  -0.246  -3.703
  229    HB2  CYS  30           HB2      CYS  30   5.012  -0.395  -2.055
  230    HB3  CYS  30           HB1      CYS  30   3.516   0.439  -1.631
  231    HG   CYS  30           HG       CYS  30   3.752  -2.086  -0.588
  Start of MODEL    2
    1    H1   ALA   1           HT1      ALA   1  -2.957  -0.762  -1.647
    2    H2   ALA   1           HT2      ALA   1  -4.125   0.320  -1.054
    3    H3   ALA   1           HT3      ALA   1  -2.578   0.882  -1.475
    4    HA   ALA   1           HA       ALA   1  -4.686   1.081  -3.075
    5    HB1  ALA   1           HB1      ALA   1  -3.081   1.446  -4.869
    6    HB2  ALA   1           HB2      ALA   1  -1.854   0.525  -3.998
    7    HB3  ALA   1           HB3      ALA   1  -2.411   2.073  -3.364
    8    H    CYS   2           HN       CYS   2  -2.344  -1.605  -3.290
    9    HA   CYS   2           HA       CYS   2  -4.432  -3.404  -4.206
   10    HB2  CYS   2           HB2      CYS   2  -3.192  -4.012  -6.284
   11    HB3  CYS   2           HB1      CYS   2  -3.839  -2.373  -6.322
   12    HG   CYS   2           HG       CYS   2  -0.822  -3.060  -5.882
   13    H    TYR   3           HN       TYR   3  -3.807  -5.607  -4.108
   14    HA   TYR   3           HA       TYR   3  -1.094  -6.159  -3.087
   15    HB2  TYR   3           HB2      TYR   3  -2.220  -7.724  -1.404
   16    HB3  TYR   3           HB1      TYR   3  -2.309  -5.998  -1.059
   17    HD1  TYR   3           HD2      TYR   3  -4.396  -4.726  -1.698
   18    HD2  TYR   3           HD1      TYR   3  -4.182  -9.016  -1.790
   19    HE1  TYR   3           HE2      TYR   3  -6.870  -4.850  -1.717
   20    HE2  TYR   3           HE1      TYR   3  -6.656  -9.139  -1.816
   21    HH   TYR   3           HH       TYR   3  -8.631  -6.293  -2.232
   22    H    CYS   4           HN       CYS   4  -1.251  -6.784  -5.484
   23    HA   CYS   4           HA       CYS   4  -1.399  -9.644  -5.543
   24    HB2  CYS   4           HB2      CYS   4  -3.573  -8.115  -6.699
   25    HB3  CYS   4           HB1      CYS   4  -2.764  -9.084  -7.929
   26    HG   CYS   4           HG       CYS   4  -4.679 -10.239  -6.028
   27    H    ARG   5           HN       ARG   5  -0.762 -10.406  -7.852
   28    HA   ARG   5           HA       ARG   5   1.612  -8.811  -8.580
   29    HB2  ARG   5           HB2      ARG   5   1.866 -11.220  -7.995
   30    HB3  ARG   5           HB1      ARG   5   0.834 -11.617  -9.368
   31    HG2  ARG   5           HG2      ARG   5   2.421 -10.614 -10.902
   32    HG3  ARG   5           HG1      ARG   5   3.427 -10.092  -9.548
   33    HD2  ARG   5           HD2      ARG   5   4.321 -12.170 -10.462
   34    HD3  ARG   5           HD1      ARG   5   3.680 -12.452  -8.847
   35    HE   ARG   5           HE       ARG   5   1.935 -13.711  -9.784
   36   HH11  ARG   5          1HH2      ARG   5   3.826 -12.108 -12.193
   37   HH12  ARG   5          2HH2      ARG   5   3.223 -13.067 -13.502
   38   HH21  ARG   5          1HH1      ARG   5   1.123 -14.960 -11.493
   39   HH22  ARG   5          2HH1      ARG   5   1.692 -14.688 -13.105
   40    H    ILE   6           HN       ILE   6   1.327  -7.490 -10.153
   41    HA   ILE   6           HA       ILE   6  -0.127  -8.354 -12.545
   42    HB   ILE   6           HB       ILE   6  -0.526  -5.516 -12.226
   43   HG12  ILE   6          2HG1      ILE   6  -1.951  -5.564 -10.164
   44   HG13  ILE   6          1HG1      ILE   6  -1.350  -7.178  -9.819
   45   HG21  ILE   6          1HG2      ILE   6  -2.016  -6.924 -13.516
   46   HG22  ILE   6          2HG2      ILE   6  -2.937  -6.241 -12.178
   47   HG23  ILE   6          3HG2      ILE   6  -2.381  -7.911 -12.100
   48   HD11  ILE   6          3HD1      ILE   6   0.799  -5.204 -10.298
   49   HD12  ILE   6          1HD1      ILE   6   0.612  -6.378  -8.999
   50   HD13  ILE   6          2HD1      ILE   6  -0.216  -4.838  -8.907
   51    HA   PRO   7           HA       PRO   7   3.800  -7.170 -14.233
   52    HB2  PRO   7           HB2      PRO   7   2.185  -6.125 -16.525
   53    HB3  PRO   7           HB1      PRO   7   3.590  -7.205 -16.539
   54    HG2  PRO   7           HG2      PRO   7   1.085  -8.097 -16.943
   55    HG3  PRO   7           HG1      PRO   7   2.323  -9.074 -16.130
   56    HD2  PRO   7           HD2      PRO   7  -0.055  -7.718 -14.964
   57    HD3  PRO   7           HD1      PRO   7   0.872  -9.123 -14.368
   58    H    ALA   8           HN       ALA   8   3.963  -5.532 -12.583
   59    HA   ALA   8           HA       ALA   8   3.869  -2.809 -13.620
   60    HB1  ALA   8           HB1      ALA   8   1.663  -3.299 -12.391
   61    HB2  ALA   8           HB2      ALA   8   2.577  -1.886 -11.864
   62    HB3  ALA   8           HB3      ALA   8   2.638  -3.375 -10.922
   63    H    CYS   9           HN       CYS   9   4.473  -1.506 -11.247
   64    HA   CYS   9           HA       CYS   9   7.235  -1.857 -11.016
   65    HB2  CYS   9           HB2      CYS   9   7.061  -0.418  -9.040
   66    HB3  CYS   9           HB1      CYS   9   6.017   0.182 -10.331
   67    HG   CYS   9           HG       CYS   9   5.010  -0.510  -7.652
   68    H    ILE  10           HN       ILE  10   7.049  -4.347 -10.820
   69    HA   ILE  10           HA       ILE  10   6.314  -5.484  -8.316
   70    HB   ILE  10           HB       ILE  10   8.014  -6.491 -10.608
   71   HG12  ILE  10          2HG1      ILE  10   5.415  -6.089 -10.746
   72   HG13  ILE  10          1HG1      ILE  10   6.093  -7.583 -11.373
   73   HG21  ILE  10          1HG2      ILE  10   7.234  -7.823  -8.017
   74   HG22  ILE  10          2HG2      ILE  10   8.821  -7.750  -8.785
   75   HG23  ILE  10          3HG2      ILE  10   7.554  -8.766  -9.473
   76   HD11  ILE  10          3HD1      ILE  10   4.014  -7.754  -9.854
   77   HD12  ILE  10          1HD1      ILE  10   5.115  -7.396  -8.525
   78   HD13  ILE  10          2HD1      ILE  10   5.367  -8.830  -9.508
   79    H    ALA  11           HN       ALA  11   9.170  -3.947  -9.529
   80    HA   ALA  11           HA       ALA  11  11.000  -5.012  -7.589
   81    HB1  ALA  11           HB1      ALA  11  12.565  -3.417  -8.437
   82    HB2  ALA  11           HB2      ALA  11  11.278  -2.418  -9.115
   83    HB3  ALA  11           HB3      ALA  11  11.638  -3.993  -9.821
   84    H    GLY  12           HN       GLY  12  12.208  -3.416  -6.128
   85    HA2  GLY  12           HA2      GLY  12  12.185  -1.594  -4.615
   86    HA3  GLY  12           HA1      GLY  12  10.468  -1.366  -4.935
   87    H    GLU  13           HN       GLU  13  10.293  -4.451  -4.680
   88    HA   GLU  13           HA       GLU  13  10.812  -4.948  -1.888
   89    HB2  GLU  13           HB2      GLU  13   8.725  -3.508  -1.902
   90    HB3  GLU  13           HB1      GLU  13   7.916  -4.828  -2.747
   91    HG2  GLU  13           HG2      GLU  13   8.376  -6.347  -0.898
   92    HG3  GLU  13           HG1      GLU  13   9.318  -5.108  -0.076
   93    H    ARG  14           HN       ARG  14  10.148  -7.162  -1.261
   94    HA   ARG  14           HA       ARG  14  10.202  -8.973  -3.601
   95    HB2  ARG  14           HB2      ARG  14  10.846  -9.540  -0.698
   96    HB3  ARG  14           HB1      ARG  14  11.056 -10.654  -2.044
   97    HG2  ARG  14           HG2      ARG  14  12.401  -7.955  -2.044
   98    HG3  ARG  14           HG1      ARG  14  13.129  -9.325  -1.213
   99    HD2  ARG  14           HD2      ARG  14  13.017 -10.627  -3.342
  100    HD3  ARG  14           HD1      ARG  14  12.405  -9.198  -4.158
  101    HE   ARG  14           HE       ARG  14  15.140  -9.618  -3.201
  102   HH11  ARG  14          1HH2      ARG  14  12.733  -7.478  -4.473
  103   HH12  ARG  14          2HH2      ARG  14  13.877  -6.337  -5.091
  104   HH21  ARG  14          1HH1      ARG  14  16.646  -8.122  -4.015
  105   HH22  ARG  14          2HH1      ARG  14  16.090  -6.700  -4.833
  106    H    ARG  15           HN       ARG  15   8.960 -10.912  -3.561
  107    HA   ARG  15           HA       ARG  15   6.270 -10.501  -2.540
  108    HB2  ARG  15           HB2      ARG  15   5.774 -12.569  -3.821
  109    HB3  ARG  15           HB1      ARG  15   6.584 -11.349  -4.808
  110    HG2  ARG  15           HG2      ARG  15   8.744 -12.487  -4.417
  111    HG3  ARG  15           HG1      ARG  15   7.905 -13.730  -3.487
  112    HD2  ARG  15           HD2      ARG  15   7.273 -13.039  -6.367
  113    HD3  ARG  15           HD1      ARG  15   8.303 -14.381  -5.875
  114    HE   ARG  15           HE       ARG  15   5.428 -14.300  -5.765
  115   HH11  ARG  15          1HH2      ARG  15   8.310 -15.544  -4.318
  116   HH12  ARG  15          2HH2      ARG  15   7.548 -16.966  -3.688
  117   HH21  ARG  15          1HH1      ARG  15   4.414 -16.158  -4.937
  118   HH22  ARG  15          2HH1      ARG  15   5.340 -17.315  -4.040
  119    H    TYR  16           HN       TYR  16   5.261 -11.674  -0.950
  120    HA   TYR  16           HA       TYR  16   6.637 -13.955   0.284
  121    HB2  TYR  16           HB2      TYR  16   7.493 -12.064   1.558
  122    HB3  TYR  16           HB1      TYR  16   5.857 -11.456   1.809
  123    HD1  TYR  16           HD1      TYR  16   7.975 -14.497   2.373
  124    HD2  TYR  16           HD2      TYR  16   4.634 -12.145   3.705
  125    HE1  TYR  16           HE1      TYR  16   7.750 -15.945   4.375
  126    HE2  TYR  16           HE2      TYR  16   4.407 -13.594   5.701
  127    HH   TYR  16           HH       TYR  16   6.317 -16.525   6.071
  128    H    GLY  17           HN       GLY  17   4.200 -12.151   1.975
  129    HA2  GLY  17           HA2      GLY  17   2.432 -14.341   2.195
  130    HA3  GLY  17           HA1      GLY  17   2.019 -12.657   2.531
  131    H    THR  18           HN       THR  18   2.438 -14.984  -0.121
  132    HA   THR  18           HA       THR  18   1.109 -13.282  -2.018
  133    HB   THR  18           HB       THR  18   1.339 -15.165  -3.554
  134    HG1  THR  18           HG1      THR  18   1.082 -16.964  -2.446
  135   HG21  THR  18          3HG2      THR  18   3.391 -13.661  -2.549
  136   HG22  THR  18          1HG2      THR  18   3.604 -14.854  -3.830
  137   HG23  THR  18          2HG2      THR  18   3.958 -15.284  -2.164
  138    H    CYS  19           HN       CYS  19  -0.804 -14.054  -3.267
  139    HA   CYS  19           HA       CYS  19  -2.765 -15.444  -1.523
  140    HB2  CYS  19           HB2      CYS  19  -4.479 -13.998  -2.284
  141    HB3  CYS  19           HB1      CYS  19  -3.124 -12.939  -1.912
  142    HG   CYS  19           HG       CYS  19  -3.793 -12.170  -4.249
  143    H    ILE  20           HN       ILE  20  -3.587 -17.281  -2.338
  144    HA   ILE  20           HA       ILE  20  -2.943 -18.030  -5.088
  145    HB   ILE  20           HB       ILE  20  -4.442 -19.605  -2.973
  146   HG12  ILE  20          2HG1      ILE  20  -2.065 -20.865  -3.144
  147   HG13  ILE  20          1HG1      ILE  20  -1.512 -19.250  -3.575
  148   HG21  ILE  20          1HG2      ILE  20  -3.301 -20.268  -5.693
  149   HG22  ILE  20          2HG2      ILE  20  -4.958 -20.482  -5.125
  150   HG23  ILE  20          3HG2      ILE  20  -3.669 -21.510  -4.497
  151   HD11  ILE  20          3HD1      ILE  20  -3.110 -19.929  -1.085
  152   HD12  ILE  20          1HD1      ILE  20  -2.436 -18.351  -1.488
  153   HD13  ILE  20          2HD1      ILE  20  -1.364 -19.699  -1.126
  154    H    TYR  21           HN       TYR  21  -4.232 -16.874  -6.436
  155    HA   TYR  21           HA       TYR  21  -7.083 -17.570  -6.443
  156    HB2  TYR  21           HB2      TYR  21  -5.978 -14.763  -6.316
  157    HB3  TYR  21           HB1      TYR  21  -7.596 -15.120  -6.921
  158    HD1  TYR  21           HD1      TYR  21  -5.363 -15.403  -3.958
  159    HD2  TYR  21           HD2      TYR  21  -9.384 -15.666  -5.441
  160    HE1  TYR  21           HE1      TYR  21  -6.212 -15.523  -1.631
  161    HE2  TYR  21           HE2      TYR  21 -10.235 -15.785  -3.115
  162    HH   TYR  21           HH       TYR  21  -8.559 -16.606  -0.588
  163    H    GLN  22           HN       GLN  22  -7.977 -17.624  -8.491
  164    HA   GLN  22           HA       GLN  22  -7.927 -17.949 -10.773
  165    HB2  GLN  22           HB2      GLN  22  -6.377 -15.362 -10.517
  166    HB3  GLN  22           HB1      GLN  22  -6.949 -16.016 -12.051
  167    HG2  GLN  22           HG2      GLN  22  -8.747 -15.410  -9.687
  168    HG3  GLN  22           HG1      GLN  22  -8.502 -14.318 -11.048
  169   HE21  GLN  22          1HE2      GLN  22 -10.724 -16.455  -9.955
  170   HE22  GLN  22          2HE2      GLN  22 -11.310 -17.063 -11.426
  171    H    GLY  23           HN       GLY  23  -5.519 -18.811  -9.000
  172    HA2  GLY  23           HA2      GLY  23  -3.716 -20.198  -9.433
  173    HA3  GLY  23           HA1      GLY  23  -4.029 -20.002 -11.154
  174    H    ARG  24           HN       ARG  24  -3.656 -17.206  -9.117
  175    HA   ARG  24           HA       ARG  24  -0.918 -16.752 -10.173
  176    HB2  ARG  24           HB2      ARG  24  -3.228 -14.799 -10.011
  177    HB3  ARG  24           HB1      ARG  24  -1.561 -14.328 -10.338
  178    HG2  ARG  24           HG2      ARG  24  -1.526 -15.774 -12.325
  179    HG3  ARG  24           HG1      ARG  24  -3.180 -16.288 -11.992
  180    HD2  ARG  24           HD2      ARG  24  -3.945 -13.951 -12.222
  181    HD3  ARG  24           HD1      ARG  24  -2.295 -13.450 -12.578
  182    HE   ARG  24           HE       ARG  24  -2.975 -15.483 -14.388
  183   HH11  ARG  24          1HH2      ARG  24  -3.897 -12.263 -13.529
  184   HH12  ARG  24          2HH2      ARG  24  -4.426 -11.840 -15.123
  185   HH21  ARG  24          1HH1      ARG  24  -3.667 -14.941 -16.481
  186   HH22  ARG  24          2HH1      ARG  24  -4.296 -13.358 -16.796
  187    H    LEU  25           HN       LEU  25   0.535 -15.863  -8.791
  188    HA   LEU  25           HA       LEU  25  -0.192 -15.740  -5.956
  189    HB2  LEU  25           HB2      LEU  25   2.482 -15.528  -7.367
  190    HB3  LEU  25           HB1      LEU  25   2.274 -15.501  -5.626
  191    HG   LEU  25           HG       LEU  25   2.910 -17.746  -6.381
  192   HD11  LEU  25          1HD1      LEU  25   1.118 -17.280  -4.519
  193   HD12  LEU  25          2HD1      LEU  25   1.396 -18.925  -5.074
  194   HD13  LEU  25          3HD1      LEU  25   0.005 -18.021  -5.666
  195   HD21  LEU  25          3HD2      LEU  25   1.628 -17.308  -8.669
  196   HD22  LEU  25          1HD2      LEU  25   0.296 -18.094  -7.822
  197   HD23  LEU  25          2HD2      LEU  25   1.825 -18.941  -8.045
  198    H    TRP  26           HN       TRP  26   0.461 -13.933  -4.610
  199    HA   TRP  26           HA       TRP  26   0.214 -11.324  -5.998
  200    HB2  TRP  26           HB2      TRP  26  -1.469 -11.425  -4.364
  201    HB3  TRP  26           HB1      TRP  26  -0.492 -12.324  -3.261
  202    HD1  TRP  26           HD1      TRP  26   0.702  -9.044  -4.818
  203    HE1  TRP  26           HE1      TRP  26   1.003  -7.299  -2.932
  204    HE3  TRP  26           HE3      TRP  26  -1.213 -11.668  -0.894
  205    HZ2  TRP  26           HZ2      TRP  26   0.483  -7.062  -0.123
  206    HZ3  TRP  26           HZ3      TRP  26  -1.314 -10.664   1.370
  207    HH2  TRP  26           HH2      TRP  26  -0.469  -8.368   1.760
  208    H    ALA  27           HN       ALA  27   2.148 -10.337  -6.363
  209    HA   ALA  27           HA       ALA  27   4.383 -10.879  -4.539
  210    HB1  ALA  27           HB1      ALA  27   4.184  -9.427  -7.179
  211    HB2  ALA  27           HB2      ALA  27   5.149 -10.849  -6.788
  212    HB3  ALA  27           HB3      ALA  27   5.605  -9.272  -6.147
  213    H    PHE  28           HN       PHE  28   5.429  -9.095  -3.394
  214    HA   PHE  28           HA       PHE  28   3.435  -7.247  -2.434
  215    HB2  PHE  28           HB2      PHE  28   5.530  -8.387  -1.253
  216    HB3  PHE  28           HB1      PHE  28   6.343  -6.933  -1.804
  217    HD1  PHE  28           HD2      PHE  28   4.565  -4.749  -1.484
  218    HD2  PHE  28           HD1      PHE  28   4.890  -8.251   0.988
  219    HE1  PHE  28           HE2      PHE  28   3.634  -3.487   0.428
  220    HE2  PHE  28           HE1      PHE  28   3.960  -6.982   2.904
  221    HZ   PHE  28           HZ       PHE  28   3.336  -4.599   2.627
  222    H    CYS  29           HN       CYS  29   2.797  -5.805  -3.859
  223    HA   CYS  29           HA       CYS  29   4.767  -4.227  -5.398
  224    HB2  CYS  29           HB2      CYS  29   2.917  -5.530  -6.588
  225    HB3  CYS  29           HB1      CYS  29   1.789  -4.374  -5.878
  226    HG   CYS  29           HG       CYS  29   4.141  -3.446  -7.735
  227    H    CYS  30           HN       CYS  30   4.489  -1.939  -5.534
  228    HA   CYS  30           HA       CYS  30   3.969   0.167  -4.765
  229    HB2  CYS  30           HB2      CYS  30   1.841  -0.915  -2.938
  230    HB3  CYS  30           HB1      CYS  30   1.875   0.596  -3.847
  231    HG   CYS  30           HG       CYS  30   1.088  -2.172  -4.998
  Start of MODEL    3
    1    H1   ALA   1           HT1      ALA   1  -0.665   0.097   1.530
    2    H2   ALA   1           HT2      ALA   1  -2.292   0.071   1.043
    3    H3   ALA   1           HT3      ALA   1  -1.061  -0.250  -0.082
    4    HA   ALA   1           HA       ALA   1  -0.991  -1.986   2.209
    5    HB1  ALA   1           HB1      ALA   1  -3.375  -1.867   2.154
    6    HB2  ALA   1           HB2      ALA   1  -2.953  -3.333   1.270
    7    HB3  ALA   1           HB3      ALA   1  -3.406  -1.872   0.391
    8    H    CYS   2           HN       CYS   2  -0.900  -4.293   1.257
    9    HA   CYS   2           HA       CYS   2   0.814  -4.199  -1.146
   10    HB2  CYS   2           HB2      CYS   2   1.594  -5.236   1.057
   11    HB3  CYS   2           HB1      CYS   2   0.455  -6.538   0.722
   12    HG   CYS   2           HG       CYS   2   3.082  -6.021  -0.791
   13    H    TYR   3           HN       TYR   3   0.072  -4.890  -3.012
   14    HA   TYR   3           HA       TYR   3  -2.392  -6.525  -3.085
   15    HB2  TYR   3           HB2      TYR   3  -2.322  -4.325  -4.328
   16    HB3  TYR   3           HB1      TYR   3  -1.080  -5.030  -5.366
   17    HD1  TYR   3           HD2      TYR   3  -4.522  -5.690  -4.046
   18    HD2  TYR   3           HD1      TYR   3  -1.716  -6.315  -7.239
   19    HE1  TYR   3           HE2      TYR   3  -6.284  -6.821  -5.375
   20    HE2  TYR   3           HE1      TYR   3  -3.480  -7.448  -8.566
   21    HH   TYR   3           HH       TYR   3  -6.717  -8.017  -7.210
   22    H    CYS   4           HN       CYS   4  -2.470  -8.364  -4.431
   23    HA   CYS   4           HA       CYS   4   0.097  -9.743  -4.651
   24    HB2  CYS   4           HB2      CYS   4  -2.541 -10.930  -5.464
   25    HB3  CYS   4           HB1      CYS   4  -1.140 -11.717  -4.737
   26    HG   CYS   4           HG       CYS   4  -3.115 -11.310  -2.956
   27    H    ARG   5           HN       ARG   5   0.800 -10.749  -6.633
   28    HA   ARG   5           HA       ARG   5  -0.393  -9.641  -9.104
   29    HB2  ARG   5           HB2      ARG   5   1.833  -8.543  -8.004
   30    HB3  ARG   5           HB1      ARG   5   2.583  -9.769  -9.023
   31    HG2  ARG   5           HG2      ARG   5   2.429  -7.975 -10.513
   32    HG3  ARG   5           HG1      ARG   5   0.927  -8.826 -10.859
   33    HD2  ARG   5           HD2      ARG   5  -0.267  -7.324  -9.276
   34    HD3  ARG   5           HD1      ARG   5   1.237  -6.450  -9.002
   35    HE   ARG   5           HE       ARG   5   0.777  -6.481 -11.763
   36   HH11  ARG   5          1HH2      ARG   5  -0.660  -5.277  -8.853
   37   HH12  ARG   5          2HH2      ARG   5  -1.390  -3.905  -9.619
   38   HH21  ARG   5          1HH1      ARG   5  -0.177  -4.683 -12.772
   39   HH22  ARG   5          2HH1      ARG   5  -1.116  -3.569 -11.836
   40    H    ILE   6           HN       ILE   6   0.748 -10.543 -11.023
   41    HA   ILE   6           HA       ILE   6   0.953 -13.456 -10.747
   42    HB   ILE   6           HB       ILE   6   0.850 -13.170 -13.357
   43   HG12  ILE   6          2HG1      ILE   6  -0.579 -10.624 -12.606
   44   HG13  ILE   6          1HG1      ILE   6   1.154 -10.594 -12.940
   45   HG21  ILE   6          1HG2      ILE   6  -1.539 -12.565 -11.590
   46   HG22  ILE   6          2HG2      ILE   6  -0.956 -14.171 -12.025
   47   HG23  ILE   6          3HG2      ILE   6  -1.625 -13.111 -13.264
   48   HD11  ILE   6          3HD1      ILE   6   0.838 -11.460 -15.140
   49   HD12  ILE   6          1HD1      ILE   6  -0.326 -10.151 -14.935
   50   HD13  ILE   6          2HD1      ILE   6  -0.857 -11.828 -14.819
   51    HA   PRO   7           HA       PRO   7   5.325 -13.464 -11.335
   52    HB2  PRO   7           HB2      PRO   7   4.909 -14.772 -13.990
   53    HB3  PRO   7           HB1      PRO   7   6.031 -15.208 -12.682
   54    HG2  PRO   7           HG2      PRO   7   3.834 -16.582 -12.970
   55    HG3  PRO   7           HG1      PRO   7   4.325 -16.067 -11.344
   56    HD2  PRO   7           HD2      PRO   7   2.186 -14.938 -13.112
   57    HD3  PRO   7           HD1      PRO   7   2.177 -15.193 -11.354
   58    H    ALA   8           HN       ALA   8   5.019 -11.148 -11.577
   59    HA   ALA   8           HA       ALA   8   6.640 -10.126 -13.641
   60    HB1  ALA   8           HB1      ALA   8   4.597 -10.467 -14.979
   61    HB2  ALA   8           HB2      ALA   8   4.972  -8.756 -14.798
   62    HB3  ALA   8           HB3      ALA   8   3.688  -9.490 -13.831
   63    H    CYS   9           HN       CYS   9   7.724  -8.757 -12.282
   64    HA   CYS   9           HA       CYS   9   6.390  -7.497 -10.080
   65    HB2  CYS   9           HB2      CYS   9   9.114  -7.136 -11.320
   66    HB3  CYS   9           HB1      CYS   9   8.545  -6.119  -9.996
   67    HG   CYS   9           HG       CYS   9   8.387  -8.212  -8.474
   68    H    ILE  10           HN       ILE  10   4.653  -6.827 -11.523
   69    HA   ILE  10           HA       ILE  10   4.970  -4.802 -13.449
   70    HB   ILE  10           HB       ILE  10   2.589  -5.718 -11.819
   71   HG12  ILE  10          2HG1      ILE  10   3.150  -6.143 -14.762
   72   HG13  ILE  10          1HG1      ILE  10   3.827  -7.216 -13.545
   73   HG21  ILE  10          1HG2      ILE  10   2.010  -3.516 -12.497
   74   HG22  ILE  10          2HG2      ILE  10   1.334  -4.550 -13.757
   75   HG23  ILE  10          3HG2      ILE  10   2.844  -3.684 -14.042
   76   HD11  ILE  10          3HD1      ILE  10   1.719  -7.993 -12.867
   77   HD12  ILE  10          1HD1      ILE  10   1.544  -7.850 -14.614
   78   HD13  ILE  10          2HD1      ILE  10   0.880  -6.605 -13.557
   79    H    ALA  11           HN       ALA  11   4.170  -4.736  -9.995
   80    HA   ALA  11           HA       ALA  11   4.047  -1.825  -9.963
   81    HB1  ALA  11           HB1      ALA  11   2.594  -3.341  -8.540
   82    HB2  ALA  11           HB2      ALA  11   3.422  -2.041  -7.681
   83    HB3  ALA  11           HB3      ALA  11   4.043  -3.691  -7.595
   84    H    GLY  12           HN       GLY  12   6.216  -4.413  -8.873
   85    HA2  GLY  12           HA2      GLY  12   8.626  -3.998  -9.015
   86    HA3  GLY  12           HA1      GLY  12   8.331  -2.375  -8.410
   87    H    GLU  13           HN       GLU  13   8.198  -5.810  -7.534
   88    HA   GLU  13           HA       GLU  13   9.279  -5.269  -4.928
   89    HB2  GLU  13           HB2      GLU  13   6.375  -5.489  -5.234
   90    HB3  GLU  13           HB1      GLU  13   6.993  -6.736  -4.156
   91    HG2  GLU  13           HG2      GLU  13   7.599  -3.780  -3.879
   92    HG3  GLU  13           HG1      GLU  13   6.376  -4.646  -2.957
   93    H    ARG  14           HN       ARG  14   9.035  -7.480  -3.594
   94    HA   ARG  14           HA       ARG  14  10.005  -9.598  -5.419
   95    HB2  ARG  14           HB2      ARG  14  10.428  -9.098  -2.468
   96    HB3  ARG  14           HB1      ARG  14  10.964 -10.560  -3.299
   97    HG2  ARG  14           HG2      ARG  14  12.330  -9.206  -4.830
   98    HG3  ARG  14           HG1      ARG  14  11.774  -7.731  -4.037
   99    HD2  ARG  14           HD2      ARG  14  12.760  -8.507  -1.910
  100    HD3  ARG  14           HD1      ARG  14  13.329  -9.969  -2.709
  101    HE   ARG  14           HE       ARG  14  14.442  -7.285  -2.986
  102   HH11  ARG  14          1HH2      ARG  14  14.231 -10.534  -4.166
  103   HH12  ARG  14          2HH2      ARG  14  15.735 -10.465  -5.022
  104   HH21  ARG  14          1HH1      ARG  14  16.414  -7.192  -4.106
  105   HH22  ARG  14          2HH1      ARG  14  16.969  -8.575  -4.989
  106    H    ARG  15           HN       ARG  15   9.012 -11.532  -5.541
  107    HA   ARG  15           HA       ARG  15   6.374 -11.825  -4.431
  108    HB2  ARG  15           HB2      ARG  15   6.465 -14.059  -5.556
  109    HB3  ARG  15           HB1      ARG  15   6.806 -12.705  -6.635
  110    HG2  ARG  15           HG2      ARG  15   9.238 -13.113  -6.340
  111    HG3  ARG  15           HG1      ARG  15   8.865 -14.501  -5.318
  112    HD2  ARG  15           HD2      ARG  15   7.632 -15.541  -7.181
  113    HD3  ARG  15           HD1      ARG  15   8.031 -14.167  -8.209
  114    HE   ARG  15           HE       ARG  15   9.838 -16.300  -7.373
  115   HH11  ARG  15          1HH2      ARG  15   9.432 -13.130  -8.704
  116   HH12  ARG  15          2HH2      ARG  15  10.967 -13.119  -9.504
  117   HH21  ARG  15          1HH1      ARG  15  11.854 -16.291  -8.425
  118   HH22  ARG  15          2HH1      ARG  15  12.338 -14.907  -9.348
  119    H    TYR  16           HN       TYR  16   5.771 -12.891  -2.639
  120    HA   TYR  16           HA       TYR  16   7.524 -14.869  -1.393
  121    HB2  TYR  16           HB2      TYR  16   6.818 -12.208  -0.165
  122    HB3  TYR  16           HB1      TYR  16   7.068 -13.618   0.865
  123    HD1  TYR  16           HD2      TYR  16   9.236 -15.051   0.256
  124    HD2  TYR  16           HD1      TYR  16   8.694 -10.894  -0.683
  125    HE1  TYR  16           HE2      TYR  16  11.693 -14.770   0.082
  126    HE2  TYR  16           HE1      TYR  16  11.153 -10.615  -0.854
  127    HH   TYR  16           HH       TYR  16  13.360 -13.081   0.166
  128    H    GLY  17           HN       GLY  17   5.196 -13.344   0.595
  129    HA2  GLY  17           HA2      GLY  17   3.608 -15.722   0.775
  130    HA3  GLY  17           HA1      GLY  17   3.271 -14.180   1.560
  131    H    THR  18           HN       THR  18   3.326 -15.581  -1.721
  132    HA   THR  18           HA       THR  18   1.319 -13.734  -2.666
  133    HB   THR  18           HB       THR  18   3.193 -14.720  -4.081
  134    HG1  THR  18           HG1      THR  18   0.591 -14.313  -4.634
  135   HG21  THR  18          3HG2      THR  18   3.068 -16.933  -4.856
  136   HG22  THR  18          1HG2      THR  18   1.382 -17.105  -4.368
  137   HG23  THR  18          2HG2      THR  18   2.657 -17.090  -3.150
  138    H    CYS  19           HN       CYS  19  -0.670 -14.516  -3.730
  139    HA   CYS  19           HA       CYS  19  -2.012 -16.546  -2.052
  140    HB2  CYS  19           HB2      CYS  19  -3.468 -14.738  -3.959
  141    HB3  CYS  19           HB1      CYS  19  -4.000 -15.392  -2.411
  142    HG   CYS  19           HG       CYS  19  -1.754 -13.222  -2.471
  143    H    ILE  20           HN       ILE  20  -3.370 -18.132  -3.066
  144    HA   ILE  20           HA       ILE  20  -2.356 -18.962  -5.704
  145    HB   ILE  20           HB       ILE  20  -4.187 -20.512  -3.874
  146   HG12  ILE  20          2HG1      ILE  20  -2.243 -19.934  -2.548
  147   HG13  ILE  20          1HG1      ILE  20  -2.072 -21.611  -3.063
  148   HG21  ILE  20          1HG2      ILE  20  -3.971 -21.319  -6.190
  149   HG22  ILE  20          2HG2      ILE  20  -3.192 -22.433  -5.067
  150   HG23  ILE  20          3HG2      ILE  20  -2.215 -21.324  -6.031
  151   HD11  ILE  20          3HD1      ILE  20  -0.644 -19.171  -4.121
  152   HD12  ILE  20          1HD1      ILE  20  -0.730 -20.660  -5.062
  153   HD13  ILE  20          2HD1      ILE  20   0.053 -20.658  -3.484
  154    H    TYR  21           HN       TYR  21  -3.459 -18.359  -7.430
  155    HA   TYR  21           HA       TYR  21  -6.423 -18.206  -7.290
  156    HB2  TYR  21           HB2      TYR  21  -4.435 -16.427  -8.707
  157    HB3  TYR  21           HB1      TYR  21  -6.124 -16.508  -9.204
  158    HD1  TYR  21           HD1      TYR  21  -7.857 -16.375  -7.147
  159    HD2  TYR  21           HD2      TYR  21  -3.869 -14.773  -7.144
  160    HE1  TYR  21           HE1      TYR  21  -8.490 -14.794  -5.345
  161    HE2  TYR  21           HE2      TYR  21  -4.509 -13.189  -5.348
  162    HH   TYR  21           HH       TYR  21  -7.679 -13.355  -3.796
  163    H    GLN  22           HN       GLN  22  -7.519 -19.377  -8.748
  164    HA   GLN  22           HA       GLN  22  -7.908 -20.957 -10.375
  165    HB2  GLN  22           HB2      GLN  22  -5.833 -19.267 -11.795
  166    HB3  GLN  22           HB1      GLN  22  -6.867 -20.461 -12.578
  167    HG2  GLN  22           HG2      GLN  22  -7.886 -18.073 -11.012
  168    HG3  GLN  22           HG1      GLN  22  -7.755 -18.132 -12.767
  169   HE21  GLN  22          1HE2      GLN  22 -10.049 -18.368 -10.456
  170   HE22  GLN  22          2HE2      GLN  22 -11.088 -19.504 -11.170
  171    H    GLY  23           HN       GLY  23  -5.405 -21.149  -8.496
  172    HA2  GLY  23           HA2      GLY  23  -4.055 -22.985  -8.014
  173    HA3  GLY  23           HA1      GLY  23  -4.518 -23.698  -9.555
  174    H    ARG  24           HN       ARG  24  -3.635 -20.557 -10.100
  175    HA   ARG  24           HA       ARG  24  -1.026 -21.352 -11.173
  176    HB2  ARG  24           HB2      ARG  24  -2.761 -20.055 -12.517
  177    HB3  ARG  24           HB1      ARG  24  -2.429 -18.689 -11.458
  178    HG2  ARG  24           HG2      ARG  24  -0.941 -18.259 -13.204
  179    HG3  ARG  24           HG1      ARG  24   0.093 -19.164 -12.102
  180    HD2  ARG  24           HD2      ARG  24  -0.329 -21.227 -13.365
  181    HD3  ARG  24           HD1      ARG  24  -1.444 -20.372 -14.424
  182    HE   ARG  24           HE       ARG  24   0.903 -18.972 -14.647
  183   HH11  ARG  24          1HH2      ARG  24  -0.069 -22.277 -14.966
  184   HH12  ARG  24          2HH2      ARG  24   1.123 -22.658 -16.164
  185   HH21  ARG  24          1HH1      ARG  24   2.470 -19.463 -16.219
  186   HH22  ARG  24          2HH1      ARG  24   2.561 -21.064 -16.873
  187    H    LEU  25           HN       LEU  25   0.914 -20.346 -10.591
  188    HA   LEU  25           HA       LEU  25   1.010 -19.340  -7.893
  189    HB2  LEU  25           HB2      LEU  25   3.079 -19.839 -10.026
  190    HB3  LEU  25           HB1      LEU  25   3.504 -19.029  -8.522
  191    HG   LEU  25           HG       LEU  25   3.871 -21.529  -8.506
  192   HD11  LEU  25          1HD1      LEU  25   3.333 -21.720  -6.265
  193   HD12  LEU  25          2HD1      LEU  25   1.747 -20.981  -6.454
  194   HD13  LEU  25          3HD1      LEU  25   3.194 -19.974  -6.442
  195   HD21  LEU  25          3HD2      LEU  25   2.022 -23.029  -8.524
  196   HD22  LEU  25          1HD2      LEU  25   1.738 -21.929  -9.873
  197   HD23  LEU  25          2HD2      LEU  25   0.856 -21.716  -8.361
  198    H    TRP  26           HN       TRP  26   1.239 -17.309  -7.200
  199    HA   TRP  26           HA       TRP  26   1.236 -15.134  -9.215
  200    HB2  TRP  26           HB2      TRP  26  -0.132 -15.533  -6.594
  201    HB3  TRP  26           HB1      TRP  26   0.375 -13.891  -6.960
  202    HD1  TRP  26           HD1      TRP  26  -1.088 -16.606  -9.295
  203    HE1  TRP  26           HE1      TRP  26  -3.147 -15.608 -10.479
  204    HE3  TRP  26           HE3      TRP  26  -1.253 -12.027  -7.057
  205    HZ2  TRP  26           HZ2      TRP  26  -4.664 -13.188 -10.477
  206    HZ3  TRP  26           HZ3      TRP  26  -3.019 -10.391  -7.671
  207    HH2  TRP  26           HH2      TRP  26  -4.721 -10.969  -9.373
  208    H    ALA  27           HN       ALA  27   2.587 -13.449  -8.997
  209    HA   ALA  27           HA       ALA  27   4.829 -13.797  -7.141
  210    HB1  ALA  27           HB1      ALA  27   4.342 -12.263  -9.652
  211    HB2  ALA  27           HB2      ALA  27   5.779 -13.151  -9.149
  212    HB3  ALA  27           HB3      ALA  27   5.457 -11.551  -8.492
  213    H    PHE  28           HN       PHE  28   4.597 -12.828  -5.173
  214    HA   PHE  28           HA       PHE  28   2.437 -10.950  -4.780
  215    HB2  PHE  28           HB2      PHE  28   3.347 -12.661  -3.093
  216    HB3  PHE  28           HB1      PHE  28   4.683 -11.552  -2.859
  217    HD1  PHE  28           HD2      PHE  28   0.927 -11.408  -3.061
  218    HD2  PHE  28           HD1      PHE  28   4.497 -10.072  -1.070
  219    HE1  PHE  28           HE2      PHE  28  -0.445 -10.124  -1.442
  220    HE2  PHE  28           HE1      PHE  28   3.119  -8.801   0.546
  221    HZ   PHE  28           HZ       PHE  28   0.648  -8.829   0.359
  222    H    CYS  29           HN       CYS  29   2.754  -9.157  -5.893
  223    HA   CYS  29           HA       CYS  29   5.133  -7.526  -5.276
  224    HB2  CYS  29           HB2      CYS  29   4.080  -8.430  -7.886
  225    HB3  CYS  29           HB1      CYS  29   4.509  -6.727  -7.809
  226    HG   CYS  29           HG       CYS  29   6.939  -7.426  -7.139
  227    H    CYS  30           HN       CYS  30   4.653  -5.620  -4.462
  228    HA   CYS  30           HA       CYS  30   2.052  -4.809  -3.833
  229    HB2  CYS  30           HB2      CYS  30   4.655  -3.285  -3.954
  230    HB3  CYS  30           HB1      CYS  30   3.156  -2.562  -3.373
  231    HG   CYS  30           HG       CYS  30   4.618  -4.941  -1.977
  Start of MODEL    4
    1    H1   ALA   1           HT1      ALA   1  -4.935   4.112  -4.397
    2    H2   ALA   1           HT2      ALA   1  -6.000   3.075  -3.574
    3    H3   ALA   1           HT3      ALA   1  -5.742   2.883  -5.242
    4    HA   ALA   1           HA       ALA   1  -3.336   2.447  -4.699
    5    HB1  ALA   1           HB1      ALA   1  -4.617   2.274  -1.959
    6    HB2  ALA   1           HB2      ALA   1  -3.272   3.304  -2.447
    7    HB3  ALA   1           HB3      ALA   1  -3.052   1.557  -2.343
    8    H    CYS   2           HN       CYS   2  -2.736   0.117  -4.202
    9    HA   CYS   2           HA       CYS   2  -4.945  -1.789  -4.199
   10    HB2  CYS   2           HB2      CYS   2  -4.441  -2.790  -6.306
   11    HB3  CYS   2           HB1      CYS   2  -4.587  -1.058  -6.608
   12    HG   CYS   2           HG       CYS   2  -2.227  -1.028  -7.342
   13    H    TYR   3           HN       TYR   3  -4.194  -4.012  -3.971
   14    HA   TYR   3           HA       TYR   3  -1.356  -4.310  -3.221
   15    HB2  TYR   3           HB2      TYR   3  -2.042  -5.544  -1.176
   16    HB3  TYR   3           HB1      TYR   3  -2.474  -3.837  -1.129
   17    HD1  TYR   3           HD1      TYR   3  -4.842  -3.165  -1.831
   18    HD2  TYR   3           HD2      TYR   3  -3.715  -7.220  -0.965
   19    HE1  TYR   3           HE1      TYR   3  -7.228  -3.764  -1.528
   20    HE2  TYR   3           HE2      TYR   3  -6.102  -7.818  -0.664
   21    HH   TYR   3           HH       TYR   3  -8.670  -5.364  -1.027
   22    H    CYS   4           HN       CYS   4  -1.679  -5.274  -5.413
   23    HA   CYS   4           HA       CYS   4  -1.836  -8.132  -5.118
   24    HB2  CYS   4           HB2      CYS   4  -3.956  -6.679  -6.472
   25    HB3  CYS   4           HB1      CYS   4  -3.195  -7.873  -7.523
   26    HG   CYS   4           HG       CYS   4  -3.994  -9.750  -6.018
   27    H    ARG   5           HN       ARG   5  -1.269  -9.050  -7.523
   28    HA   ARG   5           HA       ARG   5   1.192  -7.583  -8.230
   29    HB2  ARG   5           HB2      ARG   5   1.449  -9.951  -7.839
   30    HB3  ARG   5           HB1      ARG   5   0.173 -10.332  -8.982
   31    HG2  ARG   5           HG2      ARG   5   1.547  -9.441 -10.823
   32    HG3  ARG   5           HG1      ARG   5   2.807  -8.988  -9.670
   33    HD2  ARG   5           HD2      ARG   5   3.074 -11.341  -9.026
   34    HD3  ARG   5           HD1      ARG   5   1.779 -11.799 -10.127
   35    HE   ARG   5           HE       ARG   5   3.235 -11.480 -11.938
   36   HH11  ARG   5          1HH2      ARG   5   4.633 -10.470  -8.938
   37   HH12  ARG   5          2HH2      ARG   5   6.232 -10.307  -9.578
   38   HH21  ARG   5          1HH1      ARG   5   5.330 -11.283 -12.780
   39   HH22  ARG   5          2HH1      ARG   5   6.628 -10.772 -11.755
   40    H    ILE   6           HN       ILE   6   1.213  -6.364  -9.786
   41    HA   ILE   6           HA       ILE   6  -0.700  -6.565 -12.012
   42    HB   ILE   6           HB       ILE   6   0.553  -4.183 -12.364
   43   HG12  ILE   6          2HG1      ILE   6   1.988  -4.614 -10.359
   44   HG13  ILE   6          1HG1      ILE   6   1.096  -3.110 -10.304
   45   HG21  ILE   6          1HG2      ILE   6  -1.787  -4.801 -10.557
   46   HG22  ILE   6          2HG2      ILE   6  -1.816  -4.224 -12.224
   47   HG23  ILE   6          3HG2      ILE   6  -1.301  -3.145 -10.927
   48   HD11  ILE   6          3HD1      ILE   6  -0.539  -5.094  -9.036
   49   HD12  ILE   6          1HD1      ILE   6   0.271  -3.715  -8.296
   50   HD13  ILE   6          2HD1      ILE   6   1.101  -5.257  -8.417
   51    HA   PRO   7           HA       PRO   7   2.696  -8.106 -14.286
   52    HB2  PRO   7           HB2      PRO   7   2.575  -6.648 -16.653
   53    HB3  PRO   7           HB1      PRO   7   1.547  -8.040 -16.264
   54    HG2  PRO   7           HG2      PRO   7   0.938  -5.129 -16.072
   55    HG3  PRO   7           HG1      PRO   7  -0.106  -6.470 -16.575
   56    HD2  PRO   7           HD2      PRO   7  -0.298  -5.333 -14.124
   57    HD3  PRO   7           HD1      PRO   7  -0.628  -7.057 -14.394
   58    H    ALA   8           HN       ALA   8   3.023  -5.663 -12.570
   59    HA   ALA   8           HA       ALA   8   5.735  -5.001 -13.337
   60    HB1  ALA   8           HB1      ALA   8   5.283  -2.588 -13.110
   61    HB2  ALA   8           HB2      ALA   8   3.561  -2.934 -12.962
   62    HB3  ALA   8           HB3      ALA   8   4.404  -3.282 -14.472
   63    H    CYS   9           HN       CYS   9   6.660  -5.607 -11.347
   64    HA   CYS   9           HA       CYS   9   5.195  -5.313  -8.939
   65    HB2  CYS   9           HB2      CYS   9   7.452  -6.653  -9.492
   66    HB3  CYS   9           HB1      CYS   9   8.172  -5.200  -8.797
   67    HG   CYS   9           HG       CYS   9   7.549  -6.119  -6.583
   68    H    ILE  10           HN       ILE  10   4.348  -3.363  -8.645
   69    HA   ILE  10           HA       ILE  10   5.602  -0.976  -9.400
   70    HB   ILE  10           HB       ILE  10   3.336  -1.487  -7.470
   71   HG12  ILE  10          2HG1      ILE  10   3.335  -0.316 -10.261
   72   HG13  ILE  10          1HG1      ILE  10   3.110  -2.031  -9.945
   73   HG21  ILE  10          1HG2      ILE  10   2.885   0.996  -7.912
   74   HG22  ILE  10          2HG2      ILE  10   4.534   1.088  -8.529
   75   HG23  ILE  10          3HG2      ILE  10   4.246   0.646  -6.848
   76   HD11  ILE  10          3HD1      ILE  10   1.153  -1.568  -8.573
   77   HD12  ILE  10          1HD1      ILE  10   0.950  -0.801 -10.150
   78   HD13  ILE  10          2HD1      ILE  10   1.412   0.165  -8.750
   79    H    ALA  11           HN       ALA  11   5.428  -2.583  -6.210
   80    HA   ALA  11           HA       ALA  11   6.919  -0.466  -4.932
   81    HB1  ALA  11           HB1      ALA  11   6.878  -1.829  -2.966
   82    HB2  ALA  11           HB2      ALA  11   6.480  -3.270  -3.902
   83    HB3  ALA  11           HB3      ALA  11   5.303  -1.977  -3.732
   84    H    GLY  12           HN       GLY  12   7.713  -3.342  -6.692
   85    HA2  GLY  12           HA2      GLY  12   9.769  -4.215  -7.301
   86    HA3  GLY  12           HA1      GLY  12  10.501  -2.735  -6.679
   87    H    GLU  13           HN       GLU  13   8.389  -4.737  -4.779
   88    HA   GLU  13           HA       GLU  13  10.580  -5.300  -2.892
   89    HB2  GLU  13           HB2      GLU  13   7.578  -5.218  -2.620
   90    HB3  GLU  13           HB1      GLU  13   8.607  -5.922  -1.373
   91    HG2  GLU  13           HG2      GLU  13   9.863  -3.788  -1.259
   92    HG3  GLU  13           HG1      GLU  13   8.759  -3.100  -2.443
   93    H    ARG  14           HN       ARG  14   9.851  -7.376  -1.529
   94    HA   ARG  14           HA       ARG  14   9.922  -9.606  -3.459
   95    HB2  ARG  14           HB2      ARG  14  10.670  -9.439  -0.530
   96    HB3  ARG  14           HB1      ARG  14  10.745 -10.909  -1.501
   97    HG2  ARG  14           HG2      ARG  14  12.365  -9.883  -3.008
   98    HG3  ARG  14           HG1      ARG  14  12.232  -8.347  -2.149
   99    HD2  ARG  14           HD2      ARG  14  14.230  -9.519  -1.387
  100    HD3  ARG  14           HD1      ARG  14  13.050  -9.467  -0.081
  101    HE   ARG  14           HE       ARG  14  12.756 -11.863  -1.597
  102   HH11  ARG  14          1HH2      ARG  14  14.770 -10.266   0.724
  103   HH12  ARG  14          2HH2      ARG  14  15.355 -11.734   1.432
  104   HH21  ARG  14          1HH1      ARG  14  13.522 -13.793  -0.670
  105   HH22  ARG  14          2HH1      ARG  14  14.648 -13.729   0.644
  106    H    ARG  15           HN       ARG  15   8.486 -11.268  -3.346
  107    HA   ARG  15           HA       ARG  15   5.890 -10.717  -2.342
  108    HB2  ARG  15           HB2      ARG  15   6.717 -13.530  -3.019
  109    HB3  ARG  15           HB1      ARG  15   5.236 -12.672  -3.414
  110    HG2  ARG  15           HG2      ARG  15   6.183 -12.564  -5.508
  111    HG3  ARG  15           HG1      ARG  15   7.016 -11.166  -4.835
  112    HD2  ARG  15           HD2      ARG  15   8.931 -12.618  -4.222
  113    HD3  ARG  15           HD1      ARG  15   8.077 -14.010  -4.872
  114    HE   ARG  15           HE       ARG  15   8.629 -13.295  -7.012
  115   HH11  ARG  15          1HH2      ARG  15   9.133 -10.785  -4.685
  116   HH12  ARG  15          2HH2      ARG  15   9.965  -9.740  -5.788
  117   HH21  ARG  15          1HH1      ARG  15   9.715 -11.932  -8.464
  118   HH22  ARG  15          2HH1      ARG  15  10.295 -10.389  -7.929
  119    H    TYR  16           HN       TYR  16   4.821 -11.519  -0.553
  120    HA   TYR  16           HA       TYR  16   6.160 -13.447   1.194
  121    HB2  TYR  16           HB2      TYR  16   7.056 -11.348   2.011
  122    HB3  TYR  16           HB1      TYR  16   5.438 -10.651   2.095
  123    HD1  TYR  16           HD1      TYR  16   7.352 -13.647   3.308
  124    HD2  TYR  16           HD2      TYR  16   4.286 -10.752   4.141
  125    HE1  TYR  16           HE1      TYR  16   7.067 -14.597   5.581
  126    HE2  TYR  16           HE2      TYR  16   4.003 -11.705   6.409
  127    HH   TYR  16           HH       TYR  16   4.414 -13.861   7.556
  128    H    GLY  17           HN       GLY  17   3.798 -11.326   2.522
  129    HA2  GLY  17           HA2      GLY  17   1.912 -13.500   2.833
  130    HA3  GLY  17           HA1      GLY  17   1.724 -11.852   3.436
  131    H    THR  18           HN       THR  18   1.867 -13.641   0.377
  132    HA   THR  18           HA       THR  18   0.382 -11.628  -1.041
  133    HB   THR  18           HB       THR  18   0.769 -12.920  -2.949
  134    HG1  THR  18           HG1      THR  18   0.592 -14.989  -1.138
  135   HG21  THR  18          3HG2      THR  18   3.089 -13.373  -2.901
  136   HG22  THR  18          1HG2      THR  18   3.046 -13.790  -1.192
  137   HG23  THR  18          2HG2      THR  18   2.845 -12.112  -1.693
  138    H    CYS  19           HN       CYS  19  -1.537 -12.202  -2.338
  139    HA   CYS  19           HA       CYS  19  -3.505 -13.680  -0.713
  140    HB2  CYS  19           HB2      CYS  19  -5.165 -12.489  -2.188
  141    HB3  CYS  19           HB1      CYS  19  -4.182 -11.411  -1.201
  142    HG   CYS  19           HG       CYS  19  -3.352 -10.366  -3.286
  143    H    ILE  20           HN       ILE  20  -4.578 -15.441  -1.533
  144    HA   ILE  20           HA       ILE  20  -3.382 -16.743  -3.816
  145    HB   ILE  20           HB       ILE  20  -5.855 -17.611  -2.313
  146   HG12  ILE  20          2HG1      ILE  20  -4.153 -17.182  -0.641
  147   HG13  ILE  20          1HG1      ILE  20  -4.236 -18.924  -0.896
  148   HG21  ILE  20          1HG2      ILE  20  -3.691 -19.138  -3.794
  149   HG22  ILE  20          2HG2      ILE  20  -5.311 -18.811  -4.407
  150   HG23  ILE  20          3HG2      ILE  20  -5.094 -19.848  -2.998
  151   HD11  ILE  20          3HD1      ILE  20  -2.133 -16.984  -1.853
  152   HD12  ILE  20          1HD1      ILE  20  -2.335 -18.556  -2.626
  153   HD13  ILE  20          2HD1      ILE  20  -1.920 -18.461  -0.916
  154    H    TYR  21           HN       TYR  21  -3.981 -16.505  -5.848
  155    HA   TYR  21           HA       TYR  21  -6.781 -16.140  -6.566
  156    HB2  TYR  21           HB2      TYR  21  -5.990 -13.833  -6.158
  157    HB3  TYR  21           HB1      TYR  21  -4.693 -14.083  -7.327
  158    HD1  TYR  21           HD1      TYR  21  -8.407 -14.123  -6.946
  159    HD2  TYR  21           HD2      TYR  21  -5.083 -13.797  -9.647
  160    HE1  TYR  21           HE1      TYR  21  -9.959 -13.521  -8.784
  161    HE2  TYR  21           HE2      TYR  21  -6.635 -13.196 -11.484
  162    HH   TYR  21           HH       TYR  21 -10.135 -13.308 -11.043
  163    H    GLN  22           HN       GLN  22  -7.199 -17.263  -8.354
  164    HA   GLN  22           HA       GLN  22  -6.861 -18.614 -10.184
  165    HB2  GLN  22           HB2      GLN  22  -6.305 -16.188 -10.973
  166    HB3  GLN  22           HB1      GLN  22  -4.633 -16.743 -10.982
  167    HG2  GLN  22           HG2      GLN  22  -5.507 -17.087 -13.198
  168    HG3  GLN  22           HG1      GLN  22  -5.385 -18.673 -12.447
  169   HE21  GLN  22          1HE2      GLN  22  -7.150 -19.767 -13.400
  170   HE22  GLN  22          2HE2      GLN  22  -8.755 -19.223 -13.307
  171    H    GLY  23           HN       GLY  23  -4.924 -18.682  -7.705
  172    HA2  GLY  23           HA2      GLY  23  -3.487 -20.410  -7.058
  173    HA3  GLY  23           HA1      GLY  23  -3.314 -20.879  -8.745
  174    H    ARG  24           HN       ARG  24  -2.896 -17.640  -8.763
  175    HA   ARG  24           HA       ARG  24   0.043 -17.882  -8.726
  176    HB2  ARG  24           HB2      ARG  24  -1.803 -15.756  -9.845
  177    HB3  ARG  24           HB1      ARG  24  -0.043 -15.674  -9.894
  178    HG2  ARG  24           HG2      ARG  24   0.036 -17.762 -11.186
  179    HG3  ARG  24           HG1      ARG  24  -1.722 -17.888 -11.110
  180    HD2  ARG  24           HD2      ARG  24  -0.257 -15.533 -12.325
  181    HD3  ARG  24           HD1      ARG  24  -0.854 -16.900 -13.261
  182    HE   ARG  24           HE       ARG  24  -2.989 -15.912 -11.731
  183   HH11  ARG  24          1HH2      ARG  24  -0.871 -14.947 -14.291
  184   HH12  ARG  24          2HH2      ARG  24  -2.025 -13.889 -15.033
  185   HH21  ARG  24          1HH1      ARG  24  -4.508 -14.530 -12.697
  186   HH22  ARG  24          2HH1      ARG  24  -4.085 -13.654 -14.131
  187    H    LEU  25           HN       LEU  25   1.290 -16.826  -7.262
  188    HA   LEU  25           HA       LEU  25  -0.029 -15.583  -4.996
  189    HB2  LEU  25           HB2      LEU  25   2.932 -15.888  -5.565
  190    HB3  LEU  25           HB1      LEU  25   2.200 -15.465  -4.018
  191    HG   LEU  25           HG       LEU  25   1.740 -18.066  -5.512
  192   HD11  LEU  25          1HD1      LEU  25   3.342 -17.489  -2.999
  193   HD12  LEU  25          2HD1      LEU  25   4.030 -17.839  -4.585
  194   HD13  LEU  25          3HD1      LEU  25   3.102 -19.074  -3.734
  195   HD21  LEU  25          3HD2      LEU  25  -0.199 -17.756  -4.219
  196   HD22  LEU  25          1HD2      LEU  25   0.666 -16.904  -2.940
  197   HD23  LEU  25          2HD2      LEU  25   0.835 -18.652  -3.111
  198    H    TRP  26           HN       TRP  26  -0.073 -13.487  -4.463
  199    HA   TRP  26           HA       TRP  26   0.453 -11.522  -6.504
  200    HB2  TRP  26           HB2      TRP  26  -1.425 -10.851  -5.344
  201    HB3  TRP  26           HB1      TRP  26  -0.910 -11.635  -3.865
  202    HD1  TRP  26           HD1      TRP  26   0.878  -8.888  -5.857
  203    HE1  TRP  26           HE1      TRP  26   1.300  -6.876  -4.305
  204    HE3  TRP  26           HE3      TRP  26  -1.527 -10.493  -1.657
  205    HZ2  TRP  26           HZ2      TRP  26   0.696  -6.058  -1.634
  206    HZ3  TRP  26           HZ3      TRP  26  -1.588  -9.086   0.376
  207    HH2  TRP  26           HH2      TRP  26  -0.485  -6.867   0.393
  208    H    ALA  27           HN       ALA  27   2.510 -10.842  -6.846
  209    HA   ALA  27           HA       ALA  27   4.572 -11.010  -4.896
  210    HB1  ALA  27           HB1      ALA  27   5.220 -10.998  -7.214
  211    HB2  ALA  27           HB2      ALA  27   5.832  -9.511  -6.488
  212    HB3  ALA  27           HB3      ALA  27   4.383  -9.471  -7.490
  213    H    PHE  28           HN       PHE  28   5.541  -9.278  -3.672
  214    HA   PHE  28           HA       PHE  28   3.561  -7.410  -2.776
  215    HB2  PHE  28           HB2      PHE  28   5.542  -8.511  -1.480
  216    HB3  PHE  28           HB1      PHE  28   6.485  -7.169  -2.113
  217    HD1  PHE  28           HD2      PHE  28   5.310  -4.772  -1.860
  218    HD2  PHE  28           HD1      PHE  28   4.419  -8.217   0.551
  219    HE1  PHE  28           HE2      PHE  28   4.379  -3.302  -0.096
  220    HE2  PHE  28           HE1      PHE  28   3.488  -6.743   2.311
  221    HZ   PHE  28           HZ       PHE  28   3.467  -4.285   1.989
  222    H    CYS  29           HN       CYS  29   2.936  -5.958  -4.101
  223    HA   CYS  29           HA       CYS  29   4.860  -4.158  -5.466
  224    HB2  CYS  29           HB2      CYS  29   2.051  -4.823  -6.353
  225    HB3  CYS  29           HB1      CYS  29   3.329  -4.044  -7.291
  226    HG   CYS  29           HG       CYS  29   3.400  -7.065  -6.462
  227    H    CYS  30           HN       CYS  30   3.907  -1.950  -5.825
  228    HA   CYS  30           HA       CYS  30   2.931  -0.020  -5.050
  229    HB2  CYS  30           HB2      CYS  30   0.904  -1.694  -3.578
  230    HB3  CYS  30           HB1      CYS  30   0.713  -0.082  -4.262
  231    HG   CYS  30           HG       CYS  30  -0.092  -1.204  -6.308
  Start of MODEL    5
    1    H1   ALA   1           HT1      ALA   1  -2.306  -0.680   1.647
    2    H2   ALA   1           HT2      ALA   1  -3.845  -0.609   2.363
    3    H3   ALA   1           HT3      ALA   1  -3.650  -0.223   0.720
    4    HA   ALA   1           HA       ALA   1  -3.617  -2.855   2.030
    5    HB1  ALA   1           HB1      ALA   1  -4.776  -1.873  -0.594
    6    HB2  ALA   1           HB2      ALA   1  -5.667  -1.924   0.927
    7    HB3  ALA   1           HB3      ALA   1  -5.098  -3.421   0.187
    8    H    CYS   2           HN       CYS   2  -3.147  -4.622   0.283
    9    HA   CYS   2           HA       CYS   2  -0.498  -3.995  -0.855
   10    HB2  CYS   2           HB2      CYS   2  -0.867  -5.934   0.789
   11    HB3  CYS   2           HB1      CYS   2  -1.657  -6.756  -0.557
   12    HG   CYS   2           HG       CYS   2   0.739  -7.401  -1.010
   13    H    TYR   3           HN       TYR   3   0.001  -5.497  -2.774
   14    HA   TYR   3           HA       TYR   3  -2.255  -5.533  -4.670
   15    HB2  TYR   3           HB2      TYR   3   0.483  -4.331  -5.092
   16    HB3  TYR   3           HB1      TYR   3  -0.562  -4.807  -6.430
   17    HD1  TYR   3           HD1      TYR   3  -3.015  -3.917  -6.366
   18    HD2  TYR   3           HD2      TYR   3   0.219  -2.194  -4.124
   19    HE1  TYR   3           HE1      TYR   3  -4.299  -1.811  -6.135
   20    HE2  TYR   3           HE2      TYR   3  -1.066  -0.084  -3.895
   21    HH   TYR   3           HH       TYR   3  -2.894   1.092  -5.083
   22    H    CYS   4           HN       CYS   4  -2.116  -6.993  -6.280
   23    HA   CYS   4           HA       CYS   4  -0.686  -9.437  -5.633
   24    HB2  CYS   4           HB2      CYS   4  -2.674  -8.866  -7.830
   25    HB3  CYS   4           HB1      CYS   4  -2.139 -10.451  -7.273
   26    HG   CYS   4           HG       CYS   4  -4.068 -10.271  -5.717
   27    H    ARG   5           HN       ARG   5  -0.165 -10.659  -7.955
   28    HA   ARG   5           HA       ARG   5   1.992  -8.993  -9.030
   29    HB2  ARG   5           HB2      ARG   5   2.644 -11.218  -8.450
   30    HB3  ARG   5           HB1      ARG   5   1.326 -11.911  -9.370
   31    HG2  ARG   5           HG2      ARG   5   2.327 -11.208 -11.459
   32    HG3  ARG   5           HG1      ARG   5   3.570 -10.291 -10.611
   33    HD2  ARG   5           HD2      ARG   5   4.361 -12.398  -9.574
   34    HD3  ARG   5           HD1      ARG   5   3.146 -13.280 -10.492
   35    HE   ARG   5           HE       ARG   5   4.423 -12.961 -12.441
   36   HH11  ARG   5          1HH2      ARG   5   5.708 -11.209  -9.737
   37   HH12  ARG   5          2HH2      ARG   5   7.223 -10.870 -10.506
   38   HH21  ARG   5          1HH1      ARG   5   6.412 -12.527 -13.442
   39   HH22  ARG   5          2HH1      ARG   5   7.621 -11.617 -12.600
   40    H    ILE   6           HN       ILE   6   1.633  -7.831 -10.572
   41    HA   ILE   6           HA       ILE   6   0.338  -8.766 -13.001
   42    HB   ILE   6           HB       ILE   6  -0.495  -6.331 -13.244
   43   HG12  ILE   6          2HG1      ILE   6   0.788  -5.771 -10.974
   44   HG13  ILE   6          1HG1      ILE   6  -0.715  -4.966 -11.374
   45   HG21  ILE   6          1HG2      ILE   6  -2.590  -6.895 -11.861
   46   HG22  ILE   6          2HG2      ILE   6  -1.753  -8.388 -11.431
   47   HG23  ILE   6          3HG2      ILE   6  -2.123  -8.040 -13.120
   48   HD11  ILE   6          3HD1      ILE   6  -1.951  -6.255  -9.855
   49   HD12  ILE   6          1HD1      ILE   6  -0.449  -5.932  -9.001
   50   HD13  ILE   6          2HD1      ILE   6  -0.721  -7.501  -9.754
   51    HA   PRO   7           HA       PRO   7   4.476  -7.446 -14.050
   52    HB2  PRO   7           HB2      PRO   7   3.264  -6.520 -16.619
   53    HB3  PRO   7           HB1      PRO   7   4.691  -7.538 -16.348
   54    HG2  PRO   7           HG2      PRO   7   2.360  -8.566 -17.167
   55    HG3  PRO   7           HG1      PRO   7   3.444  -9.451 -16.075
   56    HD2  PRO   7           HD2      PRO   7   0.846  -8.116 -15.465
   57    HD3  PRO   7           HD1      PRO   7   1.642  -9.492 -14.658
   58    H    ALA   8           HN       ALA   8   4.474  -5.803 -12.525
   59    HA   ALA   8           HA       ALA   8   4.247  -3.067 -13.551
   60    HB1  ALA   8           HB1      ALA   8   2.942  -2.315 -11.663
   61    HB2  ALA   8           HB2      ALA   8   2.972  -3.926 -10.943
   62    HB3  ALA   8           HB3      ALA   8   2.073  -3.643 -12.432
   63    H    CYS   9           HN       CYS   9   4.658  -1.828 -11.062
   64    HA   CYS   9           HA       CYS   9   7.441  -1.957 -10.813
   65    HB2  CYS   9           HB2      CYS   9   7.128  -0.639  -8.766
   66    HB3  CYS   9           HB1      CYS   9   6.088  -0.044 -10.060
   67    HG   CYS   9           HG       CYS   9   5.027  -0.843  -7.461
   68    H    ILE  10           HN       ILE  10   7.695  -4.341 -10.726
   69    HA   ILE  10           HA       ILE  10   6.882  -5.853  -8.447
   70    HB   ILE  10           HB       ILE  10   9.031  -6.300 -10.533
   71   HG12  ILE  10          2HG1      ILE  10   6.473  -7.871 -10.180
   72   HG13  ILE  10          1HG1      ILE  10   6.449  -6.346 -11.044
   73   HG21  ILE  10          1HG2      ILE  10   9.762  -7.575  -8.665
   74   HG22  ILE  10          2HG2      ILE  10   8.857  -8.719  -9.655
   75   HG23  ILE  10          3HG2      ILE  10   8.114  -8.015  -8.219
   76   HD11  ILE  10          3HD1      ILE  10   8.257  -8.679 -11.704
   77   HD12  ILE  10          1HD1      ILE  10   8.155  -7.164 -12.599
   78   HD13  ILE  10          2HD1      ILE  10   6.779  -8.267 -12.571
   79    H    ALA  11           HN       ALA  11   9.362  -3.572  -9.023
   80    HA   ALA  11           HA       ALA  11  10.981  -4.468  -6.726
   81    HB1  ALA  11           HB1      ALA  11  12.010  -3.787  -8.972
   82    HB2  ALA  11           HB2      ALA  11  12.685  -3.030  -7.529
   83    HB3  ALA  11           HB3      ALA  11  11.559  -2.135  -8.551
   84    H    GLY  12           HN       GLY  12  11.990  -2.013  -5.918
   85    HA2  GLY  12           HA2      GLY  12  11.487  -0.032  -4.798
   86    HA3  GLY  12           HA1      GLY  12   9.806  -0.208  -5.285
   87    H    GLU  13           HN       GLU  13   8.363  -1.028  -3.871
   88    HA   GLU  13           HA       GLU  13   9.342  -1.721  -1.172
   89    HB2  GLU  13           HB2      GLU  13   7.690   0.153  -1.477
   90    HB3  GLU  13           HB1      GLU  13   6.534  -1.033  -2.076
   91    HG2  GLU  13           HG2      GLU  13   6.526  -2.201   0.036
   92    HG3  GLU  13           HG1      GLU  13   7.865  -1.226   0.641
   93    H    ARG  14           HN       ARG  14   8.010  -3.417  -0.028
   94    HA   ARG  14           HA       ARG  14   7.645  -5.724  -1.825
   95    HB2  ARG  14           HB2      ARG  14   8.124  -5.520   1.148
   96    HB3  ARG  14           HB1      ARG  14   7.776  -7.035   0.315
   97    HG2  ARG  14           HG2      ARG  14   9.746  -6.689  -1.137
   98    HG3  ARG  14           HG1      ARG  14  10.100  -5.181  -0.292
   99    HD2  ARG  14           HD2      ARG  14   9.940  -7.889   1.054
  100    HD3  ARG  14           HD1      ARG  14  11.443  -7.125   0.546
  101    HE   ARG  14           HE       ARG  14   9.895  -6.465   2.876
  102   HH11  ARG  14          1HH2      ARG  14  12.000  -5.250   0.414
  103   HH12  ARG  14          2HH2      ARG  14  12.598  -3.940   1.377
  104   HH21  ARG  14          1HH1      ARG  14  10.674  -4.750   4.147
  105   HH22  ARG  14          2HH1      ARG  14  11.846  -3.657   3.490
  106    H    ARG  15           HN       ARG  15   5.939  -7.265  -1.289
  107    HA   ARG  15           HA       ARG  15   3.401  -5.995  -1.192
  108    HB2  ARG  15           HB2      ARG  15   2.608  -8.442  -0.910
  109    HB3  ARG  15           HB1      ARG  15   3.470  -8.025  -2.391
  110    HG2  ARG  15           HG2      ARG  15   5.414  -9.144  -1.754
  111    HG3  ARG  15           HG1      ARG  15   5.075  -8.983  -0.032
  112    HD2  ARG  15           HD2      ARG  15   3.453 -10.731  -1.895
  113    HD3  ARG  15           HD1      ARG  15   4.805 -11.323  -0.934
  114    HE   ARG  15           HE       ARG  15   2.169 -10.594   0.047
  115   HH11  ARG  15          1HH2      ARG  15   5.518 -11.104   0.750
  116   HH12  ARG  15          2HH2      ARG  15   5.263 -11.407   2.437
  117   HH21  ARG  15          1HH1      ARG  15   1.827 -10.992   2.263
  118   HH22  ARG  15          2HH1      ARG  15   3.175 -11.342   3.292
  119    H    TYR  16           HN       TYR  16   2.050  -5.618   0.491
  120    HA   TYR  16           HA       TYR  16   3.052  -6.067   3.191
  121    HB2  TYR  16           HB2      TYR  16   2.038  -3.901   2.582
  122    HB3  TYR  16           HB1      TYR  16   0.514  -4.717   2.236
  123    HD1  TYR  16           HD2      TYR  16   3.015  -4.086   4.930
  124    HD2  TYR  16           HD1      TYR  16  -1.010  -5.242   3.976
  125    HE1  TYR  16           HE2      TYR  16   2.414  -3.972   7.333
  126    HE2  TYR  16           HE1      TYR  16  -1.612  -5.129   6.379
  127    HH   TYR  16           HH       TYR  16  -0.812  -4.020   8.422
  128    H    GLY  17           HN       GLY  17   0.996  -7.615   0.965
  129    HA2  GLY  17           HA2      GLY  17   0.482  -9.836   2.595
  130    HA3  GLY  17           HA1      GLY  17  -0.929  -8.786   2.662
  131    H    THR  18           HN       THR  18   0.595 -11.248   0.947
  132    HA   THR  18           HA       THR  18  -0.488 -10.655  -1.667
  133    HB   THR  18           HB       THR  18   1.461 -11.965  -1.756
  134    HG1  THR  18           HG1      THR  18  -0.865 -13.052  -2.429
  135   HG21  THR  18          3HG2      THR  18   1.612 -14.112  -0.384
  136   HG22  THR  18          1HG2      THR  18   0.202 -13.529   0.499
  137   HG23  THR  18          2HG2      THR  18   1.703 -12.608   0.530
  138    H    CYS  19           HN       CYS  19  -2.255 -11.583  -2.653
  139    HA   CYS  19           HA       CYS  19  -3.994 -13.337  -1.018
  140    HB2  CYS  19           HB2      CYS  19  -5.958 -12.062  -1.811
  141    HB3  CYS  19           HB1      CYS  19  -4.885 -11.066  -0.828
  142    HG   CYS  19           HG       CYS  19  -4.684  -9.551  -2.766
  143    H    ILE  20           HN       ILE  20  -4.302 -15.157  -2.086
  144    HA   ILE  20           HA       ILE  20  -3.896 -15.288  -4.972
  145    HB   ILE  20           HB       ILE  20  -4.503 -17.441  -2.940
  146   HG12  ILE  20          2HG1      ILE  20  -1.953 -16.840  -4.455
  147   HG13  ILE  20          1HG1      ILE  20  -2.270 -16.250  -2.821
  148   HG21  ILE  20          1HG2      ILE  20  -5.311 -18.211  -5.060
  149   HG22  ILE  20          2HG2      ILE  20  -3.710 -18.921  -4.879
  150   HG23  ILE  20          3HG2      ILE  20  -3.936 -17.513  -5.916
  151   HD11  ILE  20          3HD1      ILE  20  -2.332 -19.157  -3.653
  152   HD12  ILE  20          1HD1      ILE  20  -2.559 -18.534  -2.019
  153   HD13  ILE  20          2HD1      ILE  20  -0.993 -18.376  -2.814
  154    H    TYR  21           HN       TYR  21  -5.414 -15.677  -6.462
  155    HA   TYR  21           HA       TYR  21  -8.147 -16.338  -5.659
  156    HB2  TYR  21           HB2      TYR  21  -8.016 -13.885  -5.527
  157    HB3  TYR  21           HB1      TYR  21  -7.451 -13.831  -7.197
  158    HD1  TYR  21           HD2      TYR  21 -10.308 -14.783  -5.017
  159    HD2  TYR  21           HD1      TYR  21  -8.963 -14.068  -9.033
  160    HE1  TYR  21           HE2      TYR  21 -12.655 -14.849  -5.815
  161    HE2  TYR  21           HE1      TYR  21 -11.310 -14.133  -9.831
  162    HH   TYR  21           HH       TYR  21 -13.518 -13.930  -9.063
  163    H    GLN  22           HN       GLN  22  -8.628 -17.995  -6.940
  164    HA   GLN  22           HA       GLN  22  -8.698 -19.383  -8.774
  165    HB2  GLN  22           HB2      GLN  22  -8.811 -16.691 -10.157
  166    HB3  GLN  22           HB1      GLN  22  -9.201 -18.232 -10.919
  167    HG2  GLN  22           HG2      GLN  22 -10.589 -17.137  -8.457
  168    HG3  GLN  22           HG1      GLN  22 -11.223 -17.016 -10.096
  169   HE21  GLN  22          1HE2      GLN  22 -11.757 -18.756  -7.410
  170   HE22  GLN  22          2HE2      GLN  22 -12.129 -20.270  -8.080
  171    H    GLY  23           HN       GLY  23  -6.038 -18.691  -7.788
  172    HA2  GLY  23           HA2      GLY  23  -3.956 -19.503  -8.532
  173    HA3  GLY  23           HA1      GLY  23  -4.534 -19.430 -10.193
  174    H    ARG  24           HN       ARG  24  -4.683 -16.777  -7.829
  175    HA   ARG  24           HA       ARG  24  -3.199 -15.086  -9.707
  176    HB2  ARG  24           HB2      ARG  24  -5.342 -14.357  -8.544
  177    HB3  ARG  24           HB1      ARG  24  -4.394 -14.257  -7.060
  178    HG2  ARG  24           HG2      ARG  24  -2.849 -12.675  -8.144
  179    HG3  ARG  24           HG1      ARG  24  -3.780 -12.785  -9.639
  180    HD2  ARG  24           HD2      ARG  24  -4.886 -11.836  -6.983
  181    HD3  ARG  24           HD1      ARG  24  -4.375 -10.776  -8.293
  182    HE   ARG  24           HE       ARG  24  -6.805 -12.364  -8.194
  183   HH11  ARG  24          1HH2      ARG  24  -4.501 -10.655 -10.129
  184   HH12  ARG  24          2HH2      ARG  24  -5.593 -10.402 -11.450
  185   HH21  ARG  24          1HH1      ARG  24  -8.241 -12.038  -9.922
  186   HH22  ARG  24          2HH1      ARG  24  -7.710 -11.185 -11.333
  187    H    LEU  25           HN       LEU  25  -1.183 -14.430  -9.452
  188    HA   LEU  25           HA       LEU  25   0.376 -15.402  -7.164
  189    HB2  LEU  25           HB2      LEU  25   1.075 -14.369  -9.908
  190    HB3  LEU  25           HB1      LEU  25   2.304 -14.573  -8.663
  191    HG   LEU  25           HG       LEU  25   2.084 -16.550 -10.187
  192   HD11  LEU  25          1HD1      LEU  25   2.660 -16.592  -7.575
  193   HD12  LEU  25          2HD1      LEU  25   2.512 -18.078  -8.509
  194   HD13  LEU  25          3HD1      LEU  25   1.172 -17.537  -7.504
  195   HD21  LEU  25          3HD2      LEU  25   0.132 -17.873 -10.260
  196   HD22  LEU  25          1HD2      LEU  25  -0.481 -16.222 -10.334
  197   HD23  LEU  25          2HD2      LEU  25  -0.544 -17.119  -8.816
  198    H    TRP  26           HN       TRP  26   2.073 -14.002  -6.261
  199    HA   TRP  26           HA       TRP  26   1.274 -11.141  -6.174
  200    HB2  TRP  26           HB2      TRP  26   2.185 -11.120  -3.849
  201    HB3  TRP  26           HB1      TRP  26   0.736 -12.104  -4.047
  202    HD1  TRP  26           HD1      TRP  26   0.965 -14.722  -3.861
  203    HE1  TRP  26           HE1      TRP  26   2.840 -16.250  -2.977
  204    HE3  TRP  26           HE3      TRP  26   4.821 -11.376  -3.681
  205    HZ2  TRP  26           HZ2      TRP  26   5.609 -16.081  -2.296
  206    HZ3  TRP  26           HZ3      TRP  26   7.063 -12.091  -2.917
  207    HH2  TRP  26           HH2      TRP  26   7.465 -14.437  -2.226
  208    H    ALA  27           HN       ALA  27   2.752  -9.704  -6.341
  209    HA   ALA  27           HA       ALA  27   5.577 -10.515  -6.700
  210    HB1  ALA  27           HB1      ALA  27   5.700  -8.372  -8.051
  211    HB2  ALA  27           HB2      ALA  27   3.940  -8.325  -7.994
  212    HB3  ALA  27           HB3      ALA  27   4.766  -9.668  -8.785
  213    H    PHE  28           HN       PHE  28   7.109  -8.858  -6.010
  214    HA   PHE  28           HA       PHE  28   6.293  -7.736  -3.478
  215    HB2  PHE  28           HB2      PHE  28   8.797  -7.501  -5.163
  216    HB3  PHE  28           HB1      PHE  28   8.627  -6.790  -3.568
  217    HD1  PHE  28           HD1      PHE  28   8.085  -8.341  -1.597
  218    HD2  PHE  28           HD2      PHE  28   9.418  -9.768  -5.421
  219    HE1  PHE  28           HE1      PHE  28   8.779 -10.482  -0.555
  220    HE2  PHE  28           HE2      PHE  28  10.111 -11.910  -4.381
  221    HZ   PHE  28           HZ       PHE  28   9.794 -12.266  -1.948
  222    H    CYS  29           HN       CYS  29   4.776  -6.203  -3.788
  223    HA   CYS  29           HA       CYS  29   5.466  -3.822  -5.401
  224    HB2  CYS  29           HB2      CYS  29   3.884  -5.498  -6.566
  225    HB3  CYS  29           HB1      CYS  29   2.693  -5.024  -5.356
  226    HG   CYS  29           HG       CYS  29   4.007  -2.913  -7.266
  227    H    CYS  30           HN       CYS  30   3.376  -2.251  -4.951
  228    HA   CYS  30           HA       CYS  30   2.135  -1.043  -3.428
  229    HB2  CYS  30           HB2      CYS  30   2.985  -2.799  -1.137
  230    HB3  CYS  30           HB1      CYS  30   1.470  -1.939  -1.383
  231    HG   CYS  30           HG       CYS  30   0.561  -3.884  -2.626
  Start of MODEL    6
    1    H1   ALA   1           HT1      ALA   1  -3.663   1.884  -2.308
    2    H2   ALA   1           HT2      ALA   1  -5.005   1.344  -1.417
    3    H3   ALA   1           HT3      ALA   1  -4.777   0.816  -3.015
    4    HA   ALA   1           HA       ALA   1  -2.451   0.119  -1.771
    5    HB1  ALA   1           HB1      ALA   1  -3.598   0.625   0.392
    6    HB2  ALA   1           HB2      ALA   1  -3.161  -1.077   0.238
    7    HB3  ALA   1           HB3      ALA   1  -4.830  -0.568  -0.017
    8    H    CYS   2           HN       CYS   2  -2.045  -2.070  -2.225
    9    HA   CYS   2           HA       CYS   2  -4.214  -3.772  -3.194
   10    HB2  CYS   2           HB2      CYS   2  -2.910  -4.182  -5.345
   11    HB3  CYS   2           HB1      CYS   2  -3.742  -2.631  -5.237
   12    HG   CYS   2           HG       CYS   2  -1.520  -1.431  -4.922
   13    H    TYR   3           HN       TYR   3  -3.772  -5.908  -2.858
   14    HA   TYR   3           HA       TYR   3  -0.977  -6.632  -2.131
   15    HB2  TYR   3           HB2      TYR   3  -3.468  -7.828  -0.910
   16    HB3  TYR   3           HB1      TYR   3  -1.803  -8.065  -0.405
   17    HD1  TYR   3           HD1      TYR   3  -0.485  -6.007   0.428
   18    HD2  TYR   3           HD2      TYR   3  -4.754  -6.072  -0.006
   19    HE1  TYR   3           HE1      TYR   3  -0.669  -4.090   1.987
   20    HE2  TYR   3           HE2      TYR   3  -4.941  -4.150   1.546
   21    HH   TYR   3           HH       TYR   3  -2.066  -2.799   3.154
   22    H    CYS   4           HN       CYS   4  -1.187  -7.059  -4.577
   23    HA   CYS   4           HA       CYS   4  -1.481  -9.905  -4.891
   24    HB2  CYS   4           HB2      CYS   4  -3.623  -8.255  -5.762
   25    HB3  CYS   4           HB1      CYS   4  -2.787  -8.793  -7.216
   26    HG   CYS   4           HG       CYS   4  -4.321 -10.618  -5.243
   27    H    ARG   5           HN       ARG   5  -0.773 -10.454  -7.296
   28    HA   ARG   5           HA       ARG   5   1.626  -8.785  -7.830
   29    HB2  ARG   5           HB2      ARG   5   1.921 -11.229  -7.529
   30    HB3  ARG   5           HB1      ARG   5   0.872 -11.501  -8.921
   31    HG2  ARG   5           HG2      ARG   5   2.432 -10.268 -10.342
   32    HG3  ARG   5           HG1      ARG   5   3.475  -9.965  -8.944
   33    HD2  ARG   5           HD2      ARG   5   4.313 -11.918 -10.130
   34    HD3  ARG   5           HD1      ARG   5   3.631 -12.434  -8.590
   35    HE   ARG   5           HE       ARG   5   1.656 -12.549 -10.640
   36   HH11  ARG   5          1HH2      ARG   5   4.472 -14.136  -9.389
   37   HH12  ARG   5          2HH2      ARG   5   4.048 -15.687 -10.030
   38   HH21  ARG   5          1HH1      ARG   5   1.101 -14.581 -11.478
   39   HH22  ARG   5          2HH1      ARG   5   2.141 -15.939 -11.211
   40    H    ILE   6           HN       ILE   6   1.225  -7.279  -9.206
   41    HA   ILE   6           HA       ILE   6  -0.543  -7.882 -11.475
   42    HB   ILE   6           HB       ILE   6  -0.125  -5.140 -11.546
   43   HG12  ILE   6          2HG1      ILE   6   0.988  -5.514  -9.219
   44   HG13  ILE   6          1HG1      ILE   6  -0.193  -4.223  -9.392
   45   HG21  ILE   6          1HG2      ILE   6  -2.441  -5.067 -10.414
   46   HG22  ILE   6          2HG2      ILE   6  -2.318  -6.825 -10.344
   47   HG23  ILE   6          3HG2      ILE   6  -2.292  -6.003 -11.904
   48   HD11  ILE   6          3HD1      ILE   6  -1.082  -6.963  -8.497
   49   HD12  ILE   6          1HD1      ILE   6  -1.862  -5.403  -8.253
   50   HD13  ILE   6          2HD1      ILE   6  -0.410  -5.808  -7.346
   51    HA   PRO   7           HA       PRO   7   2.827  -7.878 -14.212
   52    HB2  PRO   7           HB2      PRO   7   1.587  -5.491 -15.531
   53    HB3  PRO   7           HB1      PRO   7   2.194  -6.991 -16.261
   54    HG2  PRO   7           HG2      PRO   7  -0.392  -6.623 -15.975
   55    HG3  PRO   7           HG1      PRO   7   0.326  -8.206 -15.615
   56    HD2  PRO   7           HD2      PRO   7  -0.640  -6.098 -13.717
   57    HD3  PRO   7           HD1      PRO   7  -0.703  -7.874 -13.591
   58    H    ALA   8           HN       ALA   8   2.132  -5.257 -12.191
   59    HA   ALA   8           HA       ALA   8   4.819  -4.055 -12.616
   60    HB1  ALA   8           HB1      ALA   8   3.891  -1.915 -12.017
   61    HB2  ALA   8           HB2      ALA   8   2.317  -2.640 -11.689
   62    HB3  ALA   8           HB3      ALA   8   2.937  -2.584 -13.339
   63    H    CYS   9           HN       CYS   9   5.951  -4.877 -10.928
   64    HA   CYS   9           HA       CYS   9   6.016  -3.905  -8.451
   65    HB2  CYS   9           HB2      CYS   9   4.798  -5.748  -7.068
   66    HB3  CYS   9           HB1      CYS   9   3.835  -4.433  -7.733
   67    HG   CYS   9           HG       CYS   9   2.861  -6.000  -9.486
   68    H    ILE  10           HN       ILE  10   6.875  -6.037 -10.695
   69    HA   ILE  10           HA       ILE  10   7.881  -8.199  -9.169
   70    HB   ILE  10           HB       ILE  10   8.959  -7.127 -11.783
   71   HG12  ILE  10          2HG1      ILE  10   6.566  -7.477 -12.028
   72   HG13  ILE  10          1HG1      ILE  10   7.408  -8.807 -12.816
   73   HG21  ILE  10          1HG2      ILE  10   9.641  -9.482 -12.107
   74   HG22  ILE  10          2HG2      ILE  10   9.018  -9.873 -10.504
   75   HG23  ILE  10          3HG2      ILE  10  10.392  -8.779 -10.675
   76   HD11  ILE  10          3HD1      ILE  10   5.874  -8.811 -10.228
   77   HD12  ILE  10          1HD1      ILE  10   7.128 -10.019 -10.507
   78   HD13  ILE  10          2HD1      ILE  10   5.745  -9.916 -11.595
   79    H    ALA  11           HN       ALA  11   9.257  -5.132 -10.259
   80    HA   ALA  11           HA       ALA  11  11.702  -5.608  -8.669
   81    HB1  ALA  11           HB1      ALA  11  12.700  -3.867  -9.963
   82    HB2  ALA  11           HB2      ALA  11  11.137  -3.355 -10.598
   83    HB3  ALA  11           HB3      ALA  11  11.827  -4.899 -11.097
   84    H    GLY  12           HN       GLY  12  12.465  -3.965  -7.227
   85    HA2  GLY  12           HA2      GLY  12  12.293  -2.104  -5.822
   86    HA3  GLY  12           HA1      GLY  12  10.715  -1.749  -6.518
   87    H    GLU  13           HN       GLU  13  10.868  -4.975  -5.731
   88    HA   GLU  13           HA       GLU  13  10.229  -4.792  -2.924
   89    HB2  GLU  13           HB2      GLU  13   7.890  -5.510  -3.164
   90    HB3  GLU  13           HB1      GLU  13   8.150  -3.942  -3.932
   91    HG2  GLU  13           HG2      GLU  13   6.965  -5.097  -5.592
   92    HG3  GLU  13           HG1      GLU  13   8.629  -5.355  -6.088
   93    H    ARG  14           HN       ARG  14   9.020  -7.038  -2.372
   94    HA   ARG  14           HA       ARG  14  10.344  -9.220  -3.878
   95    HB2  ARG  14           HB2      ARG  14  10.301  -8.790  -0.889
   96    HB3  ARG  14           HB1      ARG  14  10.738 -10.321  -1.649
   97    HG2  ARG  14           HG2      ARG  14  12.547  -9.217  -2.882
   98    HG3  ARG  14           HG1      ARG  14  12.098  -7.664  -2.175
   99    HD2  ARG  14           HD2      ARG  14  12.563  -8.540   0.072
  100    HD3  ARG  14           HD1      ARG  14  12.989 -10.103  -0.618
  101    HE   ARG  14           HE       ARG  14  14.539  -7.947  -1.726
  102   HH11  ARG  14          1HH2      ARG  14  14.152 -10.112   0.942
  103   HH12  ARG  14          2HH2      ARG  14  15.832 -10.118   1.363
  104   HH21  ARG  14          1HH1      ARG  14  16.747  -7.950  -1.185
  105   HH22  ARG  14          2HH1      ARG  14  17.302  -8.893   0.157
  106    H    ARG  15           HN       ARG  15   9.292 -11.246  -3.770
  107    HA   ARG  15           HA       ARG  15   6.409 -11.033  -3.444
  108    HB2  ARG  15           HB2      ARG  15   7.402 -12.165  -5.414
  109    HB3  ARG  15           HB1      ARG  15   8.105 -13.372  -4.340
  110    HG2  ARG  15           HG2      ARG  15   5.809 -13.969  -3.555
  111    HG3  ARG  15           HG1      ARG  15   5.146 -12.815  -4.711
  112    HD2  ARG  15           HD2      ARG  15   6.929 -15.136  -5.464
  113    HD3  ARG  15           HD1      ARG  15   5.170 -15.167  -5.557
  114    HE   ARG  15           HE       ARG  15   6.049 -12.913  -6.969
  115   HH11  ARG  15          1HH2      ARG  15   6.259 -16.365  -7.076
  116   HH12  ARG  15          2HH2      ARG  15   6.414 -16.439  -8.799
  117   HH21  ARG  15          1HH1      ARG  15   6.258 -13.002  -9.228
  118   HH22  ARG  15          2HH1      ARG  15   6.413 -14.536 -10.018
  119    H    TYR  16           HN       TYR  16   5.850 -11.068  -1.314
  120    HA   TYR  16           HA       TYR  16   6.925 -13.226   0.398
  121    HB2  TYR  16           HB2      TYR  16   5.510 -10.626   0.994
  122    HB3  TYR  16           HB1      TYR  16   5.740 -11.877   2.215
  123    HD1  TYR  16           HD2      TYR  16   8.219 -12.856   2.328
  124    HD2  TYR  16           HD1      TYR  16   7.169  -8.978   0.805
  125    HE1  TYR  16           HE2      TYR  16  10.533 -12.069   2.735
  126    HE2  TYR  16           HE1      TYR  16   9.485  -8.190   1.217
  127    HH   TYR  16           HH       TYR  16  11.552  -9.506   3.177
  128    H    GLY  17           HN       GLY  17   3.951 -11.778   1.265
  129    HA2  GLY  17           HA2      GLY  17   2.570 -14.211   1.495
  130    HA3  GLY  17           HA1      GLY  17   1.818 -12.616   1.486
  131    H    THR  18           HN       THR  18   2.089 -15.511  -0.155
  132    HA   THR  18           HA       THR  18   1.379 -14.341  -2.768
  133    HB   THR  18           HB       THR  18   3.015 -15.911  -3.218
  134    HG1  THR  18           HG1      THR  18   1.620 -18.021  -3.452
  135   HG21  THR  18          3HG2      THR  18   3.165 -18.081  -1.962
  136   HG22  THR  18          1HG2      THR  18   1.845 -17.521  -0.936
  137   HG23  THR  18          2HG2      THR  18   3.382 -16.656  -0.946
  138    H    CYS  19           HN       CYS  19  -0.665 -14.273  -3.361
  139    HA   CYS  19           HA       CYS  19  -2.672 -15.892  -1.921
  140    HB2  CYS  19           HB2      CYS  19  -4.246 -14.232  -2.443
  141    HB3  CYS  19           HB1      CYS  19  -2.782 -13.306  -2.126
  142    HG   CYS  19           HG       CYS  19  -3.771 -12.448  -4.395
  143    H    ILE  20           HN       ILE  20  -3.772 -17.492  -2.955
  144    HA   ILE  20           HA       ILE  20  -3.011 -18.095  -5.705
  145    HB   ILE  20           HB       ILE  20  -5.041 -19.594  -4.045
  146   HG12  ILE  20          2HG1      ILE  20  -3.077 -19.384  -2.633
  147   HG13  ILE  20          1HG1      ILE  20  -3.106 -21.012  -3.307
  148   HG21  ILE  20          1HG2      ILE  20  -3.083 -20.437  -6.204
  149   HG22  ILE  20          2HG2      ILE  20  -4.807 -20.158  -6.448
  150   HG23  ILE  20          3HG2      ILE  20  -4.265 -21.481  -5.416
  151   HD11  ILE  20          3HD1      ILE  20  -1.370 -18.682  -4.145
  152   HD12  ILE  20          1HD1      ILE  20  -1.577 -20.108  -5.163
  153   HD13  ILE  20          2HD1      ILE  20  -0.859 -20.265  -3.562
  154    H    TYR  21           HN       TYR  21  -4.020 -17.118  -7.310
  155    HA   TYR  21           HA       TYR  21  -6.946 -17.024  -7.363
  156    HB2  TYR  21           HB2      TYR  21  -6.316 -14.872  -6.361
  157    HB3  TYR  21           HB1      TYR  21  -5.216 -14.559  -7.703
  158    HD1  TYR  21           HD2      TYR  21  -8.803 -15.238  -6.899
  159    HD2  TYR  21           HD1      TYR  21  -6.005 -13.572  -9.702
  160    HE1  TYR  21           HE2      TYR  21 -10.680 -14.288  -8.210
  161    HE2  TYR  21           HE1      TYR  21  -7.883 -12.621 -11.012
  162    HH   TYR  21           HH       TYR  21 -10.076 -12.311 -11.116
  163    H    GLN  22           HN       GLN  22  -7.415 -17.998  -9.231
  164    HA   GLN  22           HA       GLN  22  -7.247 -18.720 -11.415
  165    HB2  GLN  22           HB2      GLN  22  -6.410 -15.825 -11.660
  166    HB3  GLN  22           HB1      GLN  22  -6.748 -16.865 -13.044
  167    HG2  GLN  22           HG2      GLN  22  -9.024 -17.261 -12.215
  168    HG3  GLN  22           HG1      GLN  22  -8.693 -16.270 -10.796
  169   HE21  GLN  22          1HE2      GLN  22  -6.982 -14.577 -12.901
  170   HE22  GLN  22          2HE2      GLN  22  -8.168 -13.564 -13.570
  171    H    GLY  23           HN       GLY  23  -4.782 -18.802  -9.615
  172    HA2  GLY  23           HA2      GLY  23  -2.747 -19.905  -9.966
  173    HA3  GLY  23           HA1      GLY  23  -2.932 -19.656 -11.698
  174    H    ARG  24           HN       ARG  24  -3.251 -17.031  -9.387
  175    HA   ARG  24           HA       ARG  24  -0.630 -15.938 -10.278
  176    HB2  ARG  24           HB2      ARG  24  -3.275 -14.519  -9.922
  177    HB3  ARG  24           HB1      ARG  24  -1.733 -13.679 -10.085
  178    HG2  ARG  24           HG2      ARG  24  -1.355 -14.747 -12.260
  179    HG3  ARG  24           HG1      ARG  24  -2.863 -15.649 -12.094
  180    HD2  ARG  24           HD2      ARG  24  -4.126 -13.533 -12.027
  181    HD3  ARG  24           HD1      ARG  24  -2.623 -12.629 -12.186
  182    HE   ARG  24           HE       ARG  24  -2.697 -14.374 -14.343
  183   HH11  ARG  24          1HH2      ARG  24  -4.625 -11.822 -13.020
  184   HH12  ARG  24          2HH2      ARG  24  -5.234 -11.300 -14.556
  185   HH21  ARG  24          1HH1      ARG  24  -3.492 -13.695 -16.359
  186   HH22  ARG  24          2HH1      ARG  24  -4.592 -12.361 -16.446
  187    H    LEU  25           HN       LEU  25   0.729 -15.631  -8.658
  188    HA   LEU  25           HA       LEU  25  -0.120 -15.770  -5.896
  189    HB2  LEU  25           HB2      LEU  25   2.650 -15.036  -6.839
  190    HB3  LEU  25           HB1      LEU  25   2.174 -15.883  -5.374
  191    HG   LEU  25           HG       LEU  25   2.061 -16.938  -8.207
  192   HD11  LEU  25          1HD1      LEU  25   3.588 -17.797  -5.732
  193   HD12  LEU  25          2HD1      LEU  25   4.272 -17.025  -7.163
  194   HD13  LEU  25          3HD1      LEU  25   3.601 -18.653  -7.274
  195   HD21  LEU  25          3HD2      LEU  25   0.088 -17.773  -7.133
  196   HD22  LEU  25          1HD2      LEU  25   0.953 -18.067  -5.627
  197   HD23  LEU  25          2HD2      LEU  25   1.283 -19.068  -7.037
  198    H    TRP  26           HN       TRP  26   0.572 -14.111  -4.295
  199    HA   TRP  26           HA       TRP  26   0.105 -11.396  -5.338
  200    HB2  TRP  26           HB2      TRP  26  -1.371 -11.728  -3.542
  201    HB3  TRP  26           HB1      TRP  26  -0.223 -12.702  -2.656
  202    HD1  TRP  26           HD1      TRP  26   0.559  -9.202  -3.989
  203    HE1  TRP  26           HE1      TRP  26   1.056  -7.655  -1.982
  204    HE3  TRP  26           HE3      TRP  26  -0.616 -12.346  -0.157
  205    HZ2  TRP  26           HZ2      TRP  26   0.953  -7.751   0.879
  206    HZ3  TRP  26           HZ3      TRP  26  -0.425 -11.594   2.196
  207    HH2  TRP  26           HH2      TRP  26   0.355  -9.301   2.718
  208    H    ALA  27           HN       ALA  27   1.800 -10.197  -5.767
  209    HA   ALA  27           HA       ALA  27   4.338 -10.680  -4.354
  210    HB1  ALA  27           HB1      ALA  27   5.339  -9.253  -6.086
  211    HB2  ALA  27           HB2      ALA  27   3.744  -8.949  -6.772
  212    HB3  ALA  27           HB3      ALA  27   4.434 -10.572  -6.827
  213    H    PHE  28           HN       PHE  28   5.383  -8.877  -3.290
  214    HA   PHE  28           HA       PHE  28   3.433  -7.170  -2.030
  215    HB2  PHE  28           HB2      PHE  28   5.439  -8.117  -0.888
  216    HB3  PHE  28           HB1      PHE  28   6.453  -7.079  -1.888
  217    HD1  PHE  28           HD2      PHE  28   6.323  -4.611  -1.676
  218    HD2  PHE  28           HD1      PHE  28   4.172  -7.233   0.960
  219    HE1  PHE  28           HE2      PHE  28   6.002  -2.742  -0.081
  220    HE2  PHE  28           HE1      PHE  28   3.851  -5.361   2.557
  221    HZ   PHE  28           HZ       PHE  28   4.771  -3.117   2.038
  222    H    CYS  29           HN       CYS  29   2.539  -5.784  -3.370
  223    HA   CYS  29           HA       CYS  29   4.120  -4.190  -5.250
  224    HB2  CYS  29           HB2      CYS  29   1.134  -4.402  -4.818
  225    HB3  CYS  29           HB1      CYS  29   1.939  -3.594  -6.166
  226    HG   CYS  29           HG       CYS  29   3.011  -6.306  -6.219
  227    H    CYS  30           HN       CYS  30   4.245  -1.980  -5.179
  228    HA   CYS  30           HA       CYS  30   4.124   0.160  -4.354
  229    HB2  CYS  30           HB2      CYS  30   2.173  -0.655  -2.213
  230    HB3  CYS  30           HB1      CYS  30   2.276   0.856  -3.117
  231    HG   CYS  30           HG       CYS  30   1.476  -0.654  -5.257
  Start of MODEL    7
    1    H1   ALA   1           HT1      ALA   1  -2.575  -0.324   1.026
    2    H2   ALA   1           HT2      ALA   1  -0.915   0.029   1.097
    3    H3   ALA   1           HT3      ALA   1  -1.844   0.007   2.519
    4    HA   ALA   1           HA       ALA   1  -0.693  -2.009   2.560
    5    HB1  ALA   1           HB1      ALA   1  -3.208  -2.121   2.907
    6    HB2  ALA   1           HB2      ALA   1  -2.461  -3.640   2.409
    7    HB3  ALA   1           HB3      ALA   1  -3.339  -2.662   1.234
    8    H    CYS   2           HN       CYS   2  -0.729  -4.282   1.228
    9    HA   CYS   2           HA       CYS   2   0.484  -3.614  -1.383
   10    HB2  CYS   2           HB2      CYS   2   0.836  -5.850   0.578
   11    HB3  CYS   2           HB1      CYS   2   1.196  -6.157  -1.123
   12    HG   CYS   2           HG       CYS   2   3.080  -4.453  -1.058
   13    H    TYR   3           HN       TYR   3  -0.134  -4.506  -3.224
   14    HA   TYR   3           HA       TYR   3  -2.771  -5.791  -3.248
   15    HB2  TYR   3           HB2      TYR   3  -1.054  -4.581  -5.438
   16    HB3  TYR   3           HB1      TYR   3  -2.607  -5.375  -5.717
   17    HD1  TYR   3           HD2      TYR   3  -4.701  -4.408  -4.853
   18    HD2  TYR   3           HD1      TYR   3  -0.933  -2.413  -4.318
   19    HE1  TYR   3           HE2      TYR   3  -5.892  -2.329  -4.210
   20    HE2  TYR   3           HE1      TYR   3  -2.126  -0.336  -3.672
   21    HH   TYR   3           HH       TYR   3  -4.123   0.534  -3.094
   22    H    CYS   4           HN       CYS   4  -2.635  -7.304  -5.430
   23    HA   CYS   4           HA       CYS   4  -0.965  -9.517  -4.566
   24    HB2  CYS   4           HB2      CYS   4  -3.449  -9.587  -5.239
   25    HB3  CYS   4           HB1      CYS   4  -2.852  -9.516  -6.896
   26    HG   CYS   4           HG       CYS   4  -2.277 -11.912  -6.728
   27    H    ARG   5           HN       ARG   5  -0.198 -10.863  -6.761
   28    HA   ARG   5           HA       ARG   5   1.715  -8.996  -8.000
   29    HB2  ARG   5           HB2      ARG   5   2.494 -11.187  -7.030
   30    HB3  ARG   5           HB1      ARG   5   1.588 -11.998  -8.299
   31    HG2  ARG   5           HG2      ARG   5   2.905 -10.766 -10.008
   32    HG3  ARG   5           HG1      ARG   5   3.883 -10.075  -8.708
   33    HD2  ARG   5           HD2      ARG   5   4.364 -12.398  -7.921
   34    HD3  ARG   5           HD1      ARG   5   3.522 -13.011  -9.338
   35    HE   ARG   5           HE       ARG   5   5.623 -11.181 -10.044
   36   HH11  ARG   5          1HH2      ARG   5   4.805 -14.397  -9.094
   37   HH12  ARG   5          2HH2      ARG   5   6.225 -15.120  -9.770
   38   HH21  ARG   5          1HH1      ARG   5   7.511 -12.123 -10.951
   39   HH22  ARG   5          2HH1      ARG   5   7.761 -13.832 -10.820
   40    H    ILE   6           HN       ILE   6   1.078  -8.079  -9.684
   41    HA   ILE   6           HA       ILE   6  -0.216  -9.575 -11.866
   42    HB   ILE   6           HB       ILE   6  -1.083  -7.162 -12.447
   43   HG12  ILE   6          2HG1      ILE   6   0.322  -6.352 -10.315
   44   HG13  ILE   6          1HG1      ILE   6  -1.195  -5.580 -10.748
   45   HG21  ILE   6          1HG2      ILE   6  -2.685  -8.855 -12.030
   46   HG22  ILE   6          2HG2      ILE   6  -3.097  -7.568 -10.899
   47   HG23  ILE   6          3HG2      ILE   6  -2.228  -8.997 -10.333
   48   HD11  ILE   6          3HD1      ILE   6  -2.387  -6.701  -9.053
   49   HD12  ILE   6          1HD1      ILE   6  -0.864  -6.254  -8.292
   50   HD13  ILE   6          2HD1      ILE   6  -1.128  -7.911  -8.837
   51    HA   PRO   7           HA       PRO   7   3.752  -8.411 -13.579
   52    HB2  PRO   7           HB2      PRO   7   2.213  -7.992 -16.114
   53    HB3  PRO   7           HB1      PRO   7   3.717  -8.895 -15.844
   54    HG2  PRO   7           HG2      PRO   7   1.376 -10.144 -16.181
   55    HG3  PRO   7           HG1      PRO   7   2.616 -10.764 -15.074
   56    HD2  PRO   7           HD2      PRO   7   0.027  -9.418 -14.427
   57    HD3  PRO   7           HD1      PRO   7   0.966 -10.595 -13.477
   58    H    ALA   8           HN       ALA   8   3.959  -6.542 -12.459
   59    HA   ALA   8           HA       ALA   8   3.482  -4.034 -13.864
   60    HB1  ALA   8           HB1      ALA   8   2.249  -3.018 -12.064
   61    HB2  ALA   8           HB2      ALA   8   2.464  -4.438 -11.042
   62    HB3  ALA   8           HB3      ALA   8   1.421  -4.525 -12.461
   63    H    CYS   9           HN       CYS   9   4.113  -2.348 -11.732
   64    HA   CYS   9           HA       CYS   9   6.901  -2.432 -11.648
   65    HB2  CYS   9           HB2      CYS   9   6.714  -0.821  -9.787
   66    HB3  CYS   9           HB1      CYS   9   5.592  -0.423 -11.090
   67    HG   CYS   9           HG       CYS   9   4.523  -2.097  -8.690
   68    H    ILE  10           HN       ILE  10   7.166  -4.784 -11.207
   69    HA   ILE  10           HA       ILE  10   6.514  -5.862  -8.661
   70    HB   ILE  10           HB       ILE  10   6.997  -7.124 -10.842
   71   HG12  ILE  10          2HG1      ILE  10   8.139  -9.012  -9.549
   72   HG13  ILE  10          1HG1      ILE  10   8.237  -7.901  -8.185
   73   HG21  ILE  10          1HG2      ILE  10   9.858  -6.924  -9.889
   74   HG22  ILE  10          2HG2      ILE  10   9.209  -5.896 -11.166
   75   HG23  ILE  10          3HG2      ILE  10   9.261  -7.646 -11.383
   76   HD11  ILE  10          3HD1      ILE  10   5.557  -8.269  -9.500
   77   HD12  ILE  10          1HD1      ILE  10   5.948  -7.937  -7.812
   78   HD13  ILE  10          2HD1      ILE  10   6.167  -9.557  -8.465
   79    H    ALA  11           HN       ALA  11   9.405  -4.359 -10.019
   80    HA   ALA  11           HA       ALA  11  11.179  -4.875  -7.902
   81    HB1  ALA  11           HB1      ALA  11  11.787  -3.952 -10.165
   82    HB2  ALA  11           HB2      ALA  11  12.533  -3.107  -8.809
   83    HB3  ALA  11           HB3      ALA  11  11.147  -2.397  -9.636
   84    H    GLY  12           HN       GLY  12  12.111  -3.017  -6.534
   85    HA2  GLY  12           HA2      GLY  12  11.781  -1.122  -5.152
   86    HA3  GLY  12           HA1      GLY  12  10.059  -1.165  -5.524
   87    H    GLU  13           HN       GLU  13  10.108  -4.150  -5.069
   88    HA   GLU  13           HA       GLU  13  10.745  -4.521  -2.288
   89    HB2  GLU  13           HB2      GLU  13   8.566  -3.165  -2.323
   90    HB3  GLU  13           HB1      GLU  13   7.810  -4.609  -2.992
   91    HG2  GLU  13           HG2      GLU  13   7.503  -4.687  -0.606
   92    HG3  GLU  13           HG1      GLU  13   8.721  -5.891  -1.010
   93    H    ARG  14           HN       ARG  14  10.425  -6.721  -1.614
   94    HA   ARG  14           HA       ARG  14  10.221  -8.598  -3.892
   95    HB2  ARG  14           HB2      ARG  14  11.453  -8.896  -1.147
   96    HB3  ARG  14           HB1      ARG  14  11.334 -10.197  -2.331
   97    HG2  ARG  14           HG2      ARG  14  12.639  -8.859  -3.939
   98    HG3  ARG  14           HG1      ARG  14  12.761  -7.556  -2.756
   99    HD2  ARG  14           HD2      ARG  14  13.771 -10.376  -2.300
  100    HD3  ARG  14           HD1      ARG  14  14.785  -9.027  -2.807
  101    HE   ARG  14           HE       ARG  14  13.678  -9.468  -0.156
  102   HH11  ARG  14          1HH2      ARG  14  15.048  -7.254  -2.434
  103   HH12  ARG  14          2HH2      ARG  14  15.577  -6.126  -1.231
  104   HH21  ARG  14          1HH1      ARG  14  14.367  -7.993   1.429
  105   HH22  ARG  14          2HH1      ARG  14  15.191  -6.545   0.957
  106    H    ARG  15           HN       ARG  15   9.091 -10.576  -3.623
  107    HA   ARG  15           HA       ARG  15   6.632 -10.264  -2.087
  108    HB2  ARG  15           HB2      ARG  15   5.874 -12.225  -3.336
  109    HB3  ARG  15           HB1      ARG  15   6.538 -11.010  -4.430
  110    HG2  ARG  15           HG2      ARG  15   8.670 -12.245  -4.509
  111    HG3  ARG  15           HG1      ARG  15   8.006 -13.464  -3.418
  112    HD2  ARG  15           HD2      ARG  15   6.236 -13.979  -5.038
  113    HD3  ARG  15           HD1      ARG  15   6.860 -12.741  -6.124
  114    HE   ARG  15           HE       ARG  15   8.633 -14.167  -6.687
  115   HH11  ARG  15          1HH2      ARG  15   6.756 -15.401  -4.051
  116   HH12  ARG  15          2HH2      ARG  15   7.452 -16.986  -4.120
  117   HH21  ARG  15          1HH1      ARG  15   9.546 -16.239  -6.783
  118   HH22  ARG  15          2HH1      ARG  15   9.031 -17.461  -5.668
  119    H    TYR  16           HN       TYR  16   5.988 -11.518  -0.408
  120    HA   TYR  16           HA       TYR  16   8.006 -13.348   0.764
  121    HB2  TYR  16           HB2      TYR  16   5.746 -11.783   2.034
  122    HB3  TYR  16           HB1      TYR  16   6.752 -12.953   2.889
  123    HD1  TYR  16           HD1      TYR  16   9.232 -12.572   3.062
  124    HD2  TYR  16           HD2      TYR  16   6.544  -9.583   1.547
  125    HE1  TYR  16           HE1      TYR  16  10.969 -10.835   3.406
  126    HE2  TYR  16           HE2      TYR  16   8.281  -7.846   1.892
  127    HH   TYR  16           HH       TYR  16  10.824  -8.147   3.807
  128    H    GLY  17           HN       GLY  17   4.467 -12.939   0.871
  129    HA2  GLY  17           HA2      GLY  17   4.140 -15.873   0.837
  130    HA3  GLY  17           HA1      GLY  17   2.919 -14.695   1.315
  131    H    THR  18           HN       THR  18   2.268 -16.689  -0.470
  132    HA   THR  18           HA       THR  18   1.785 -15.126  -2.934
  133    HB   THR  18           HB       THR  18   3.491 -16.537  -3.700
  134    HG1  THR  18           HG1      THR  18   1.035 -16.966  -4.433
  135   HG21  THR  18          3HG2      THR  18   3.877 -17.940  -1.818
  136   HG22  THR  18          1HG2      THR  18   3.429 -19.033  -3.128
  137   HG23  THR  18          2HG2      THR  18   2.249 -18.611  -1.888
  138    H    CYS  19           HN       CYS  19  -0.300 -15.013  -3.368
  139    HA   CYS  19           HA       CYS  19  -2.152 -16.957  -2.126
  140    HB2  CYS  19           HB2      CYS  19  -3.845 -15.314  -2.326
  141    HB3  CYS  19           HB1      CYS  19  -2.418 -14.424  -1.800
  142    HG   CYS  19           HG       CYS  19  -3.640 -14.314  -4.661
  143    H    ILE  20           HN       ILE  20  -3.209 -18.412  -3.370
  144    HA   ILE  20           HA       ILE  20  -2.763 -18.296  -6.282
  145    HB   ILE  20           HB       ILE  20  -4.100 -20.540  -4.768
  146   HG12  ILE  20          2HG1      ILE  20  -2.009 -20.148  -3.598
  147   HG13  ILE  20          1HG1      ILE  20  -1.809 -21.563  -4.627
  148   HG21  ILE  20          1HG2      ILE  20  -3.304 -21.874  -6.630
  149   HG22  ILE  20          2HG2      ILE  20  -2.374 -20.515  -7.263
  150   HG23  ILE  20          3HG2      ILE  20  -4.137 -20.462  -7.280
  151   HD11  ILE  20          3HD1      ILE  20   0.152 -20.236  -4.952
  152   HD12  ILE  20          1HD1      ILE  20  -0.791 -18.756  -5.119
  153   HD13  ILE  20          2HD1      ILE  20  -0.838 -19.981  -6.388
  154    H    TYR  21           HN       TYR  21  -4.249 -17.344  -7.477
  155    HA   TYR  21           HA       TYR  21  -7.028 -18.019  -7.275
  156    HB2  TYR  21           HB2      TYR  21  -6.913 -16.392  -5.440
  157    HB3  TYR  21           HB1      TYR  21  -6.187 -15.208  -6.528
  158    HD1  TYR  21           HD2      TYR  21  -9.229 -17.320  -6.039
  159    HD2  TYR  21           HD1      TYR  21  -7.546 -13.826  -7.888
  160    HE1  TYR  21           HE2      TYR  21 -11.490 -16.620  -6.776
  161    HE2  TYR  21           HE1      TYR  21  -9.809 -13.127  -8.625
  162    HH   TYR  21           HH       TYR  21 -12.059 -13.482  -8.235
  163    H    GLN  22           HN       GLN  22  -7.805 -17.965  -9.287
  164    HA   GLN  22           HA       GLN  22  -7.959 -17.538 -11.544
  165    HB2  GLN  22           HB2      GLN  22  -8.521 -15.275 -10.446
  166    HB3  GLN  22           HB1      GLN  22  -6.890 -14.791 -10.903
  167    HG2  GLN  22           HG2      GLN  22  -7.369 -15.175 -13.250
  168    HG3  GLN  22           HG1      GLN  22  -8.939 -15.871 -12.858
  169   HE21  GLN  22          1HE2      GLN  22  -8.731 -13.607 -14.585
  170   HE22  GLN  22          2HE2      GLN  22  -9.402 -12.265 -13.789
  171    H    GLY  23           HN       GLY  23  -5.233 -18.102 -10.084
  172    HA2  GLY  23           HA2      GLY  23  -3.226 -18.870 -10.986
  173    HA3  GLY  23           HA1      GLY  23  -3.673 -18.163 -12.533
  174    H    ARG  24           HN       ARG  24  -3.804 -16.251  -9.612
  175    HA   ARG  24           HA       ARG  24  -1.390 -14.752 -10.491
  176    HB2  ARG  24           HB2      ARG  24  -3.945 -13.744  -9.216
  177    HB3  ARG  24           HB1      ARG  24  -2.501 -12.760  -9.471
  178    HG2  ARG  24           HG2      ARG  24  -2.618 -13.179 -11.891
  179    HG3  ARG  24           HG1      ARG  24  -4.033 -14.205 -11.656
  180    HD2  ARG  24           HD2      ARG  24  -3.920 -11.294 -10.833
  181    HD3  ARG  24           HD1      ARG  24  -4.575 -11.849 -12.370
  182    HE   ARG  24           HE       ARG  24  -5.843 -13.297 -10.327
  183   HH11  ARG  24          1HH2      ARG  24  -5.539 -10.058 -11.509
  184   HH12  ARG  24          2HH2      ARG  24  -7.112  -9.569 -10.972
  185   HH21  ARG  24          1HH1      ARG  24  -7.905 -12.661  -9.622
  186   HH22  ARG  24          2HH1      ARG  24  -8.451 -11.042  -9.904
  187    H    LEU  25           HN       LEU  25   0.147 -14.320  -9.024
  188    HA   LEU  25           HA       LEU  25  -0.095 -15.533  -6.353
  189    HB2  LEU  25           HB2      LEU  25   2.380 -14.389  -7.662
  190    HB3  LEU  25           HB1      LEU  25   2.295 -15.473  -6.281
  191    HG   LEU  25           HG       LEU  25   2.900 -16.823  -8.160
  192   HD11  LEU  25          1HD1      LEU  25  -0.072 -17.270  -7.921
  193   HD12  LEU  25          2HD1      LEU  25   1.027 -17.603  -6.585
  194   HD13  LEU  25          3HD1      LEU  25   1.208 -18.468  -8.108
  195   HD21  LEU  25          3HD2      LEU  25   1.687 -14.976  -9.771
  196   HD22  LEU  25          1HD2      LEU  25   0.471 -16.257  -9.804
  197   HD23  LEU  25          2HD2      LEU  25   2.123 -16.596 -10.304
  198    H    TRP  26           HN       TRP  26   0.946 -14.321  -4.498
  199    HA   TRP  26           HA       TRP  26   0.149 -11.480  -4.644
  200    HB2  TRP  26           HB2      TRP  26  -0.875 -12.809  -2.851
  201    HB3  TRP  26           HB1      TRP  26   0.723 -13.196  -2.234
  202    HD1  TRP  26           HD1      TRP  26   2.202 -11.092  -1.306
  203    HE1  TRP  26           HE1      TRP  26   1.403  -8.950  -0.115
  204    HE3  TRP  26           HE3      TRP  26  -2.713 -11.100  -2.681
  205    HZ2  TRP  26           HZ2      TRP  26  -1.003  -7.450   0.223
  206    HZ3  TRP  26           HZ3      TRP  26  -4.238  -9.305  -1.909
  207    HH2  TRP  26           HH2      TRP  26  -3.392  -7.479  -0.461
  208    H    ALA  27           HN       ALA  27   1.747 -10.206  -5.193
  209    HA   ALA  27           HA       ALA  27   4.367 -10.562  -3.850
  210    HB1  ALA  27           HB1      ALA  27   3.748  -9.279  -6.527
  211    HB2  ALA  27           HB2      ALA  27   4.653 -10.775  -6.270
  212    HB3  ALA  27           HB3      ALA  27   5.322  -9.235  -5.732
  213    H    PHE  28           HN       PHE  28   5.265  -8.696  -2.932
  214    HA   PHE  28           HA       PHE  28   3.253  -6.790  -2.101
  215    HB2  PHE  28           HB2      PHE  28   6.178  -7.235  -1.513
  216    HB3  PHE  28           HB1      PHE  28   5.380  -5.748  -1.002
  217    HD1  PHE  28           HD1      PHE  28   4.568  -9.425  -1.049
  218    HD2  PHE  28           HD2      PHE  28   4.608  -5.767   1.209
  219    HE1  PHE  28           HE1      PHE  28   3.620 -10.617   0.906
  220    HE2  PHE  28           HE2      PHE  28   3.655  -6.963   3.161
  221    HZ   PHE  28           HZ       PHE  28   3.160  -9.388   3.007
  222    H    CYS  29           HN       CYS  29   2.607  -5.554  -3.716
  223    HA   CYS  29           HA       CYS  29   4.606  -4.027  -5.287
  224    HB2  CYS  29           HB2      CYS  29   3.060  -5.732  -6.463
  225    HB3  CYS  29           HB1      CYS  29   1.760  -4.588  -6.123
  226    HG   CYS  29           HG       CYS  29   3.221  -2.768  -7.473
  227    H    CYS  30           HN       CYS  30   4.646  -1.933  -4.856
  228    HA   CYS  30           HA       CYS  30   2.539  -0.162  -4.733
  229    HB2  CYS  30           HB2      CYS  30   2.644   0.203  -2.107
  230    HB3  CYS  30           HB1      CYS  30   1.546  -0.990  -2.796
  231    HG   CYS  30           HG       CYS  30   3.013  -2.084  -0.857
  Start of MODEL    8
    1    H1   ALA   1           HT1      ALA   1  -2.134   0.206  -0.042
    2    H2   ALA   1           HT2      ALA   1  -2.658   0.541   1.540
    3    H3   ALA   1           HT3      ALA   1  -3.733  -0.133   0.410
    4    HA   ALA   1           HA       ALA   1  -1.779  -1.415   2.084
    5    HB1  ALA   1           HB1      ALA   1  -3.304  -3.268   1.854
    6    HB2  ALA   1           HB2      ALA   1  -4.052  -2.544   0.430
    7    HB3  ALA   1           HB3      ALA   1  -4.279  -1.807   2.016
    8    H    CYS   2           HN       CYS   2  -1.465  -3.857   1.049
    9    HA   CYS   2           HA       CYS   2   0.232  -3.362  -1.311
   10    HB2  CYS   2           HB2      CYS   2   0.226  -5.578   0.744
   11    HB3  CYS   2           HB1      CYS   2   1.242  -5.576  -0.698
   12    HG   CYS   2           HG       CYS   2   1.737  -3.916   1.805
   13    H    TYR   3           HN       TYR   3  -0.271  -4.126  -3.217
   14    HA   TYR   3           HA       TYR   3  -2.603  -5.879  -3.510
   15    HB2  TYR   3           HB2      TYR   3  -0.959  -4.323  -5.523
   16    HB3  TYR   3           HB1      TYR   3  -2.336  -5.346  -5.938
   17    HD1  TYR   3           HD1      TYR   3  -1.271  -2.263  -4.203
   18    HD2  TYR   3           HD2      TYR   3  -4.605  -4.693  -5.398
   19    HE1  TYR   3           HE1      TYR   3  -2.822  -0.408  -3.651
   20    HE2  TYR   3           HE2      TYR   3  -6.155  -2.838  -4.847
   21    HH   TYR   3           HH       TYR   3  -5.082   0.016  -3.167
   22    H    CYS   4           HN       CYS   4  -2.511  -7.796  -4.752
   23    HA   CYS   4           HA       CYS   4   0.030  -9.212  -4.490
   24    HB2  CYS   4           HB2      CYS   4  -2.502 -10.392  -5.617
   25    HB3  CYS   4           HB1      CYS   4  -1.215 -11.185  -4.706
   26    HG   CYS   4           HG       CYS   4  -3.522  -9.523  -3.486
   27    H    ARG   5           HN       ARG   5   1.066 -10.256  -6.252
   28    HA   ARG   5           HA       ARG   5   0.301  -9.267  -8.942
   29    HB2  ARG   5           HB2      ARG   5   2.436  -8.304  -7.546
   30    HB3  ARG   5           HB1      ARG   5   3.213  -9.619  -8.420
   31    HG2  ARG   5           HG2      ARG   5   3.422  -7.856  -9.939
   32    HG3  ARG   5           HG1      ARG   5   1.934  -8.619 -10.495
   33    HD2  ARG   5           HD2      ARG   5   0.617  -6.986  -9.170
   34    HD3  ARG   5           HD1      ARG   5   2.114  -6.221  -8.649
   35    HE   ARG   5           HE       ARG   5   2.291  -6.154 -11.363
   36   HH11  ARG   5          1HH2      ARG   5  -0.133  -5.260  -9.066
   37   HH12  ARG   5          2HH2      ARG   5  -0.758  -3.961 -10.026
   38   HH21  ARG   5          1HH1      ARG   5   1.494  -4.452 -12.620
   39   HH22  ARG   5          2HH1      ARG   5   0.167  -3.501 -12.042
   40    H    ILE   6           HN       ILE   6   1.611 -10.364 -10.610
   41    HA   ILE   6           HA       ILE   6   1.549 -13.267 -10.150
   42    HB   ILE   6           HB       ILE   6   1.885 -12.967 -12.845
   43   HG12  ILE   6          2HG1      ILE   6   0.092 -10.655 -12.108
   44   HG13  ILE   6          1HG1      ILE   6   1.818 -10.430 -12.400
   45   HG21  ILE   6          1HG2      ILE   6  -0.769 -12.749 -11.395
   46   HG22  ILE   6          2HG2      ILE   6   0.085 -14.254 -11.737
   47   HG23  ILE   6          3HG2      ILE   6  -0.545 -13.275 -13.062
   48   HD11  ILE   6          3HD1      ILE   6   0.437 -10.075 -14.437
   49   HD12  ILE   6          1HD1      ILE   6  -0.080 -11.757 -14.339
   50   HD13  ILE   6          2HD1      ILE   6   1.618 -11.372 -14.620
   51    HA   PRO   7           HA       PRO   7   5.920 -13.679 -10.169
   52    HB2  PRO   7           HB2      PRO   7   5.742 -14.896 -12.901
   53    HB3  PRO   7           HB1      PRO   7   6.665 -15.441 -11.482
   54    HG2  PRO   7           HG2      PRO   7   4.425 -16.635 -12.041
   55    HG3  PRO   7           HG1      PRO   7   4.742 -16.154 -10.363
   56    HD2  PRO   7           HD2      PRO   7   2.942 -14.869 -12.383
   57    HD3  PRO   7           HD1      PRO   7   2.687 -15.115 -10.641
   58    H    ALA   8           HN       ALA   8   5.815 -11.336 -10.403
   59    HA   ALA   8           HA       ALA   8   7.829 -10.402 -12.131
   60    HB1  ALA   8           HB1      ALA   8   5.937 -10.586 -13.761
   61    HB2  ALA   8           HB2      ALA   8   6.537  -8.943 -13.563
   62    HB3  ALA   8           HB3      ALA   8   5.033  -9.440 -12.778
   63    H    CYS   9           HN       CYS   9   8.760  -9.190 -10.525
   64    HA   CYS   9           HA       CYS   9   7.145  -7.874  -8.553
   65    HB2  CYS   9           HB2      CYS   9  10.070  -7.987  -9.173
   66    HB3  CYS   9           HB1      CYS   9   9.476  -6.700  -8.121
   67    HG   CYS   9           HG       CYS   9   8.488  -9.492  -7.316
   68    H    ILE  10           HN       ILE  10   5.835  -6.989 -10.313
   69    HA   ILE  10           HA       ILE  10   6.744  -4.879 -11.956
   70    HB   ILE  10           HB       ILE  10   3.985  -5.675 -11.014
   71   HG12  ILE  10          2HG1      ILE  10   5.211  -6.128 -13.739
   72   HG13  ILE  10          1HG1      ILE  10   5.517  -7.245 -12.418
   73   HG21  ILE  10          1HG2      ILE  10   4.911  -3.708 -13.121
   74   HG22  ILE  10          2HG2      ILE  10   3.839  -3.399 -11.756
   75   HG23  ILE  10          3HG2      ILE  10   3.285  -4.392 -13.102
   76   HD11  ILE  10          3HD1      ILE  10   2.691  -6.454 -13.083
   77   HD12  ILE  10          1HD1      ILE  10   3.273  -7.910 -12.277
   78   HD13  ILE  10          2HD1      ILE  10   3.501  -7.713 -14.013
   79    H    ALA  11           HN       ALA  11   5.765  -5.066  -8.648
   80    HA   ALA  11           HA       ALA  11   5.165  -2.234  -8.392
   81    HB1  ALA  11           HB1      ALA  11   4.490  -2.734  -6.217
   82    HB2  ALA  11           HB2      ALA  11   5.614  -4.084  -6.068
   83    HB3  ALA  11           HB3      ALA  11   4.170  -4.251  -7.057
   84    H    GLY  12           HN       GLY  12   7.756  -4.458  -7.396
   85    HA2  GLY  12           HA2      GLY  12  10.073  -3.691  -7.502
   86    HA3  GLY  12           HA1      GLY  12   9.528  -2.115  -6.933
   87    H    GLU  13           HN       GLU  13   8.629  -5.336  -5.760
   88    HA   GLU  13           HA       GLU  13  10.146  -4.966  -3.284
   89    HB2  GLU  13           HB2      GLU  13   8.223  -5.302  -1.847
   90    HB3  GLU  13           HB1      GLU  13   7.946  -3.892  -2.868
   91    HG2  GLU  13           HG2      GLU  13   6.677  -5.373  -4.447
   92    HG3  GLU  13           HG1      GLU  13   6.830  -6.675  -3.272
   93    H    ARG  14           HN       ARG  14   9.309  -7.045  -1.806
   94    HA   ARG  14           HA       ARG  14   9.997  -9.351  -3.520
   95    HB2  ARG  14           HB2      ARG  14  10.081  -8.953  -0.525
   96    HB3  ARG  14           HB1      ARG  14  10.544 -10.438  -1.357
   97    HG2  ARG  14           HG2      ARG  14  12.279  -9.236  -2.597
   98    HG3  ARG  14           HG1      ARG  14  11.794  -7.719  -1.837
   99    HD2  ARG  14           HD2      ARG  14  12.743 -10.152  -0.304
  100    HD3  ARG  14           HD1      ARG  14  13.783  -8.799  -0.746
  101    HE   ARG  14           HE       ARG  14  11.834  -8.839   1.374
  102   HH11  ARG  14          1HH2      ARG  14  13.491  -6.894  -0.960
  103   HH12  ARG  14          2HH2      ARG  14  13.307  -5.421  -0.068
  104   HH21  ARG  14          1HH1      ARG  14  11.585  -6.910   2.549
  105   HH22  ARG  14          2HH1      ARG  14  12.226  -5.429   1.920
  106    H    ARG  15           HN       ARG  15   8.894 -11.301  -3.433
  107    HA   ARG  15           HA       ARG  15   6.072 -11.108  -2.693
  108    HB2  ARG  15           HB2      ARG  15   5.846 -13.231  -3.927
  109    HB3  ARG  15           HB1      ARG  15   6.607 -11.985  -4.917
  110    HG2  ARG  15           HG2      ARG  15   8.846 -12.945  -4.248
  111    HG3  ARG  15           HG1      ARG  15   7.979 -14.273  -3.477
  112    HD2  ARG  15           HD2      ARG  15   6.896 -14.814  -5.630
  113    HD3  ARG  15           HD1      ARG  15   7.795 -13.510  -6.395
  114    HE   ARG  15           HE       ARG  15   9.758 -14.798  -6.250
  115   HH11  ARG  15          1HH2      ARG  15   7.047 -16.328  -4.716
  116   HH12  ARG  15          2HH2      ARG  15   7.832 -17.864  -4.567
  117   HH21  ARG  15          1HH1      ARG  15  10.783 -16.805  -6.043
  118   HH22  ARG  15          2HH1      ARG  15   9.944 -18.134  -5.315
  119    H    TYR  16           HN       TYR  16   5.251 -12.038  -0.907
  120    HA   TYR  16           HA       TYR  16   6.603 -14.321   0.338
  121    HB2  TYR  16           HB2      TYR  16   7.628 -12.374   1.431
  122    HB3  TYR  16           HB1      TYR  16   6.027 -11.746   1.829
  123    HD1  TYR  16           HD1      TYR  16   8.289 -14.676   2.335
  124    HD2  TYR  16           HD2      TYR  16   4.872 -12.496   3.760
  125    HE1  TYR  16           HE1      TYR  16   8.250 -16.074   4.384
  126    HE2  TYR  16           HE2      TYR  16   4.834 -13.894   5.808
  127    HH   TYR  16           HH       TYR  16   5.602 -15.971   6.629
  128    H    GLY  17           HN       GLY  17   4.143 -11.983   1.409
  129    HA2  GLY  17           HA2      GLY  17   2.297 -14.176   1.997
  130    HA3  GLY  17           HA1      GLY  17   2.077 -12.475   2.408
  131    H    THR  18           HN       THR  18   1.997 -14.796  -0.261
  132    HA   THR  18           HA       THR  18   0.323 -12.910  -1.825
  133    HB   THR  18           HB       THR  18   2.555 -13.871  -2.761
  134    HG1  THR  18           HG1      THR  18   1.699 -13.611  -4.710
  135   HG21  THR  18          3HG2      THR  18   2.527 -16.066  -3.651
  136   HG22  THR  18          1HG2      THR  18   0.785 -16.220  -3.433
  137   HG23  THR  18          2HG2      THR  18   1.855 -16.242  -2.031
  138    H    CYS  19           HN       CYS  19  -1.438 -13.788  -3.019
  139    HA   CYS  19           HA       CYS  19  -2.828 -15.950  -1.563
  140    HB2  CYS  19           HB2      CYS  19  -4.750 -14.903  -3.133
  141    HB3  CYS  19           HB1      CYS  19  -4.314 -14.176  -1.587
  142    HG   CYS  19           HG       CYS  19  -3.610 -13.022  -4.364
  143    H    ILE  20           HN       ILE  20  -3.773 -17.679  -2.707
  144    HA   ILE  20           HA       ILE  20  -2.432 -18.294  -5.250
  145    HB   ILE  20           HB       ILE  20  -4.235 -20.112  -3.654
  146   HG12  ILE  20          2HG1      ILE  20  -2.546 -19.335  -2.101
  147   HG13  ILE  20          1HG1      ILE  20  -2.103 -20.960  -2.620
  148   HG21  ILE  20          1HG2      ILE  20  -1.939 -20.606  -5.574
  149   HG22  ILE  20          2HG2      ILE  20  -3.651 -20.814  -5.943
  150   HG23  ILE  20          3HG2      ILE  20  -2.873 -21.856  -4.751
  151   HD11  ILE  20          3HD1      ILE  20  -0.897 -18.329  -3.482
  152   HD12  ILE  20          1HD1      ILE  20  -0.668 -19.800  -4.426
  153   HD13  ILE  20          2HD1      ILE  20  -0.087 -19.720  -2.765
  154    H    TYR  21           HN       TYR  21  -3.417 -17.876  -7.085
  155    HA   TYR  21           HA       TYR  21  -6.361 -18.151  -7.275
  156    HB2  TYR  21           HB2      TYR  21  -4.607 -15.870  -8.190
  157    HB3  TYR  21           HB1      TYR  21  -6.138 -16.210  -8.997
  158    HD1  TYR  21           HD1      TYR  21  -8.207 -16.565  -7.403
  159    HD2  TYR  21           HD2      TYR  21  -4.623 -14.472  -6.294
  160    HE1  TYR  21           HE1      TYR  21  -9.446 -15.401  -5.600
  161    HE2  TYR  21           HE2      TYR  21  -5.867 -13.309  -4.491
  162    HH   TYR  21           HH       TYR  21  -8.712 -12.785  -4.266
  163    H    GLN  22           HN       GLN  22  -7.113 -19.078  -9.126
  164    HA   GLN  22           HA       GLN  22  -7.076 -20.439 -10.971
  165    HB2  GLN  22           HB2      GLN  22  -4.780 -18.591 -11.651
  166    HB3  GLN  22           HB1      GLN  22  -5.442 -19.782 -12.770
  167    HG2  GLN  22           HG2      GLN  22  -7.648 -18.737 -12.630
  168    HG3  GLN  22           HG1      GLN  22  -7.051 -17.584 -11.437
  169   HE21  GLN  22          1HE2      GLN  22  -7.663 -17.921 -14.727
  170   HE22  GLN  22          2HE2      GLN  22  -6.627 -16.708 -15.308
  171    H    GLY  23           HN       GLY  23  -5.100 -20.801  -8.553
  172    HA2  GLY  23           HA2      GLY  23  -3.877 -22.647  -7.872
  173    HA3  GLY  23           HA1      GLY  23  -4.045 -23.314  -9.492
  174    H    ARG  24           HN       ARG  24  -2.968 -20.258  -9.952
  175    HA   ARG  24           HA       ARG  24  -0.199 -21.160 -10.337
  176    HB2  ARG  24           HB2      ARG  24  -1.646 -18.652 -11.220
  177    HB3  ARG  24           HB1      ARG  24   0.028 -19.046 -11.614
  178    HG2  ARG  24           HG2      ARG  24  -0.687 -21.087 -12.762
  179    HG3  ARG  24           HG1      ARG  24  -2.364 -20.777 -12.311
  180    HD2  ARG  24           HD2      ARG  24  -2.024 -20.036 -14.600
  181    HD3  ARG  24           HD1      ARG  24  -2.259 -18.625 -13.573
  182    HE   ARG  24           HE       ARG  24  -0.019 -18.029 -13.925
  183   HH11  ARG  24          1HH2      ARG  24  -0.742 -21.177 -15.173
  184   HH12  ARG  24          2HH2      ARG  24   0.733 -21.309 -16.072
  185   HH21  ARG  24          1HH1      ARG  24   1.915 -18.199 -15.099
  186   HH22  ARG  24          2HH1      ARG  24   2.237 -19.623 -16.031
  187    H    LEU  25           HN       LEU  25   1.599 -20.030  -9.496
  188    HA   LEU  25           HA       LEU  25   1.153 -18.895  -6.880
  189    HB2  LEU  25           HB2      LEU  25   3.596 -19.514  -8.532
  190    HB3  LEU  25           HB1      LEU  25   3.735 -18.552  -7.061
  191    HG   LEU  25           HG       LEU  25   2.610 -20.370  -5.790
  192   HD11  LEU  25          1HD1      LEU  25   2.512 -22.620  -7.017
  193   HD12  LEU  25          2HD1      LEU  25   2.654 -21.691  -8.509
  194   HD13  LEU  25          3HD1      LEU  25   1.270 -21.443  -7.442
  195   HD21  LEU  25          3HD2      LEU  25   4.953 -21.452  -7.377
  196   HD22  LEU  25          1HD2      LEU  25   4.512 -21.837  -5.714
  197   HD23  LEU  25          2HD2      LEU  25   5.131 -20.235  -6.113
  198    H    TRP  26           HN       TRP  26   1.324 -16.823  -6.243
  199    HA   TRP  26           HA       TRP  26   1.547 -14.759  -8.363
  200    HB2  TRP  26           HB2      TRP  26  -0.026 -14.987  -5.818
  201    HB3  TRP  26           HB1      TRP  26   0.452 -13.377  -6.342
  202    HD1  TRP  26           HD1      TRP  26  -0.902 -16.464  -8.264
  203    HE1  TRP  26           HE1      TRP  26  -2.843 -15.670  -9.764
  204    HE3  TRP  26           HE3      TRP  26  -1.013 -11.531  -7.008
  205    HZ2  TRP  26           HZ2      TRP  26  -4.256 -13.250 -10.350
  206    HZ3  TRP  26           HZ3      TRP  26  -2.664  -9.998  -8.044
  207    HH2  TRP  26           HH2      TRP  26  -4.285 -10.852  -9.713
  208    H    ALA  27           HN       ALA  27   2.888 -13.097  -8.131
  209    HA   ALA  27           HA       ALA  27   4.939 -13.278  -6.050
  210    HB1  ALA  27           HB1      ALA  27   5.196 -10.942  -7.745
  211    HB2  ALA  27           HB2      ALA  27   4.847 -12.336  -8.740
  212    HB3  ALA  27           HB3      ALA  27   6.242 -12.360  -7.688
  213    H    PHE  28           HN       PHE  28   4.348 -12.288  -4.115
  214    HA   PHE  28           HA       PHE  28   2.170 -10.390  -4.159
  215    HB2  PHE  28           HB2      PHE  28   2.218 -11.652  -2.193
  216    HB3  PHE  28           HB1      PHE  28   3.954 -11.520  -2.014
  217    HD1  PHE  28           HD1      PHE  28   0.731  -9.728  -1.669
  218    HD2  PHE  28           HD2      PHE  28   4.960  -9.624  -0.921
  219    HE1  PHE  28           HE1      PHE  28   0.419  -7.784  -0.159
  220    HE2  PHE  28           HE2      PHE  28   4.648  -7.681   0.587
  221    HZ   PHE  28           HZ       PHE  28   2.378  -6.763   0.969
  222    H    CYS  29           HN       CYS  29   2.630  -8.694  -5.280
  223    HA   CYS  29           HA       CYS  29   4.722  -6.874  -4.331
  224    HB2  CYS  29           HB2      CYS  29   4.599  -8.240  -6.951
  225    HB3  CYS  29           HB1      CYS  29   4.852  -6.499  -7.053
  226    HG   CYS  29           HG       CYS  29   6.817  -7.185  -5.104
  227    H    CYS  30           HN       CYS  30   3.846  -4.962  -3.936
  228    HA   CYS  30           HA       CYS  30   1.150  -4.350  -4.314
  229    HB2  CYS  30           HB2      CYS  30   3.407  -2.365  -3.987
  230    HB3  CYS  30           HB1      CYS  30   1.708  -2.112  -3.586
  231    HG   CYS  30           HG       CYS  30   3.410  -2.995  -1.538
  Start of MODEL    9
    1    H1   ALA   1           HT1      ALA   1  -0.911  -0.276   2.741
    2    H2   ALA   1           HT2      ALA   1  -1.282  -1.049   4.209
    3    H3   ALA   1           HT3      ALA   1  -2.363   0.080   3.542
    4    HA   ALA   1           HA       ALA   1  -2.292  -2.683   3.142
    5    HB1  ALA   1           HB1      ALA   1  -4.263  -2.055   1.625
    6    HB2  ALA   1           HB2      ALA   1  -3.905  -0.378   2.037
    7    HB3  ALA   1           HB3      ALA   1  -4.363  -1.518   3.302
    8    H    CYS   2           HN       CYS   2  -1.391  -3.901   1.609
    9    HA   CYS   2           HA       CYS   2  -0.207  -2.594  -0.762
   10    HB2  CYS   2           HB2      CYS   2   0.277  -5.258   0.577
   11    HB3  CYS   2           HB1      CYS   2   0.966  -4.831  -0.990
   12    HG   CYS   2           HG       CYS   2   2.266  -2.877   0.161
   13    H    TYR   3           HN       TYR   3  -0.975  -2.931  -2.748
   14    HA   TYR   3           HA       TYR   3  -3.291  -4.707  -3.079
   15    HB2  TYR   3           HB2      TYR   3  -3.310  -2.334  -3.937
   16    HB3  TYR   3           HB1      TYR   3  -2.079  -2.817  -5.105
   17    HD1  TYR   3           HD2      TYR   3  -5.521  -3.611  -3.900
   18    HD2  TYR   3           HD1      TYR   3  -2.671  -3.969  -7.095
   19    HE1  TYR   3           HE2      TYR   3  -7.285  -4.553  -5.368
   20    HE2  TYR   3           HE1      TYR   3  -4.435  -4.913  -8.561
   21    HH   TYR   3           HH       TYR   3  -7.464  -5.949  -7.358
   22    H    CYS   4           HN       CYS   4  -3.360  -6.288  -4.741
   23    HA   CYS   4           HA       CYS   4  -0.776  -7.571  -5.188
   24    HB2  CYS   4           HB2      CYS   4  -3.525  -8.500  -6.021
   25    HB3  CYS   4           HB1      CYS   4  -2.064  -9.470  -5.881
   26    HG   CYS   4           HG       CYS   4  -2.207  -9.367  -3.337
   27    H    ARG   5           HN       ARG   5   0.064  -8.104  -7.208
   28    HA   ARG   5           HA       ARG   5  -1.251  -7.229  -9.628
   29    HB2  ARG   5           HB2      ARG   5   0.270  -5.288  -8.436
   30    HB3  ARG   5           HB1      ARG   5   1.474  -6.042  -9.472
   31    HG2  ARG   5           HG2      ARG   5   0.543  -4.464 -10.934
   32    HG3  ARG   5           HG1      ARG   5  -0.436  -5.868 -11.314
   33    HD2  ARG   5           HD2      ARG   5  -2.139  -5.076  -9.661
   34    HD3  ARG   5           HD1      ARG   5  -1.181  -3.621  -9.419
   35    HE   ARG   5           HE       ARG   5  -2.768  -4.298 -11.787
   36   HH11  ARG   5          1HH2      ARG   5  -0.424  -2.244 -10.268
   37   HH12  ARG   5          2HH2      ARG   5  -0.658  -0.935 -11.377
   38   HH21  ARG   5          1HH1      ARG   5  -3.075  -2.586 -13.233
   39   HH22  ARG   5          2HH1      ARG   5  -2.157  -1.128 -13.055
   40    H    ILE   6           HN       ILE   6   0.401  -7.389 -11.476
   41    HA   ILE   6           HA       ILE   6   1.642 -10.033 -11.267
   42    HB   ILE   6           HB       ILE   6   1.916  -9.249 -13.912
   43   HG12  ILE   6          2HG1      ILE   6  -0.312  -8.298 -14.563
   44   HG13  ILE   6          1HG1      ILE   6  -0.637  -7.986 -12.863
   45   HG21  ILE   6          1HG2      ILE   6  -0.016 -10.685 -14.387
   46   HG22  ILE   6          2HG2      ILE   6  -0.523 -10.575 -12.701
   47   HG23  ILE   6          3HG2      ILE   6   0.984 -11.390 -13.117
   48   HD11  ILE   6          3HD1      ILE   6   1.347  -6.538 -12.728
   49   HD12  ILE   6          1HD1      ILE   6   0.290  -5.987 -14.026
   50   HD13  ILE   6          2HD1      ILE   6   1.746  -6.909 -14.403
   51    HA   PRO   7           HA       PRO   7   5.707  -8.436 -10.973
   52    HB2  PRO   7           HB2      PRO   7   6.351  -9.342 -13.751
   53    HB3  PRO   7           HB1      PRO   7   7.247  -9.607 -12.238
   54    HG2  PRO   7           HG2      PRO   7   5.810 -11.558 -13.210
   55    HG3  PRO   7           HG1      PRO   7   5.719 -11.197 -11.473
   56    HD2  PRO   7           HD2      PRO   7   3.767 -10.503 -13.645
   57    HD3  PRO   7           HD1      PRO   7   3.454 -11.112 -12.004
   58    H    ALA   8           HN       ALA   8   4.115  -6.338 -11.558
   59    HA   ALA   8           HA       ALA   8   5.917  -4.435 -12.569
   60    HB1  ALA   8           HB1      ALA   8   4.565  -3.735 -14.564
   61    HB2  ALA   8           HB2      ALA   8   3.668  -5.245 -14.407
   62    HB3  ALA   8           HB3      ALA   8   5.397  -5.279 -14.753
   63    H    CYS   9           HN       CYS   9   5.422  -3.182 -10.888
   64    HA   CYS   9           HA       CYS   9   3.751  -1.153 -10.786
   65    HB2  CYS   9           HB2      CYS   9   1.715  -2.467 -11.014
   66    HB3  CYS   9           HB1      CYS   9   2.181  -3.485  -9.646
   67    HG   CYS   9           HG       CYS   9   1.136  -1.784  -8.187
   68    H    ILE  10           HN       ILE  10   5.527  -3.542  -9.410
   69    HA   ILE  10           HA       ILE  10   5.280  -2.977  -6.651
   70    HB   ILE  10           HB       ILE  10   7.808  -3.999  -7.958
   71   HG12  ILE  10          2HG1      ILE  10   5.266  -5.569  -7.407
   72   HG13  ILE  10          1HG1      ILE  10   5.929  -5.216  -8.994
   73   HG21  ILE  10          1HG2      ILE  10   8.100  -5.152  -5.896
   74   HG22  ILE  10          2HG2      ILE  10   6.430  -4.875  -5.412
   75   HG23  ILE  10          3HG2      ILE  10   7.573  -3.532  -5.450
   76   HD11  ILE  10          3HD1      ILE  10   8.107  -6.363  -7.880
   77   HD12  ILE  10          1HD1      ILE  10   6.860  -7.287  -8.714
   78   HD13  ILE  10          2HD1      ILE  10   6.846  -7.179  -6.955
   79    H    ALA  11           HN       ALA  11   5.985  -1.285  -5.547
   80    HA   ALA  11           HA       ALA  11   7.505   0.792  -6.825
   81    HB1  ALA  11           HB1      ALA  11   7.374   1.866  -4.572
   82    HB2  ALA  11           HB2      ALA  11   6.570   0.417  -3.971
   83    HB3  ALA  11           HB3      ALA  11   5.799   1.401  -5.217
   84    H    GLY  12           HN       GLY  12   8.486  -2.072  -6.084
   85    HA2  GLY  12           HA2      GLY  12  10.887  -2.507  -6.173
   86    HA3  GLY  12           HA1      GLY  12  11.108  -1.230  -4.982
   87    H    GLU  13           HN       GLU  13   9.751  -4.464  -5.488
   88    HA   GLU  13           HA       GLU  13  10.609  -5.295  -2.869
   89    HB2  GLU  13           HB2      GLU  13   8.438  -4.085  -2.426
   90    HB3  GLU  13           HB1      GLU  13   7.631  -5.309  -3.404
   91    HG2  GLU  13           HG2      GLU  13   8.255  -7.058  -1.889
   92    HG3  GLU  13           HG1      GLU  13   9.365  -6.000  -1.020
   93    H    ARG  14           HN       ARG  14   9.943  -7.646  -2.484
   94    HA   ARG  14           HA       ARG  14  10.089  -9.093  -5.060
   95    HB2  ARG  14           HB2      ARG  14  10.775 -10.034  -2.265
   96    HB3  ARG  14           HB1      ARG  14  11.034 -10.934  -3.758
   97    HG2  ARG  14           HG2      ARG  14  12.242  -8.196  -3.347
   98    HG3  ARG  14           HG1      ARG  14  13.054  -9.650  -2.774
   99    HD2  ARG  14           HD2      ARG  14  12.936 -10.574  -5.097
  100    HD3  ARG  14           HD1      ARG  14  12.264  -9.045  -5.642
  101    HE   ARG  14           HE       ARG  14  15.022  -9.532  -4.803
  102   HH11  ARG  14          1HH2      ARG  14  12.528  -7.277  -5.649
  103   HH12  ARG  14          2HH2      ARG  14  13.630  -6.009  -6.064
  104   HH21  ARG  14          1HH1      ARG  14  16.464  -7.871  -5.346
  105   HH22  ARG  14          2HH1      ARG  14  15.855  -6.343  -5.892
  106    H    ARG  15           HN       ARG  15   8.957 -11.112  -5.276
  107    HA   ARG  15           HA       ARG  15   6.224 -10.907  -4.488
  108    HB2  ARG  15           HB2      ARG  15   5.888 -12.892  -5.795
  109    HB3  ARG  15           HB1      ARG  15   7.078 -11.903  -6.639
  110    HG2  ARG  15           HG2      ARG  15   8.888 -13.263  -5.527
  111    HG3  ARG  15           HG1      ARG  15   7.621 -14.337  -4.928
  112    HD2  ARG  15           HD2      ARG  15   6.875 -14.764  -7.232
  113    HD3  ARG  15           HD1      ARG  15   8.131 -13.693  -7.842
  114    HE   ARG  15           HE       ARG  15   9.150 -15.835  -6.193
  115   HH11  ARG  15          1HH2      ARG  15   8.133 -14.839  -9.345
  116   HH12  ARG  15          2HH2      ARG  15   9.087 -16.019 -10.179
  117   HH21  ARG  15          1HH1      ARG  15  10.409 -17.386  -7.280
  118   HH22  ARG  15          2HH1      ARG  15  10.376 -17.460  -9.011
  119    H    TYR  16           HN       TYR  16   5.226 -11.655  -2.755
  120    HA   TYR  16           HA       TYR  16   6.304 -13.946  -1.277
  121    HB2  TYR  16           HB2      TYR  16   7.398 -12.049  -0.210
  122    HB3  TYR  16           HB1      TYR  16   5.851 -11.222  -0.031
  123    HD1  TYR  16           HD2      TYR  16   7.655 -14.363   0.894
  124    HD2  TYR  16           HD1      TYR  16   4.495 -11.619   1.866
  125    HE1  TYR  16           HE2      TYR  16   7.269 -15.564   3.028
  126    HE2  TYR  16           HE1      TYR  16   4.110 -12.821   4.001
  127    HH   TYR  16           HH       TYR  16   6.238 -14.841   5.380
  128    H    GLY  17           HN       GLY  17   4.088 -11.600   0.065
  129    HA2  GLY  17           HA2      GLY  17   1.961 -13.627   0.093
  130    HA3  GLY  17           HA1      GLY  17   2.004 -12.141   1.038
  131    H    THR  18           HN       THR  18   1.305 -13.534  -2.096
  132    HA   THR  18           HA       THR  18  -0.364 -11.184  -2.751
  133    HB   THR  18           HB       THR  18   1.213 -12.624  -4.887
  134    HG1  THR  18           HG1      THR  18   2.926 -11.585  -4.332
  135   HG21  THR  18          3HG2      THR  18  -0.127  -9.916  -4.657
  136   HG22  THR  18          1HG2      THR  18  -0.589 -11.256  -5.708
  137   HG23  THR  18          2HG2      THR  18   0.912 -10.377  -6.001
  138    H    CYS  19           HN       CYS  19  -1.960 -11.730  -4.501
  139    HA   CYS  19           HA       CYS  19  -3.049 -14.423  -3.985
  140    HB2  CYS  19           HB2      CYS  19  -4.544 -12.297  -5.488
  141    HB3  CYS  19           HB1      CYS  19  -5.152 -13.525  -4.377
  142    HG   CYS  19           HG       CYS  19  -3.719 -11.983  -2.519
  143    H    ILE  20           HN       ILE  20  -3.536 -15.851  -5.619
  144    HA   ILE  20           HA       ILE  20  -2.163 -15.381  -8.181
  145    HB   ILE  20           HB       ILE  20  -3.421 -17.947  -7.212
  146   HG12  ILE  20          2HG1      ILE  20  -1.882 -17.277  -5.472
  147   HG13  ILE  20          1HG1      ILE  20  -1.089 -18.521  -6.435
  148   HG21  ILE  20          1HG2      ILE  20  -2.679 -17.570  -9.647
  149   HG22  ILE  20          2HG2      ILE  20  -2.038 -18.993  -8.826
  150   HG23  ILE  20          3HG2      ILE  20  -1.033 -17.558  -9.017
  151   HD11  ILE  20          3HD1      ILE  20  -0.592 -15.544  -6.442
  152   HD12  ILE  20          1HD1      ILE  20  -0.089 -16.557  -7.794
  153   HD13  ILE  20          2HD1      ILE  20   0.564 -16.849  -6.184
  154    H    TYR  21           HN       TYR  21  -3.286 -14.757  -9.888
  155    HA   TYR  21           HA       TYR  21  -6.185 -15.378 -10.042
  156    HB2  TYR  21           HB2      TYR  21  -4.596 -13.040 -11.114
  157    HB3  TYR  21           HB1      TYR  21  -6.257 -13.387 -11.595
  158    HD1  TYR  21           HD2      TYR  21  -8.008 -13.649  -9.709
  159    HD2  TYR  21           HD1      TYR  21  -4.169 -11.813  -9.143
  160    HE1  TYR  21           HE2      TYR  21  -8.849 -12.519  -7.669
  161    HE2  TYR  21           HE1      TYR  21  -5.009 -10.680  -7.106
  162    HH   TYR  21           HH       TYR  21  -7.061 -11.333  -5.358
  163    H    GLN  22           HN       GLN  22  -6.944 -16.424 -11.793
  164    HA   GLN  22           HA       GLN  22  -6.956 -17.663 -13.724
  165    HB2  GLN  22           HB2      GLN  22  -6.339 -15.315 -14.584
  166    HB3  GLN  22           HB1      GLN  22  -4.688 -15.923 -14.688
  167    HG2  GLN  22           HG2      GLN  22  -5.368 -17.670 -16.234
  168    HG3  GLN  22           HG1      GLN  22  -7.065 -17.251 -16.022
  169   HE21  GLN  22          1HE2      GLN  22  -5.834 -17.204 -18.606
  170   HE22  GLN  22          2HE2      GLN  22  -5.763 -15.592 -19.130
  171    H    GLY  23           HN       GLY  23  -4.775 -17.940 -11.472
  172    HA2  GLY  23           HA2      GLY  23  -3.327 -19.673 -10.959
  173    HA3  GLY  23           HA1      GLY  23  -3.605 -20.328 -12.568
  174    H    ARG  24           HN       ARG  24  -2.711 -17.035 -12.524
  175    HA   ARG  24           HA       ARG  24  -0.081 -17.697 -13.652
  176    HB2  ARG  24           HB2      ARG  24  -1.647 -15.108 -13.520
  177    HB3  ARG  24           HB1      ARG  24  -0.051 -15.272 -14.257
  178    HG2  ARG  24           HG2      ARG  24  -0.928 -16.958 -15.818
  179    HG3  ARG  24           HG1      ARG  24  -2.520 -16.835 -15.070
  180    HD2  ARG  24           HD2      ARG  24  -1.081 -14.493 -16.340
  181    HD3  ARG  24           HD1      ARG  24  -2.263 -15.487 -17.187
  182    HE   ARG  24           HE       ARG  24  -3.427 -14.599 -14.787
  183   HH11  ARG  24          1HH2      ARG  24  -2.224 -13.388 -17.794
  184   HH12  ARG  24          2HH2      ARG  24  -3.305 -12.035 -17.843
  185   HH21  ARG  24          1HH1      ARG  24  -4.852 -12.830 -14.842
  186   HH22  ARG  24          2HH1      ARG  24  -4.794 -11.720 -16.170
  187    H    LEU  25           HN       LEU  25   1.859 -16.699 -12.900
  188    HA   LEU  25           HA       LEU  25   1.984 -16.476 -10.028
  189    HB2  LEU  25           HB2      LEU  25   4.133 -15.896 -12.080
  190    HB3  LEU  25           HB1      LEU  25   4.373 -16.197 -10.360
  191    HG   LEU  25           HG       LEU  25   3.188 -18.180 -12.327
  192   HD11  LEU  25          1HD1      LEU  25   5.618 -17.727 -12.658
  193   HD12  LEU  25          2HD1      LEU  25   5.308 -19.372 -12.103
  194   HD13  LEU  25          3HD1      LEU  25   5.902 -18.157 -10.971
  195   HD21  LEU  25          3HD2      LEU  25   2.286 -18.763 -10.232
  196   HD22  LEU  25          1HD2      LEU  25   3.719 -18.226  -9.354
  197   HD23  LEU  25          2HD2      LEU  25   3.760 -19.726 -10.281
  198    H    TRP  26           HN       TRP  26   1.705 -14.688  -8.872
  199    HA   TRP  26           HA       TRP  26   1.915 -12.059 -10.225
  200    HB2  TRP  26           HB2      TRP  26   0.158 -13.075  -8.009
  201    HB3  TRP  26           HB1      TRP  26   0.552 -11.359  -8.071
  202    HD1  TRP  26           HD1      TRP  26  -0.174 -13.700 -11.059
  203    HE1  TRP  26           HE1      TRP  26  -2.156 -12.720 -12.371
  204    HE3  TRP  26           HE3      TRP  26  -1.366  -9.760  -8.044
  205    HZ2  TRP  26           HZ2      TRP  26  -4.011 -10.561 -12.171
  206    HZ3  TRP  26           HZ3      TRP  26  -3.258  -8.266  -8.627
  207    HH2  TRP  26           HH2      TRP  26  -4.577  -8.659 -10.684
  208    H    ALA  27           HN       ALA  27   3.079 -10.458  -9.340
  209    HA   ALA  27           HA       ALA  27   4.964 -11.237  -7.233
  210    HB1  ALA  27           HB1      ALA  27   5.719 -10.120  -9.390
  211    HB2  ALA  27           HB2      ALA  27   6.270  -9.373  -7.893
  212    HB3  ALA  27           HB3      ALA  27   4.933  -8.657  -8.794
  213    H    PHE  28           HN       PHE  28   5.196  -9.965  -5.369
  214    HA   PHE  28           HA       PHE  28   2.692  -8.904  -4.405
  215    HB2  PHE  28           HB2      PHE  28   4.084 -10.244  -2.925
  216    HB3  PHE  28           HB1      PHE  28   5.420  -9.119  -3.129
  217    HD1  PHE  28           HD2      PHE  28   1.771  -9.032  -2.232
  218    HD2  PHE  28           HD1      PHE  28   5.711  -7.509  -1.464
  219    HE1  PHE  28           HE2      PHE  28   0.875  -7.640  -0.383
  220    HE2  PHE  28           HE1      PHE  28   4.817  -6.116   0.381
  221    HZ   PHE  28           HZ       PHE  28   2.399  -6.182   0.922
  222    H    CYS  29           HN       CYS  29   2.145  -7.032  -5.183
  223    HA   CYS  29           HA       CYS  29   4.093  -4.882  -5.575
  224    HB2  CYS  29           HB2      CYS  29   2.617  -5.183  -7.408
  225    HB3  CYS  29           HB1      CYS  29   1.219  -5.341  -6.343
  226    HG   CYS  29           HG       CYS  29   0.948  -2.890  -6.452
  227    H    CYS  30           HN       CYS  30   4.306  -3.225  -4.195
  228    HA   CYS  30           HA       CYS  30   2.566  -3.113  -1.833
  229    HB2  CYS  30           HB2      CYS  30   5.150  -3.017  -1.796
  230    HB3  CYS  30           HB1      CYS  30   4.959  -1.351  -2.342
  231    HG   CYS  30           HG       CYS  30   4.447  -0.762   0.001
  Start of MODEL   10
    1    H1   ALA   1           HT1      ALA   1  -3.490  -0.906   1.992
    2    H2   ALA   1           HT2      ALA   1  -1.904  -0.353   2.247
    3    H3   ALA   1           HT3      ALA   1  -2.187  -1.982   1.853
    4    HA   ALA   1           HA       ALA   1  -3.069   0.125   0.003
    5    HB1  ALA   1           HB1      ALA   1  -0.806  -0.172  -1.126
    6    HB2  ALA   1           HB2      ALA   1  -0.252  -0.925   0.369
    7    HB3  ALA   1           HB3      ALA   1  -0.782   0.756   0.373
    8    H    CYS   2           HN       CYS   2  -0.784  -2.373  -0.741
    9    HA   CYS   2           HA       CYS   2  -2.815  -4.327  -1.491
   10    HB2  CYS   2           HB2      CYS   2  -2.055  -4.396  -3.852
   11    HB3  CYS   2           HB1      CYS   2  -2.821  -2.860  -3.442
   12    HG   CYS   2           HG       CYS   2  -0.668  -2.053  -4.500
   13    H    TYR   3           HN       TYR   3  -1.907  -6.376  -2.066
   14    HA   TYR   3           HA       TYR   3   0.988  -6.732  -1.742
   15    HB2  TYR   3           HB2      TYR   3   0.584  -8.525  -0.037
   16    HB3  TYR   3           HB1      TYR   3   0.206  -6.900   0.534
   17    HD1  TYR   3           HD1      TYR   3  -2.208  -6.091   0.413
   18    HD2  TYR   3           HD2      TYR   3  -1.098 -10.215  -0.047
   19    HE1  TYR   3           HE1      TYR   3  -4.537  -6.774   0.916
   20    HE2  TYR   3           HE2      TYR   3  -3.429 -10.897   0.451
   21    HH   TYR   3           HH       TYR   3  -5.771  -8.676   1.677
   22    H    CYS   4           HN       CYS   4   0.332  -7.109  -4.075
   23    HA   CYS   4           HA       CYS   4   0.115  -9.984  -4.507
   24    HB2  CYS   4           HB2      CYS   4  -2.003  -7.997  -5.209
   25    HB3  CYS   4           HB1      CYS   4  -1.682  -9.267  -6.377
   26    HG   CYS   4           HG       CYS   4  -2.828  -9.692  -3.529
   27    H    ARG   5           HN       ARG   5   0.342 -10.395  -7.001
   28    HA   ARG   5           HA       ARG   5   2.407  -8.535  -8.047
   29    HB2  ARG   5           HB2      ARG   5   3.006 -10.331  -9.608
   30    HB3  ARG   5           HB1      ARG   5   3.123 -10.876  -7.946
   31    HG2  ARG   5           HG2      ARG   5   1.815 -12.636  -8.591
   32    HG3  ARG   5           HG1      ARG   5   0.477 -11.497  -8.548
   33    HD2  ARG   5           HD2      ARG   5   0.271 -12.350 -10.706
   34    HD3  ARG   5           HD1      ARG   5   1.287 -10.949 -11.019
   35    HE   ARG   5           HE       ARG   5   3.100 -12.391 -11.415
   36   HH11  ARG   5          1HH2      ARG   5   0.307 -14.073 -10.241
   37   HH12  ARG   5          2HH2      ARG   5   0.961 -15.647 -10.541
   38   HH21  ARG   5          1HH1      ARG   5   3.968 -14.458 -11.785
   39   HH22  ARG   5          2HH1      ARG   5   3.031 -15.866 -11.410
   40    H    ILE   6           HN       ILE   6   2.013  -7.383  -9.746
   41    HA   ILE   6           HA       ILE   6  -0.132  -8.092 -11.589
   42    HB   ILE   6           HB       ILE   6   0.083  -5.356 -10.315
   43   HG12  ILE   6          2HG1      ILE   6  -2.277  -6.093  -9.474
   44   HG13  ILE   6          1HG1      ILE   6  -1.716  -7.730  -9.786
   45   HG21  ILE   6          1HG2      ILE   6  -0.714  -5.419 -12.674
   46   HG22  ILE   6          2HG2      ILE   6  -1.980  -4.912 -11.559
   47   HG23  ILE   6          3HG2      ILE   6  -1.975  -6.555 -12.195
   48   HD11  ILE   6          3HD1      ILE   6  -1.112  -5.970  -7.568
   49   HD12  ILE   6          1HD1      ILE   6   0.381  -6.505  -8.329
   50   HD13  ILE   6          2HD1      ILE   6  -0.788  -7.678  -7.753
   51    HA   PRO   7           HA       PRO   7   3.312  -6.973 -14.213
   52    HB2  PRO   7           HB2      PRO   7   1.149  -5.983 -16.032
   53    HB3  PRO   7           HB1      PRO   7   2.520  -7.048 -16.391
   54    HG2  PRO   7           HG2      PRO   7   0.028  -7.989 -16.139
   55    HG3  PRO   7           HG1      PRO   7   1.441  -8.922 -15.610
   56    HD2  PRO   7           HD2      PRO   7  -0.599  -7.512 -13.959
   57    HD3  PRO   7           HD1      PRO   7   0.422  -8.917 -13.562
   58    H    ALA   8           HN       ALA   8   3.881  -5.358 -12.725
   59    HA   ALA   8           HA       ALA   8   3.703  -2.652 -13.643
   60    HB1  ALA   8           HB1      ALA   8   2.485  -3.201 -10.934
   61    HB2  ALA   8           HB2      ALA   8   1.497  -3.082 -12.391
   62    HB3  ALA   8           HB3      ALA   8   2.459  -1.701 -11.863
   63    H    CYS   9           HN       CYS   9   4.301  -1.448 -11.175
   64    HA   CYS   9           HA       CYS   9   7.056  -1.778 -10.946
   65    HB2  CYS   9           HB2      CYS   9   6.833  -0.511  -8.855
   66    HB3  CYS   9           HB1      CYS   9   5.800   0.173 -10.112
   67    HG   CYS   9           HG       CYS   9   4.654  -1.740  -7.906
   68    H    ILE  10           HN       ILE  10   6.966  -4.280 -10.925
   69    HA   ILE  10           HA       ILE  10   6.218  -5.630  -8.532
   70    HB   ILE  10           HB       ILE  10   8.023  -6.392 -10.834
   71   HG12  ILE  10          2HG1      ILE  10   5.369  -7.631 -10.087
   72   HG13  ILE  10          1HG1      ILE  10   5.403  -6.124 -10.992
   73   HG21  ILE  10          1HG2      ILE  10   7.714  -8.743  -9.847
   74   HG22  ILE  10          2HG2      ILE  10   7.208  -7.934  -8.365
   75   HG23  ILE  10          3HG2      ILE  10   8.834  -7.679  -8.995
   76   HD11  ILE  10          3HD1      ILE  10   5.314  -8.263 -12.381
   77   HD12  ILE  10          1HD1      ILE  10   6.971  -8.556 -11.855
   78   HD13  ILE  10          2HD1      ILE  10   6.588  -7.119 -12.804
   79    H    ALA  11           HN       ALA  11   9.299  -4.365  -9.761
   80    HA   ALA  11           HA       ALA  11  10.892  -5.317  -7.614
   81    HB1  ALA  11           HB1      ALA  11  11.893  -4.628  -9.728
   82    HB2  ALA  11           HB2      ALA  11  12.549  -3.656  -8.412
   83    HB3  ALA  11           HB3      ALA  11  11.325  -2.977  -9.484
   84    H    GLY  12           HN       GLY  12  12.133  -3.702  -6.196
   85    HA2  GLY  12           HA2      GLY  12  12.154  -1.786  -4.805
   86    HA3  GLY  12           HA1      GLY  12  10.474  -1.473  -5.231
   87    H    GLU  13           HN       GLU  13  10.166  -4.550  -4.781
   88    HA   GLU  13           HA       GLU  13  10.417  -4.797  -1.905
   89    HB2  GLU  13           HB2      GLU  13   8.330  -3.433  -2.229
   90    HB3  GLU  13           HB1      GLU  13   7.649  -4.788  -3.129
   91    HG2  GLU  13           HG2      GLU  13   6.887  -4.968  -0.843
   92    HG3  GLU  13           HG1      GLU  13   8.075  -6.241  -1.110
   93    H    ARG  14           HN       ARG  14  10.190  -6.923  -1.199
   94    HA   ARG  14           HA       ARG  14  10.097  -8.954  -3.349
   95    HB2  ARG  14           HB2      ARG  14  11.253  -9.027  -0.554
   96    HB3  ARG  14           HB1      ARG  14  11.184 -10.419  -1.634
   97    HG2  ARG  14           HG2      ARG  14  12.514  -9.191  -3.309
   98    HG3  ARG  14           HG1      ARG  14  12.585  -7.797  -2.229
   99    HD2  ARG  14           HD2      ARG  14  13.624 -10.554  -1.529
  100    HD3  ARG  14           HD1      ARG  14  14.631  -9.235  -2.116
  101    HE   ARG  14           HE       ARG  14  13.466  -9.482   0.536
  102   HH11  ARG  14          1HH2      ARG  14  14.853  -7.428  -1.879
  103   HH12  ARG  14          2HH2      ARG  14  15.350  -6.209  -0.754
  104   HH21  ARG  14          1HH1      ARG  14  14.114  -7.887   2.018
  105   HH22  ARG  14          2HH1      ARG  14  14.932  -6.469   1.453
  106    H    ARG  15           HN       ARG  15   9.209 -11.110  -2.618
  107    HA   ARG  15           HA       ARG  15   6.493 -10.780  -1.845
  108    HB2  ARG  15           HB2      ARG  15   6.429 -13.266  -1.926
  109    HB3  ARG  15           HB1      ARG  15   7.136 -12.551  -3.375
  110    HG2  ARG  15           HG2      ARG  15   9.403 -12.945  -2.438
  111    HG3  ARG  15           HG1      ARG  15   8.670 -13.719  -1.034
  112    HD2  ARG  15           HD2      ARG  15   9.349 -15.432  -2.622
  113    HD3  ARG  15           HD1      ARG  15   7.591 -15.374  -2.537
  114    HE   ARG  15           HE       ARG  15   7.544 -14.561  -4.730
  115   HH11  ARG  15          1HH2      ARG  15  10.751 -14.590  -3.429
  116   HH12  ARG  15          2HH2      ARG  15  11.520 -14.283  -4.950
  117   HH21  ARG  15          1HH1      ARG  15   8.546 -14.158  -6.729
  118   HH22  ARG  15          2HH1      ARG  15  10.272 -14.038  -6.819
  119    H    TYR  16           HN       TYR  16   5.506 -10.984   0.068
  120    HA   TYR  16           HA       TYR  16   6.864 -12.243   2.338
  121    HB2  TYR  16           HB2      TYR  16   5.916  -9.367   2.355
  122    HB3  TYR  16           HB1      TYR  16   6.380 -10.279   3.791
  123    HD1  TYR  16           HD2      TYR  16   8.733 -11.470   3.667
  124    HD2  TYR  16           HD1      TYR  16   7.566  -8.128   1.232
  125    HE1  TYR  16           HE2      TYR  16  11.119 -10.934   3.257
  126    HE2  TYR  16           HE1      TYR  16   9.952  -7.594   0.823
  127    HH   TYR  16           HH       TYR  16  12.546  -9.429   2.416
  128    H    GLY  17           HN       GLY  17   4.392 -10.064   3.146
  129    HA2  GLY  17           HA2      GLY  17   2.610 -12.164   3.937
  130    HA3  GLY  17           HA1      GLY  17   2.291 -10.433   4.034
  131    H    THR  18           HN       THR  18   3.070 -12.484   1.249
  132    HA   THR  18           HA       THR  18   0.960 -11.293  -0.323
  133    HB   THR  18           HB       THR  18   1.905 -12.417  -2.158
  134    HG1  THR  18           HG1      THR  18   3.537 -14.202  -1.271
  135   HG21  THR  18          3HG2      THR  18   3.518 -10.843  -1.136
  136   HG22  THR  18          1HG2      THR  18   4.348 -12.201  -1.891
  137   HG23  THR  18          2HG2      THR  18   4.160 -12.155  -0.148
  138    H    CYS  19           HN       CYS  19  -0.582 -12.730  -1.538
  139    HA   CYS  19           HA       CYS  19  -1.785 -14.666   0.341
  140    HB2  CYS  19           HB2      CYS  19  -3.715 -14.425  -1.431
  141    HB3  CYS  19           HB1      CYS  19  -3.434 -13.130  -0.268
  142    HG   CYS  19           HG       CYS  19  -2.792 -12.991  -3.288
  143    H    ILE  20           HN       ILE  20  -2.402 -16.737  -0.340
  144    HA   ILE  20           HA       ILE  20  -0.646 -17.899  -2.324
  145    HB   ILE  20           HB       ILE  20  -2.893 -19.274  -0.847
  146   HG12  ILE  20          2HG1      ILE  20  -1.575 -18.137   0.838
  147   HG13  ILE  20          1HG1      ILE  20  -1.118 -19.839   0.850
  148   HG21  ILE  20          1HG2      ILE  20  -1.505 -21.251  -1.162
  149   HG22  ILE  20          2HG2      ILE  20  -0.223 -20.275  -1.878
  150   HG23  ILE  20          3HG2      ILE  20  -1.758 -20.473  -2.724
  151   HD11  ILE  20          3HD1      ILE  20   0.949 -18.691   0.902
  152   HD12  ILE  20          1HD1      ILE  20   0.414 -17.494  -0.275
  153   HD13  ILE  20          2HD1      ILE  20   0.764 -19.142  -0.792
  154    H    TYR  21           HN       TYR  21  -1.104 -18.080  -4.404
  155    HA   TYR  21           HA       TYR  21  -3.841 -18.623  -5.291
  156    HB2  TYR  21           HB2      TYR  21  -2.293 -16.119  -5.939
  157    HB3  TYR  21           HB1      TYR  21  -3.414 -16.787  -7.124
  158    HD1  TYR  21           HD2      TYR  21  -5.777 -17.499  -6.131
  159    HD2  TYR  21           HD1      TYR  21  -3.148 -14.597  -4.366
  160    HE1  TYR  21           HE2      TYR  21  -7.695 -16.499  -4.921
  161    HE2  TYR  21           HE1      TYR  21  -5.068 -13.596  -3.155
  162    HH   TYR  21           HH       TYR  21  -8.300 -15.056  -3.313
  163    H    GLN  22           HN       GLN  22  -3.945 -19.702  -7.232
  164    HA   GLN  22           HA       GLN  22  -3.210 -21.179  -8.833
  165    HB2  GLN  22           HB2      GLN  22  -1.156 -18.976  -9.113
  166    HB3  GLN  22           HB1      GLN  22  -1.320 -20.317 -10.248
  167    HG2  GLN  22           HG2      GLN  22  -3.620 -19.677 -10.739
  168    HG3  GLN  22           HG1      GLN  22  -3.553 -18.399  -9.526
  169   HE21  GLN  22          1HE2      GLN  22  -3.721 -18.499 -12.691
  170   HE22  GLN  22          2HE2      GLN  22  -2.589 -17.320 -13.146
  171    H    GLY  23           HN       GLY  23  -1.867 -21.041  -5.991
  172    HA2  GLY  23           HA2      GLY  23  -0.513 -22.546  -4.868
  173    HA3  GLY  23           HA1      GLY  23  -0.210 -23.355  -6.403
  174    H    ARG  24           HN       ARG  24   0.327 -19.956  -6.297
  175    HA   ARG  24           HA       ARG  24   3.233 -20.303  -5.867
  176    HB2  ARG  24           HB2      ARG  24   1.924 -18.894  -8.205
  177    HB3  ARG  24           HB1      ARG  24   3.641 -18.797  -7.810
  178    HG2  ARG  24           HG2      ARG  24   3.876 -21.214  -8.077
  179    HG3  ARG  24           HG1      ARG  24   2.145 -21.376  -8.368
  180    HD2  ARG  24           HD2      ARG  24   3.316 -21.391 -10.504
  181    HD3  ARG  24           HD1      ARG  24   2.380 -19.904 -10.366
  182    HE   ARG  24           HE       ARG  24   5.009 -19.468  -9.396
  183   HH11  ARG  24          1HH2      ARG  24   3.220 -20.055 -12.298
  184   HH12  ARG  24          2HH2      ARG  24   4.319 -19.184 -13.316
  185   HH21  ARG  24          1HH1      ARG  24   6.454 -18.324 -10.723
  186   HH22  ARG  24          2HH1      ARG  24   6.149 -18.204 -12.425
  187    H    LEU  25           HN       LEU  25   4.324 -18.420  -5.182
  188    HA   LEU  25           HA       LEU  25   2.664 -16.615  -3.626
  189    HB2  LEU  25           HB2      LEU  25   5.670 -16.601  -4.004
  190    HB3  LEU  25           HB1      LEU  25   4.759 -15.801  -2.724
  191    HG   LEU  25           HG       LEU  25   4.840 -18.799  -3.182
  192   HD11  LEU  25          1HD1      LEU  25   6.993 -17.794  -2.379
  193   HD12  LEU  25          2HD1      LEU  25   6.258 -18.893  -1.213
  194   HD13  LEU  25          3HD1      LEU  25   6.124 -17.149  -0.986
  195   HD21  LEU  25          3HD2      LEU  25   3.438 -17.011  -1.193
  196   HD22  LEU  25          1HD2      LEU  25   3.871 -18.663  -0.752
  197   HD23  LEU  25          2HD2      LEU  25   2.788 -18.371  -2.108
  198    H    TRP  26           HN       TRP  26   2.078 -14.596  -4.192
  199    HA   TRP  26           HA       TRP  26   2.940 -13.562  -6.795
  200    HB2  TRP  26           HB2      TRP  26   0.837 -12.701  -4.806
  201    HB3  TRP  26           HB1      TRP  26   1.225 -11.778  -6.254
  202    HD1  TRP  26           HD1      TRP  26   1.604 -15.422  -6.892
  203    HE1  TRP  26           HE1      TRP  26  -0.396 -16.305  -8.228
  204    HE3  TRP  26           HE3      TRP  26  -1.585 -11.478  -6.429
  205    HZ2  TRP  26           HZ2      TRP  26  -3.009 -15.463  -9.007
  206    HZ3  TRP  26           HZ3      TRP  26  -3.831 -11.537  -7.476
  207    HH2  TRP  26           HH2      TRP  26  -4.547 -13.531  -8.764
  208    H    ALA  27           HN       ALA  27   4.310 -11.947  -7.083
  209    HA   ALA  27           HA       ALA  27   6.009 -11.100  -5.032
  210    HB1  ALA  27           HB1      ALA  27   6.768  -9.395  -6.612
  211    HB2  ALA  27           HB2      ALA  27   5.346  -9.670  -7.619
  212    HB3  ALA  27           HB3      ALA  27   6.560 -10.938  -7.440
  213    H    PHE  28           HN       PHE  28   5.994  -9.350  -3.707
  214    HA   PHE  28           HA       PHE  28   3.420  -8.167  -3.162
  215    HB2  PHE  28           HB2      PHE  28   5.200  -8.878  -1.475
  216    HB3  PHE  28           HB1      PHE  28   6.084  -7.436  -1.958
  217    HD1  PHE  28           HD2      PHE  28   4.769  -5.170  -1.878
  218    HD2  PHE  28           HD1      PHE  28   3.564  -8.736   0.194
  219    HE1  PHE  28           HE2      PHE  28   3.381  -3.810  -0.341
  220    HE2  PHE  28           HE1      PHE  28   2.185  -7.374   1.733
  221    HZ   PHE  28           HZ       PHE  28   2.091  -4.912   1.466
  222    H    CYS  29           HN       CYS  29   2.766  -6.715  -4.627
  223    HA   CYS  29           HA       CYS  29   4.655  -4.768  -5.745
  224    HB2  CYS  29           HB2      CYS  29   3.047  -5.991  -7.212
  225    HB3  CYS  29           HB1      CYS  29   1.725  -5.179  -6.370
  226    HG   CYS  29           HG       CYS  29   3.739  -3.148  -7.390
  227    H    CYS  30           HN       CYS  30   4.688  -2.656  -5.221
  228    HA   CYS  30           HA       CYS  30   2.534  -1.154  -4.206
  229    HB2  CYS  30           HB2      CYS  30   4.167  -2.616  -2.201
  230    HB3  CYS  30           HB1      CYS  30   3.885  -0.915  -1.840
  231    HG   CYS  30           HG       CYS  30   1.761  -3.122  -1.799